Chemistry
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Synform issue 2010/4
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Synthesis 2010; 2010: A33-A38DOI: 10.1055/s-0029-1219633© Georg Thieme Verlag, Rüdigerstr. 14, 70469 Stuttgart, Germany. All rights reserved. This journal, including all individual contributions and illustrations published therein, is legally protected by copyright for the duration of the copyright period. Any use, exploitation or commercialization outside the narrow limits set by copyright legislation, without the publisher's consent, is illegal and liable to criminal prosecution. This applies in particular to photostat reproduction, copying, cyclostyling, mimeographing or duplication of any kind, translating, preparati...
Source: Synthesis - March 20, 2010 Category: Chemistry Tags: synform Source Type: journals
Selective Synthesis of Allenes and Alkynes through Ligand-Controlled, Palladium-Catalyzed Decarboxylative Hydrogenolysis of Propargylic Formates
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Organic Letters, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Organic Letters)
Source: Organic Letters - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
(Py)2Co(CH2SiMe3)2 As an Easily Accessible Source of “CoR2”
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Organometallics, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Organometallics)
Source: Organometallics - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Structure of the Ethylammonium Nitrate Surface: An X-ray Reflectivity and Vibrational Sum Frequency Spectroscopy Study
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Langmuir, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Langmuir)
Source: Langmuir - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Erratum: Length-Dependent Optical Effects in Single Walled Carbon Nanotubes
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The Journal of Physical Chemistry B, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Journal of Physical Chemistry B)
Source: Journal of Physical Chemistry B - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Modeling the Rovibrationally Excited C2H4OH Radicals from the Photodissociation of 2-Bromoethanol at 193 nm
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The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Journal of Physical Chemistry A)
Source: Journal of Physical Chemistry A - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Zinc Chloride Promoted Formal Oxidative Coupling of Aromatic Aldehydes and Isocyanides to α-Ketoamides
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The Journal of Organic Chemistry, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: The Journal of Organic Chemistry)
Source: The Journal of Organic Chemistry - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
(1S)-1,5-Anhydro-1-[5-(4-ethoxybenzyl)-2-methoxy-4-methylphenyl]-1-thio-d-glucitol (TS-071) is a Potent, Selective Sodium-Dependent Glucose Cotransporter 2 (SGLT2) Inhibitor for Type 2 Diabetes Treatment
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Journal of Medicinal Chemistry, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Journal of Medicinal Chemistry)
Source: Journal of Medicinal Chemistry - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Bonding in Classical and Nonclassical Transition Metal Carbonyls: The Interacting Quantum Atoms Perspective
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Journal of Chemical Theory and Computation, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Journal of Chemical Theory and Computation)
Source: Journal of Chemical Theory and Computation - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Enantioselective Alkenylation via Nickel-Catalyzed Cross-Coupling with Organozirconium Reagents
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Journal of the American Chemical Society, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Journal of the American Chemical Society)
Source: Journal of the American Chemical Society - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Synthesis, Structure, and Electrochemistry of the Dicluster Molecular Pincer [Pt3(μ-PBut2)3(CO)2]2(μ-1′,1′′′-diethynylbiferrocene)
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Inorganic Chemistry, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Inorganic Chemistry)
Source: Inorganic Chemistry - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Erratum: Transition Metal-Catalyzed Direct Arylation of Substrates with Activated sp3-Hybridized C−H Bonds and Some of Their Synthetic Equivalents with Aryl Halides or Pseudohalides
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Chemical Reviews, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Chemical Reviews)
Source: Chemical Reviews - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
Kinetics of Chemical Degradation in Monoclonal Antibodies: Relationship between Rates at the Molecular and Peptide Levels
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Analytical Chemistry, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable). (Source: Analytical Chemistry)
Source: Analytical Chemistry - March 20, 2010 Category: Chemistry Tags: article Source Type: journals
This Day in Science History - March 20 - Mayer and Conservation of Energy
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March 20th marks the passing of Julius Robert von Mayer. Mayer was a German physician who had a hobby of studying physics. Most of his work centered around how energy was transferred from one form to another. He was one of the first to recognize that plants converted light into chemical energy, and the process of oxidation was the primary source of energy in living creatures. He also outlined the earliest versions of what would become the first law of thermodynamics by writing "Energy is neither created nor destroyed".
He attempted to publish his ideas as conservation of force, but had several basic errors due to his lack ...
Source: About.com Chemistry - March 20, 2010 Category: Chemistry Source Type: consumer
Savannah's Nuclear Bomb
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About.com is holding a meeting in Savannah this weekend so I suspect my coworkers would be interested to know that there is a live nuclear bomb off the Georgia coast. In February 1958 a B-47 bomber on a training mission out of Homestead Air Force Base in Florida had a collision with an F-86. The pilot of the F-86 parachuted to safety and the fighter jet crashed. The B-47 also sustained damage. The crew requested and received permission to jettison the 7,600 pound Mark 15 bomb it was carrying so that the aircraft could more safely land at Hunter Air Force Base. The bomb was lost somewhere in Wassaw Sound off the shores of T...
Source: About.com Chemistry - March 20, 2010 Category: Chemistry Source Type: consumer
4-Iodoanilinium perchlorate
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In the crystal structure of the title compound, C6H7IN+·ClO4−, the ions are connected in a three-dimensional hydrogen-bonded network via N—H...O hydrogen bonds. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: SiMa, W. Tags: organic compounds Source Type: journals
3-(1,3-Benzodioxol-5-yl)-3H-benzo[f]isobenzofuran-1-one
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In the title compound, C19H12O4, the dioxole ring adopts a flattened envelope conformation with the methylene C at the flap [deviation = 0.104 (2) Å]. The benzene ring of the benzodioxole ring system makes a dihedral angle of 76.45 (5)° with the planar [maximum deviation = 0.016 (1) Å] 3H-benzo[f]isobenzofuran-1-one ring system. In the crystal structure, the molecules are linked into C(5) chains running along the b axis by intermolecular C—H...O hydrogen bonds. In addition, C—H...π interactions are observed. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Thenmozhi, S.SubbiahPandi, A.Arulclement, J.MohanaKrishnan, A.K. Tags: organic compounds Source Type: journals
Methyl 3-(4-methoxyphenyl)-1-methyl-1,2,3,3a,4,11b-hexahydrobenzo[f]chromeno[4,3-b]pyrrole-3a-carboxylate
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In the title compound, C25H25NO4, the pyrrolidine ring exhibits an envelope conformation and the tetrahydropyran ring exhibits a half-chair conformation. The crystal structure is stabilized by intermolecular C–H...π interactions. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Thenmozhi, S.SubbiahPandi, A.Kathiravan, S.Raghunathan, R. Tags: organic compounds Source Type: journals
N′-(2-Hydroxy-4-methoxybenzylidene)isonicotinohydrazide
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The title compound, C14H13N3O3, was synthesized by the condensation reaction of 2-hydroxy-4-methoxybenzaldehyde with isonicotinohydrazide in a methanol solution. The molecule of the compound displays a trans configuration with respect to the C=N and C—N bonds. The dihedral angle between the benzene and the pyridine rings is 27.3 (2)°. In the crystal, molecules are linked by N—H...N interactions into zigzag chains with graph-set notation C(7) along [010]. An intramolecular O—H...N hydrogen bond is observed. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Zhi, F.Wang, R. Tags: organic compounds Source Type: journals
N-(2-Chlorophenyl)-3-methylbenzamide
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In the title compound, C14H12ClNO, the N—H bond is anti to the carbonyl bond and the two aromatic rings make a dihedral angle of 5.4 (2)°. In the crystal, intermolecular N—H...O hydrogen bonds connect the molecules into chains running along the b axis. The chains are interconnected through short Cl...Cl contacts [3.279 (1) Å]. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Rodrigues, V.Z.Tokarčík, M.Gowda, B.T.Kožíšek, J. Tags: organic compounds Source Type: journals
11-(2-Oxopyrrolidin-1-ylmethyl)-1,2,3,4,5,6,11,11a-octahydropyrido[2,1-b]quinazolin-6-one dihydrate
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In the crystal structure of the title compound, C17H21N3O2·2H2O, water molecules are mutually O—H...O hydrogen bonded and form infinite chains propagating along the b axis. Neighboring chains are linked by the quinazoline molecules by means of O—H...O=C hydrogen bonds, forming a two–dimensional network. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Samarov, Z.U.Okmanov, R.Y.Turgunov, K.K.Tashkhodjaev, B.Shakhidoyatov, K.M. Tags: organic compounds Source Type: journals
Sodium N,2-dichlorobenzenesulfonamidate sesquihydrate
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In the title compound, Na+·C6H4Cl2NO2S−·1.5H2O, one of the water molecules lies on a twofold axis. There is no interaction between the N atom and the sodium ion. The sodium ion exhibits a pseudo-octahedral coordination defined by three water O atoms and three sulfonyl O atoms from three different anions. The S—N distance of 1.588 (2) Å is consistent with an S=N double bond. The crystal structure is stabilized by O—H...N and O—H...Cl hydrogen bonds. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Gowda, B.T.Foro, S.Shakuntala, K.Fuess, H. Tags: organic compounds Source Type: journals
Ethyl (2E)-2-(hydroxyimino)propanoate
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The molecule of the title compound, C5H9NO3, is essentially planar [the maximum deviation for a non-H atom from the mean plane is 0.021 (3) Å] due to the π-conjugation of the hydroxyimino and carbonyl groups, which are trans to each other; ab initio calculations in vacuo at the DFT (B3LYP/6–311G**++) level of theory confirmed that E conformer is indeed the lowest in energy. The packing in crystal structure is influenced by strong intermolecular O—H...N hydrogen-bonding interactions between oxime groups and also by π-stacking of the molecules due to the carbonyl and oxime group orbital overlap [interplanar distan...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Nikolayenko, I.V.Bazzicalupi, C.Thubron, G.P.Grimmer, C. Tags: organic compounds Source Type: journals
5-Chloro-3-ethylsulfinyl-2-(4-fluorophenyl)-7-methyl-1-benzofuran
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In the title compound, C17H14ClFO2S, the 4-fluorophenyl ring is rotated slightly out of the benzofuran plane, as indicated by the dihedral angle of 8.32 (5)°. The crystal structure features a short Cl...O contact [3.092 (1) Å]. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Choi, H.D.Seo, P.J.Son, B.W.Lee, U. Tags: organic compounds Source Type: journals
3-(3-Chlorobenzoyl)-4-hydroxy-2H-1,2-benzothiazine 1,1-dioxide
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In the title compound, C15H10ClNO4S, the heterocyclic thiazine ring adopts a half-chair conformation with the S and N atoms displaced by 0.476 (5) and 0.227 (5) Å, respectively, on opposite sides of the mean plane formed by the remaining ring atoms. The structure is stabilized by intermolecular N—H...O and C—H...O hydrogen bonds. In addition, intramolecular O—H...O and C—H...N interactions are also present. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Khalid, Z.Siddiqui, H.L.Ahmad, M.Aslam, S.Parvez, M. Tags: organic compounds Source Type: journals
2,2,2-Tribromo-N-(2-methylphenyl)acetamide
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The asymmetric unit of the title compound, C9H8Br3NO, contains two independent molecules. Intramolecular N—H...Br hydrogen bonds are present in both molecules. In the crystal, molecules are packed into columnar chains by intermolecular N—H...O hydrogen bonds. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Gowda, B.T.Foro, S.Suchetan, P.A.Fuess, H. Tags: organic compounds Source Type: journals
(E)-2-[1-(3-Amino-4-chlorophenylimino)ethyl]-4-bromophenol
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The title Schiff base compound, C14H12BrClN2O, exists in an E configuration with respect to the central C=N double bond. The amino group adopts a pyramidal configuration. The dihedral angle between the two benzene rings is 76.88 (10)° and an intramolecular O—H...N hydrogen bond forms a six-membered ring, generating an S(6) ring motif. In the crystal structure, molecules are linked into chains along [010] via N—H...O hydrogen bonds. The presence of π–π interactions [centroid–centroid distance = 3.6244 (12) Å] further stabilizes the crystal structure. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Bahron, H.Bakar, S.N.A.Kassim, K.Yeap, C.S.Fun, H.-K. Tags: organic compounds Source Type: journals
2-[2-(2,6-Dichloroanilino)phenyl]-N-[(2S)-2-methyl-3-oxo-8-phenyl-1-thia-4-azaspiro[4.5]dec-4-yl]acetamide
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In the title compound, C29H29Cl2N3O2S, the phenyl ring is disordered over two orientations with occupancies of 0.55 (3) and 0.45 (3). The molecular packing in the crystal is stabilized by intermolecular N—H...O interactions, linking the molecules into infinite chains along the c axis. In addition, there are weak C—H...S and C—H...π interactions. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Akkurt, M.Nassozi, M.Kocabalkanlı, A.Khan, I.U.Sharif, S. Tags: organic compounds Source Type: journals
N-(2,4-Dimethylphenyl)succinimide
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In the title compound, C12H13NO2, the dihedral angle between the benzene ring and the imide segment is 85.7 (1)°. In the crystal, the molecules are packed into zigzag chains parallel to the a axis. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Saraswathi, B.S.Gowda, B.T.Foro, S.Fuess, H. Tags: organic compounds Source Type: journals
Absolute configuration of isoeichlerialactone
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The title seco-dammarane triterpenoid, C27H42O4 (systematic name: 3-{(3S,3aR,5aR,6S,7S,9aR,9bR)-6,9a,9b-trimethyl-3-[(R)-2-methyl-5-oxotetrahydrofuran-2-yl]-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl}propanoic acid), has been isolated for the first time from the seeds of Aglaia forbesii. The molecule has three fused rings and all rings are in trans-fused. The two cyclohexane rings are in standard chair conformations and the cyclopentane ring adopts an envelope conformation. Its absolute configuration was determined by the refinement of the Flack parameter to 0.26 (17). In the crystal, molecules are lin...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Fun, H.-K.Joycharat, N.Voravuthikunchai, S.P.Chantrapromma, S. Tags: organic compounds Source Type: journals
2-[4-Acetyl-5-(biphenyl-4-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]phenyl acetate
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In the title molecule, C24H20N2O4, the five-membered oxadiazole ring is nearly planar (r.m.s. deviation = 0.053 Å) and the phenyl ring of the biphenyl unit attached to it forms a dihedral angle of 73.2 (1)°; the other phenyl ring is close to coplanar with the oxadiazole ring [dihedral angle = 6.2 (2)°]. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Yehye, W.A.Ariffin, A.Rahman, N.A.Ng, S.W. Tags: organic compounds Source Type: journals
3-Chloro-N-(4-hydroxy-3-methoxybenzyl)-2,2-dimethylpropanamide
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In the molecular structure of the title compound, C13H18ClNO3, the amide group is nearly perpendicular to the benzene ring, making a dihedral angle of 85.66 (9)°. The C=O bond distance of 1.242 (3) Å and the C—N bond distance of 1.333 (3) Å suggest electron delocalization in the amide fragment. Intermolecular O—H...O and N—H...O hydrogen bonding helps to stabilize the crystal structure. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Huang, Y.-L.Wang, W.-L.Shan, S. Tags: organic compounds Source Type: journals
N′-(2,4-Dichlorobenzylidene)-3-methoxybenzohydrazide
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There are two independent molecules in the asymmetric unit of the title compound, C15H12Cl2N2O2. The dihedral angle between the two benzene rings is 27.6 (4)° in one molecule and 16.4 (4)° in the other. Both molecules adopt an E configuration about the C=N bonds. In the crystal structure, molecules are linked through intermolecular N—H...O hydrogen bonds, forming chains in the a-axis direction. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Ren, C.-G. Tags: organic compounds Source Type: journals
(E)-1-(4-Methylphenyl)ethanone [8-(trifluoromethyl)quinolin-4-yl]hydrazone
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In the title compound, C19H16F3N3, the dihedral angle between the naphthalene and quinoline ring systems is 14.58 (8)°. The hydrazone C—N—N=C—C chain is in an extended conformation and its mean plane is nearly coplanar with the quinoline plane [dihedral angle = 3.45 (9)°]. The bond angles within the phenyl ring show the almost additive influence of the two para substituents. In the crystal, weak π–π [centroid–centroid distances = 3.779 (2) and 3.718 (1) Å] and C—H...F directional interactions join the molecules into centrosymmetric dimers, which are further connected into infinite zigzag chains p...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Dutkiewicz, G.Mayekar, A.N.Yathirajan, H.S.Narayana, B.Kubicki, M. Tags: organic compounds Source Type: journals
(8-Bromo-2,7-dimethoxy-1-naphthyl)(4-chlorophenyl)methanone
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In the title compound, C19H14BrClO3, the naphthalene ring system and the benzene ring make a dihedral angle of 77.36 (10)°. The conformation around the central C=O group is such that the C=O bond vector forms a larger angle to the plane of the naphthalene ring system than to the plane of the benzene ring, viz. 75.73 (15)° versus 2.33 (17)°. In the crystal structure, a π–π interaction is formed between naphthalene ring systems, with a centroid–centroid distance of 3.8363 (14) Å and a lateral offset of 1.606 Å. Intermolecular C—H...Br and C—H...O hydrogen bonds and a C—H...π contact are present ...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Mitsui, R.Nagasawa, A.Watanabe, S.Okamoto, A.Yonezawa, N. Tags: organic compounds Source Type: journals
5,11,17,23-Tetrabromo-25,26,27,28-tetrakis(4-tolylsulfonyloxy)-2,8,14,20-tetrathiacalix[4]arene dichloromethane solvate
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In the crystal structure of the title compound, C52H36Br4O12S8·CH2Cl2, the thiacalix[4]arene unit adopts a 1,3-alternate conformation with an intramolecular C—H...O hydrogen bond and four C—H...π interactions, with the four 4-MeC6H4SO3 groups located alternately above and below the virtual plane (R) defined by the four bridging S atoms. The benzene ring of each 4-MeC6H4SO3 unit is nearly perpendicular to one of the two neighboring phenol rings with interplanar angles varying from 72.97 (13) to 78.70 (13)°, while the dihedral angles between the plane (R) and the phenol rings range from 83.04 (7) to 84.30 (9)...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Chen, Y.-F.Liu, Y.Ma, J.-P.Guo, D.-S. Tags: organic compounds Source Type: journals
N′-Benzoyl-N,N-diethylthiourea: a monoclinic polymorph
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In the crystal of the title compound, C12H16N2OS, inversion dimers linked by pairs of N—H...S hydrogen bonds occur, generating R22(8) loops. The molecules are also linked by weak C—H...O hydrogen bonds. The structure is isostructural with that of N′-benzoyl-N,N-diethylselenourea [Bruce et al. (2007). New J. Chem. 31, 1647–1653]. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Gomes, L.R.Santos, L.M.N.B.F.Coutinho, J.P.Schröder, B.Low, J.N. Tags: organic compounds Source Type: journals
N-[4-(N-Cyclohexylsulfamoyl)phenyl]acetamide
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In the title compound, C14H20N2O3S, the cyclohexyl ring adopts a chair conformation: the four coplanar C atoms of this ring make a dihedral angle of 64.8 (2)° with the benzene ring. In the molecule, an intramolecular C—H...O contact generates an S(6) ring motif. In the crystal structure, molecules are linked via intermolecular N—H...O hydrogen bonds into two-dimensional layers propagating in (100). (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Khan, I.U.Akkurt, M.Anwar, F.Sharif, S. Tags: organic compounds Source Type: journals
(E)-5-Benzyl-1-methyl-N-nitro-1,3,5-triazinan-2-imine
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In the title compound, C11H15N5O2, the 1,3,5-triazine ring exhibits a half-chair conformation. An intramolecular N—H...O interaction occurs. In the crystal structure, molecules are connected by intermolecular C—H...O and N—H...N hydrogen bonds, forming a zigzag chain along the b axis. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Xu, L.-Z.Yin, R.-F.Li, H.-X. Tags: organic compounds Source Type: journals
N-Butyl-4-methyl-6-phenylpyrimidin-2-amine
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In the title compound, C15H19N3, the pyrimidine ring is approximately planar [maximum deviation = 0.007 (1) Å] and forms a dihedral angle of 3.15 (6)° with the benzene ring. In the crystal packing, intermolecular N—H...N hydrogen bonds link pairs of neighbouring molecules into dimers with R22(6) ring motifs. These dimers are stacked along the b axis. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Fun, H.-K.Loh, W.-S.Hazra, A.Goswami, S. Tags: organic compounds Source Type: journals
Bis[μ-2,2′-dimethyl-1,1′-(oxydiethylene)bis(1H-benzimidazole)-κ2N3:N3′]bis[bis(4-methoxybenzoato-κ2O,O′)cadmium(II)]
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The title complex, [Cd2(C8H7O3)4(C20H22N4O)2], forms a dimer of the paddle-wheel type, located on a crystallographic inversion centre. The CdII ion is hexacoordinated by four carboxylate O atoms [Cd...O = 2.280 (2)–2.404 (2) Å] from two chelating 4-methoxybenzoate anions, and two N atoms [Cd...N = 2.313 (2) and 2.332 (2) Å] from one chelating 2,2′-dimethyl-3,3′-(oxydiethylene)bis(1H-benzimidazole) ligand. In the crystal, molecules are linked by a weak intermolecular C—H...O hydrogen bond and an intermolecular C—H...π interaction. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Zhao, D.-Y. Tags: metal-organic compounds Source Type: journals
[(Z)-O-Isopropyl N-phenylthiocarbamato-κS](tricyclohexylphosphine-κP)gold(I)
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The Au atom in the title compound, [Au(C10H12NOS)(C18H33P)], is coordinated within an S,P-donor set that defines a slightly distorted linear geometry [S—Au—P = 174.54 (2)°], with the distortion due in part to a close intramolecular Au...O contact [3.1702 (16) Å]. In the crystal structure, molecules are arranged into supramolecular chains along the b axis mediated by C—H...O interactions. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Tadbuppa, P.P.Tiekink, E.R.T. Tags: metal-organic compounds Source Type: journals
(meso-5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene)copper(II) bis[O,O′-bis(4-methylphenyl) dithiophosphate]
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The title compound, [Cu(C16H32N4)](C14H14O2PS2)2 or [Cu(trans[14]dien)][S2P(OC6H4Me-4)2]2, where trans[14]dien is meso-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene, was obtained by the reaction of [Cu(trans[14]dien)](ClO4)2 and [(C2H5)2NH]2 [S2P(OC6H4Me-4)2]2. The CuII atom lies on a centre of inversion and possesses a relatively undistorted square-planar coordination arrangement with four N atoms of the macrocyclic tetramine trans[14]dien [Cu—N = 1.9716 (19) and 2.0075 (19) Å]. The two uncoordinated [(4-MeC6H4O)2PS2]− groups act as counter-ions to balance the charge and interact with the...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: He, L.-X.Zou, L.-K.Xie, B.Xiang, Y.-G.Feng, J.-S. Tags: metal-organic compounds Source Type: journals
catena-Poly[sodium-di-μ-aqua-sodium-bis[μ-2,2,2-trichloro-N-(dimorpholinophosphoryl)acetamide]]
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The title compound, [Na2(C10H16Cl3N3O4P)2(H2O)2]n, can be considered as a two-dimensional coordination polymer in which one-dimensional chains are connected to each other by intermolecular C—H...O hydrogen bonds involving the water molecules. The NaI ion is five-coordinated in a distorted trigonal-bipyramidal geometry. The connection between the two NaI ions is facilitated by the two μ-O atoms of the carbonyl group of the 2,2,2-trichloro-N-(dimorpholinophosphoryl)acetamide (CAPh) ligand. A bridging coordination of the CAPh ligand via the carbonyl O atom is observed for the first time. The bridging water molecules form i...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Litsis, O.O.Ovchynnikov, V.A.Sliva, T.Y.Konovalova, I.S.Amirkhanov, V.M. Tags: metal-organic compounds Source Type: journals
Diacridinium hexachloridoplatinate(IV) dihydrate
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The asymmetric unit of the title compound, (C13H10N)2[PtCl6]·2H2O, contains a protonated acridine cation, one half of a [PtCl6]2− dianionic complex and a solvent water molecule. The octahedral [PtCl6]2− dianion is located on an inversion centre. π–π interactions between neighboring acridinium cations produce stacks along the a axis; the shortest distance between the centroids of the six-membered rings within the cations is 3.553 (9) Å. In the crystal, two independent intermolecular O—H...Cl hydrogen bonds, both involving the same Cl atom of the anion as acceptor, give rise to chains also running along the a...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Ha, K. Tags: metal-organic compounds Source Type: journals
Substitutional disorder in the ionic diorganoantimony halide adduct [bromido/chlorido(0.33/0.67)][2-(dimethylaminomethyl)phenyl][2-(dimethylammoniomethyl)phenyl]antimony(III) 0.75-bromide 0.25-chloride
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The title complex, [SbBr0.33Cl0.67(C9H13N)(C9H12N)]Br0.75Cl0.25, exhibits substitutional disorder of both halogen atoms in the asymmetric unit, however, with different occupancies. Thus, the halogen atom bonded to Sb has 0.67 (4) occupancy for Cl and 0.33 (4) for Br, while the anionic halogen atom shows 0.75 (4) occupancy for Br and 0.25 (4) for Cl. An N—H...Cl/Br hydrogen bond is established between the cation and the halide anion. The coordination geometry of the Sb center in the cation is distorted pseudo-trigonal-bipyramidal as a result of the strong intramolecular N→Sb coordination trans to the Sb—Cl/Br ...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Soran, A.P.Bojan, V.R. Tags: metal-organic compounds Source Type: journals
Hexaaquamagnesium(II) bis[4-(3-ethoxy-2-hydroxybenzylideneamino)-3-methylbenzenesulfonate]
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In the title compound, [Mg(H2O)6](C16H16NO5S)2, the Mg2+ ion (site symmetry 2) adopts an almost regular octahedral coordination geometry. The anion is stabilized by an intramolecular O—H...N hydrogen bond, generating an S(6) ring, and the dihedral angle between the aromatic rings is 41.02 (7)°. In the crystal, the cations and anions are linked by O—H...O hydrogen bonds, generating sheets lying parallel to (100). (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Tai, X.-S.Zhang, F.-G. Tags: metal-organic compounds Source Type: journals
[(Z)-O-Isopropyl N-(m-tolyl)thiocarbamato-κS](tricyclohexylphosphine-κP)gold(I)
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The Au atom in the title compound, [Au(C11H14NOS)(C18H33P)], is coordinated within an S,P-donor set that defines a slightly distorted linear geometry [S—Au—P = 174.73 (3)°], with the distortion due in part to a close intramolecular Au...O contact [3.060 (3) Å]. In the crystal structure, molecules are arranged in layers in the bc plane with the primary connections between the arrays being of the type C—H...π. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Tadbuppa, P.P.Tiekink, E.R.T. Tags: metal-organic compounds Source Type: journals
[(Z)-O-Isopropyl N-(4-chlorophenyl)thiocarbamato-κS](tricyclohexylphosphine-κP)gold(I)
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The Au atom in the title compound, [Au(C10H11ClNOS)(C18H33P)], is coordinated within an S,P-donor set that defines a slightly distorted linear geometry [S—Au—P = 172.45 (5)°], with the distortion due in part to a close intramolecular Au...O contact [3.134 (3) Å]. (Source: Acta Crystallographica Section E)
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Tadbuppa, P.P.Tiekink, E.R.T. Tags: metal-organic compounds Source Type: journals
A new crystal modification of diammonium hydrogen phosphate, (NH4)2(HPO4)
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The addition of hexafluoridophosphate salts (ammonium, silver, thallium or potassium) is usually used to precipitate complex cations from aqueous solutions. It has long been known that PF6− is sensitive towards hydrolysis under acidic conditions [Gebala & Jones (1969). J. Inorg. Nucl. Chem. 31, 771–776; Plakhotnyk et al. (2005). J. Fluorine Chem. 126, 27–31]. During the course of our investigation into coinage metal complexes of diphosphine ligands, we used ammonium hexafluoridophosphate in order to crystallize [Ag(diphosphine)2]PF6 complexes. From these solutions we always obtained needle-like crystals which turned ...
Source: Acta Crystallographica Section E - March 20, 2010 Category: Chemistry Authors: Kunz, P.C.Wetzel, C.Spingler, B. Tags: inorganic compounds Source Type: journals
