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June 2017 issue
metal-organic compounds
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The distorted tetrahedral coordination geometry about the cobalt(II) metal atom is provided by pairs of O and N atoms. The molecular conformation features weak C—H⋯O hydrogen bonds.
CCDC reference: 1552570
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Crystallization of silver(I) chloride from tetrahydrothiophene (THT) affords the labile dimeric complex [Ag2(μ-Cl)2(THT)4].
CCDC reference: 1482494
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The ReI atom in the cationic complex of the title compound is coordinated in a distorted octahedral fashion by one bidentate 2,2′-bipyrazine ligand, three CO ligands and one monodentate P-bonded bis(diphenylphosphinomethane) ligand.
CCDC reference: 1557877
organic compounds
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Intra- and intermolecular hydrogen bridges control the crystal structure of the title compound.
CCDC reference: 1551877
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The title molecule exhibits point group symmetry Ci.
CCDC reference: 1553273
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In the title dihydropyrimidinone, the 3,4-dihydropyrimidin-2(1H)-one ring displays a screw-boat conformation. The mean plane through this heterocycle is almost perpendicular to the prop-2-ynyl chain and to the benzene ring, with which it makes a dihedral angle of 87.63 (6)°.
CCDC reference: 1553623
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In the title compound, the piperidine ring adopts a chair conformation, and its mean plane is inclined to the benzene ring by 58.5 (3)°.
CCDC reference: 1500603
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In the title compound, the mean planes of the two pyran rings (A and B) are inclined to one another by 69.2 (1)°, while the aromatic ring (D) of the chromene ring system makes dihedral angles of 63.42 (11) and 66.81 (12)° with the pyrimidine (C) and benzene (E) rings, respectively.
CCDC reference: 938663
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In the title molecular salt, the asymmetric unit consists of a 6-amino-3,4-dimethyl-1,2,4-triazin-1-ium cation, a 2-anilinobenzoate anion and a neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecule.
CCDC reference: 1554175
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The acetyl group is only slightly twisted out of the plane of the indazole moiety with its orientation assisted by an intramolecular C—H⋯O hydrogen bonds. In the crystal, C—H⋯O and C—H⋯N hydrogen bonds form layers parallel to (100). These are associated into stacks by head-to-head π-stacking interactions of the indazole units along the a-axis direction.
CCDC reference: 1554341
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The molecular and crystal structure of the title pyrazole–pyrazolone derivative is reported. The crystal structure is stabilized by N—H⋯O, C—H⋯O and C—H⋯π(ring) hydrogen bonds.
CCDC reference: 1554813
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The molecular and crystal structure of the title 4,5-dihydrooxazole–triazole derivative is reported. The crystal packing is stabilized by C—H⋯N hydrogen bonds and C—H⋯π(ring) interactions.
CCDC reference: 1555146
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The chiral sulfamidate crystallizes with two independent molecules in the asymmetric unit.
CCDC reference: 1555404
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The cycloheptane ring of the title compound adopts a chair conformation. In the crystal, the packing is dominated by van der Waals forces.
CCDC reference: 1556094
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The asymmetric unit of the title compound contains three independent molecules with almost identical conformations.
CCDC reference: 1553210
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The molecular and crystal structure of the title oxoindole derivative is reported. π–π stacking together with C—H⋯F hydrogen bonds, stabilize the crystal structure.
CCDC reference: 1556401
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The molecular and crystal structure of the title quinoxaline derivative is reported. The crystal structure is stabilized by C—H⋯O hydrogen bonds and weak π–π stacking interactions.
CCDC reference: 1556425
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In the title compound, C19H13BrClN3, the chlorophenyl ring occupies an equatorial position with respect to the mean plane of the imidazopyridine ring, while the other phenyl ring is twisted by 4.1 (2)° with respect to the mean plane of the imidazopyridine. In the crystal, a weak intermolecular C—H⋯Br interaction links the molecules into dimers.
CCDC reference: 1556392
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The title compound is related to a ditosylated 2-iminobenzothiazole but differs from the latter regarding the arrangement of the phenyl rings.
CCDC reference: 1555243
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The title tetrahydroisoquinoline derivative forms hydrogen-bonded inversion dimers in the crystal, which stack along the b-axis direction. The methyl acetate group attached to the S atom is disordered over two sites in a 50:50 ratio, which appears to prevent close intermolecular contacts between the methyl groups.
CCDC reference: 1555400
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The crystal and molecular structure of the title benzothiazine derivative is reported. The crystal packing is features C—H⋯O hydrogen bonds.
CCDC reference: 1555441
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The title compound is centrosymmetric and the C—Se—Se bond angle is 92.77 (8)°.
CCDC reference: 1555913
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In 1-(1-benzyl-2,5-dimethyl-4-phenyl-1H-pyrrol-3-yl)ethanone, the dihedral angles between the planes of the pyrrole and phenyl rings are 47.04 (5) and 79.27 (3)°.
CCDC reference: 1556327
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The tetramethylpiperidine units of the title compound are in trans position to the P=P axis and the trans bent N—P—P—N skeleton is almost planar.
CCDC reference: 1556525
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The molecular and crystal structure of the title benzimidazolone derivative is reported. The crystal structure features C—H⋯O and C—H⋯N hydrogen bonds.
CCDC reference: 1556697
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The molecular and crystal structure of the title benzothiazine derivative is reported. The crystal structure features C—H⋯O hydrogen bonds and π–π interactions.
CCDC reference: 1556120
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The molecular and crystal structure of the title benzothiazine derivative is reported The crystal structure features C—H⋯π(ring) and weak π–π stacking interactions.
CCDC reference: 1556121
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The title molecule adopts a Z-shaped conformation, with the benzyl and benzodiazole substituents disposed on opposite sides of the plane of the triazole ring. A three-dimensional network is generated in the crystal by a combination of C—H⋯N hydrogen bonds and C—H⋯π(ring) interactions.
CCDC reference: 1558237
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The molecular and crystal structure of the title quinoline derivative is reported. The crystal structure is stabilized by C—H⋯O hydrogen bonds.
CCDC reference: 1556969