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July 2019 issue
metal-organic compounds
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A cadmium 2-(carboxymethoxy)benzoate (cmb) ribbon-like coordination polymer, [Cd2(cmb)2(H2O)2)]n, was isolated and structurally characterized by single-crystal X-ray diffraction. Inter-ribbon O—H⋯O hydrogen-bonding interactions construct supramolecular layers, while π–π interactions form the full crystal structure of the title complex.
CCDC reference: 1937965
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The synthesis and crystal structure of the title N,N′-disubstituted imidazol-2-ylidene palladium(II) complex is presented.
CCDC reference: 1935988
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A cadmium 3-(4-carboxyphenyl)propionate (cpp) zigzag chain coordination polymer, [Cd(cpp)(H2O)2)]n, was isolated and structurally characterized by single-crystal X-ray diffraction. O–H⋯O Hydrogen bonding interactions involving the bound water molecules form the full crystal structure of the title compound.
CCDC reference: 1940078
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The ZnII site in the title compound is located on a centre of inversion and shows a distorted octahedral coordination by six O atoms from symmetry-related dimethylsulfoxide and chelating 3-nitrobenzohydroxamato ligands.
CCDC reference: 1940726
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The complex (2,2-bipyridine-κ2N,N′)chlorido[η6-1-methyl-4-(propan-2-yl)benzene]ruthenium tetraphenylborate was prepared by the reaction of the dichlorido[1-methyl-4-(propan-2-yl)benzene]ruthenium(II) dimer with 2,2′-bipyridine, followed by the addition of ammonium tetraphenylborate.
CCDC reference: 1940325
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A zinc 4-(carboxymethyl)benzoate (4-cmb) three-dimensional coordination polymer, [Zn(4-cmb)]n, was isolated and structurally characterized by single-crystal X-ray diffraction.
CCDC reference: 1940757
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The PdII ion has an N4 square-planar coordination sphere defined by a tetradentate 1,4,8,11-tetraazacyclotetradecane ligand.
CCDC reference: 1941633
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The central NiII ion has an N4O2 octahedral coordination sphere defined by two tridentate ligands: 2,2′:6′,2"-terpyridine and pyridine-2,6-dicarboxylate anion.
CCDC reference: 1941852
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Solid-state structural analysis of 1-(2,4,6-trimethylphenyl)-3-(benzyl)imidazole-2-silver(I) acetate reveals that the molecule resides on an inversion center so that half of the molecule is crystallographically unique. The binuclear complex molecules display strong C—H⋯π interactions and strong π–π stacking interactions.
CCDC reference: 1940243
organic compounds
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The title compound is not isostructural with other Ph3SiX (X = F, Cl or Br) compounds.
CCDC reference: 1938347
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The crystal structure of the synthetic psychedelic MPT is reported. The molecules are linked together in chains through N—H⋯N hydrogen bonds.
CCDC reference: 1938495
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In the title compound, the dihydropyrimidine ring adopts a shallow-boat conformation and the dihedral angle between its plane and that of the phenyl ring is 81.91 (17)°.
CCDC reference: 1835185
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The asymmetric unit of bis(2-methyllactato)borate tetrahydrate comprises half a bis(2-methyllactato)borate molecule and two water molecules.
CCDC reference: 1939448
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The present low-temperature crystal structure analysis of the title compound, a synthetic derivative of sucrose, enabled the absolute configuration to be determined by resonant scattering.
CCDC reference: 1862300
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The asymmetric unit comprises an n-decyl chain bound to a trimethylammonium group at one end with a bromide counter-ion to balance the charge. The bromide anions and the trimethylammonium cations form layers spaced by inter-digitated n-decyl chains, which adopt approximately all-trans conformations.
CCDC reference: 1937243
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The crystal structure of the title indanone derivative features supramolecular chains formed through O—H⋯O=C hydrogen bonds.
CCDC reference: 1937942
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The asymmetric unit of the title sulfodiimide, C22H22N2OS, consists of two crystallographically independent molecules, the structures of which are almost the same.
CCDC reference: 1452478
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The structure of the benzene solvate of 1,2,4,5-tetrachloro-3,6-diiodobenzene is reported. The crystal is stabilized by C—I⋯π interactions.
CCDC reference: 1940085
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The dihedral angle between the phenanthroline ring system and the nitro group is 23.75 (14)°. The molecule features intramolecular N—H⋯O and C—H⋯O hydrogen bonds. In the crystal, N—H⋯(N,N), C—H⋯N and C—H⋯O hydrogen bonds link the molecules into [100] chains.
CCDC reference: 1940842
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The complete molecule of the title compound is generated by a crystallographic twofold axis.
CCDC reference: 1940426
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The title compound is an intermediate in the synthesis of the anti-HIV drug efavirenz. Its crystal structure is consolidated by N—H⋯F and N—H⋯O hydrogen bonds, which generate [010] chains.
CCDC reference: 1810647
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In the title compound, weak N—H⋯N hydrogen bonds link the molecules into [100] chains.
CCDC reference: 1941535
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In the title compound the dihedral angle between the aromatic rings is 77.79 (8)°. Inversion dimers linked by pairs of N—H⋯N hydrogen bonds feature in the crystal structure.
CCDC reference: 1912193
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The synthesis, characterization and the crystal structure (molecular, crystal packing and crystal supramolecularity) of 3-(2,5-dichlorothiophen-3-yl)-4,5-dihydro-5-(2,4-dimethoxyphenyl)-1-methyl-1H-pyrazole are discussed.
CCDC reference: 1906405
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The title compound C31H30O6 contains a bridging dioxepine unit which hinders the rotation around the 2,2′-internaphthyl bond.
CCDC reference: 1940900
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In the title molecule, the configuration around the sulfur atom is a slightly distorted tetrahedral geometry with two S—N bonds and two S—C bonds.
CCDC reference: 1449252