Information card for entry 2213975

Structure parameters

• Chemical name: (Isoquinoline-2κ<i>N</i>)bis[μ-1-(2-oxidobenzylidene)-4- phenylthiosemicarbazonato]-1:2κ^4^S,N,O:O;1:2κ^4^O:O,N,S-(quinoline- 1κ<i>N</i>)dizinc(II) hemiquinoline hemiisoquinoline solvate
• Formula: C55 H43 N9 O2 S2 Zn2
• Calculated formula: C55 H43 N9 O2 S2 Zn2
• Title of publication: (Isoquinoline-2κ<i>N</i>)bis[μ-1-(2-oxidobenzylidene)-4-phenylthiosemicarbazonato]-1:2κ^4^<i>S</i>,<i>N</i>,<i>O</i>:<i>O</i>;1:2κ^4^<i>O</i>:<i>O</i>,<i>N</i>,<i>S</i>-(quinoline-1κ<i>N</i>)dizinc(II) hemiquinoline hemiisoquinoline solvate
• Authors of publication: Deng, Zhao-Peng; Gao, Shan; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1650 - m1650
• a: 11.1001 ± 0.0002 Å
• b: 21.208 ± 0.0005 Å
• c: 21.6944 ± 0.0005 Å
• α: 103.568 ± 0.0008°
• β: 90.1886 ± 0.0007°
• γ: 91.6505 ± 0.0008°
• Cell volume: 4962.25 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.086
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.177
• Weighted residual factors for all reflections included in the refinement: 0.205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes