Information card for entry 8107047

Structure parameters

• Formula: C22 H19 N2 O4 Zn
• Calculated formula: C22 H19 N2 O4 Zn
• Title of publication: Crystal structure of bis(μ3-isophthalato-κ 3 O:O′:O′′)(μ2-1,4-\ bis((2-propyl-1H-benzo[d]imidazol-1-yl)methyl)benzene-κ2 N:N′)dizinc(II), C22H19N2O4Zn
• Authors of publication: Xu, Chunying; Liu, Lu; Su, Tong; Li, Shenshen
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 3
• Pages of publication: 913 - 915
• a: 8.7451 ± 0.0017 Å
• b: 8.9609 ± 0.0018 Å
• c: 12.81 ± 0.003 Å
• α: 80.31 ± 0.03°
• β: 82.66 ± 0.03°
• γ: 69.9 ± 0.03°
• Cell volume: 926.6 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0737
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No