Information card for entry 2211013

Structure parameters

• Chemical name: Poly[[(4,7-diphenyl-1,10-phenanthroline)zinc(II)]-μ-benzene-1,3-dicarboxylato] monohydrate]
• Formula: C32 H22 N2 O5 Zn
• Calculated formula: C32 H22 N2 O5 Zn
• Title of publication: Poly[[[(4,7-diphenyl-1,10-phenanthroline)zinc(II)]-μ-benzene-1,3-dicarboxylato] monohydrate]
• Authors of publication: Li, Xiu-Mei; Wang, Qing-Wei; Liu, Bo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: m2813 - m2815
• a: 11.4746 ± 0.0016 Å
• b: 12.5849 ± 0.0017 Å
• c: 17.284 ± 0.002 Å
• α: 90°
• β: 96.647 ± 0.002°
• γ: 90°
• Cell volume: 2479.1 ± 0.6 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0401
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes