Information card for entry 8102469

Structure parameters

• Formula: C21 H26 N2 Ni O9
• Calculated formula: C21 H26 N2 Ni O9
• Title of publication: Crystal structure of tetraaqua-(4,4'-bipyridyl)zinc(II) 3-(4-(carboxymethoxy)phenyl)propanoate, [Ni(H2O)4(C10H8N2)][C11H10O5]
• Authors of publication: Yun-Nan Gong; Chong-Bo Liu; De-He Huang; Zhi-Qiang Xiong
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 3
• Pages of publication: 421
• a: 7.0946 ± 0.0005 Å
• b: 7.6046 ± 0.0006 Å
• c: 10.3449 ± 0.0008 Å
• α: 91.811 ± 0.001°
• β: 101.853 ± 0.001°
• γ: 94.38 ± 0.001°
• Cell volume: 543.99 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0304
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.0801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No