Information card for entry 4500365

Structure parameters

• Formula: C70 H73 N14 Nb10 Ni3 O36.5
• Calculated formula: C70 H56 N14 Nb10 Ni3 O36.5
• Title of publication: Zero- or One-Dimensional Organic−Inorganic Hybrid Polyoxoniobates Constructed from Decaniobate Units and Transition-Metal Complexes
• Authors of publication: Niu, Jingyang; Wang, Guan; Zhao, Junwei; Sui, Yunxia; Ma, Pengtao; Wang, Jingping
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 4
• Pages of publication: 1253
• a: 14.139 ± 0.003 Å
• b: 14.16 ± 0.003 Å
• c: 24.201 ± 0.005 Å
• α: 80.884 ± 0.003°
• β: 89.686 ± 0.003°
• γ: 89.727 ± 0.003°
• Cell volume: 4783.9 ± 1.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0553
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No