Information card for entry 7207962

Structure parameters

• Formula: C44 H31 N6 Ni O7
• Calculated formula: C44 H31 N6 Ni O7
• Title of publication: Nickel coordination polymers with {48.62} and bnn topologies constructed from common square-pyramidal 5-connected nodes
• Authors of publication: Ke, Chun-Hung; Lee, Hon Man
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 12
• Pages of publication: 4157
• a: 11.1502 ± 0.0003 Å
• b: 13.5449 ± 0.0002 Å
• c: 14.6921 ± 0.0002 Å
• α: 113.808 ± 0.001°
• β: 101.505 ± 0.001°
• γ: 100.238 ± 0.001°
• Cell volume: 1904.99 ± 0.07 ų
• Cell temperature: 151 ± 2 K
• Ambient diffraction temperature: 151 ± 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: 0.0571
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1122
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No