Information card for entry 7207963

Structure parameters

• Formula: C76 H56 N12 Ni2 O17 S2
• Calculated formula: C76 H56 N12 Ni2 O17 S2
• 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: 9.2237 ± 0.0018 Å
• b: 11.182 ± 0.002 Å
• c: 19.434 ± 0.005 Å
• α: 99.623 ± 0.018°
• β: 94.382 ± 0.019°
• γ: 114.218 ± 0.012°
• Cell volume: 1778.7 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1226
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.129
• Weighted residual factors for all reflections included in the refinement: 0.1592
• Goodness-of-fit parameter for all reflections included in the refinement: 0.938
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No