Information card for entry 7216850

Structure parameters

• Formula: C126 H108 N10 Ni4 O29
• Calculated formula: C126 H98 N10 Ni4 O29
• Title of publication: Ligand geometry-directed assembly of seven entangled coordination polymers
• Authors of publication: Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 28
• Pages of publication: 6354
• a: 11.624 ± 0.002 Å
• b: 13.395 ± 0.003 Å
• c: 21.378 ± 0.004 Å
• α: 108.23 ± 0.03°
• β: 96.32 ± 0.03°
• γ: 103.03 ± 0.03°
• Cell volume: 3020.9 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.116
• Residual factor for significantly intense reflections: 0.0848
• Weighted residual factors for significantly intense reflections: 0.2499
• Weighted residual factors for all reflections included in the refinement: 0.2634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No