Information card for entry 7219263

Structure parameters

• Formula: C20 H12 N Ni O5
• Calculated formula: C20 H12 N Ni O5
• Title of publication: Peculiar phenomena of structural transformations triggered from a nickel coordination polymer
• Authors of publication: Kang, Meng; Yang, Guo-Ping; Hou, Lei; Wu, Wei-Ping; Wu, Yun-Long; Wang, Yao-Yu
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 8
• Pages of publication: 1839
• a: 9.406 ± 0.004 Å
• b: 9.512 ± 0.003 Å
• c: 11.655 ± 0.004 Å
• α: 75.58 ± 0.006°
• β: 80.947 ± 0.006°
• γ: 66.329 ± 0.006°
• Cell volume: 923 ± 0.6 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: 0.118
• Residual factor for significantly intense reflections: 0.0874
• Weighted residual factors for significantly intense reflections: 0.3104
• Weighted residual factors for all reflections included in the refinement: 0.3773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No