Information card for entry 4342757

Structure parameters

• Common name: Ni-btm-SCN
• Formula: C12 H14 N14 Ni O S2
• Calculated formula: C12 H14 N14 Ni O S2
• Title of publication: Cobalt(II) Coordination Polymer Exhibiting Single-Ion-Magnet-Type Field-Induced Slow Relaxation Behavior.
• Authors of publication: Zhu, Yuan-Yuan; Zhu, Ming-Sheng; Yin, Ting-Ting; Meng, Yin-Shan; Wu, Zong-Quan; Zhang, Yi-Quan; Gao, Song
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 3716 - 3718
• a: 12.747 ± 0.003 Å
• b: 9.52 ± 0.002 Å
• c: 17.42 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2113.9 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1502
• Weighted residual factors for all reflections included in the refinement: 0.155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.389
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No