Information card for entry 2213176

Structure parameters

• Chemical name: [N,N'-Bis(pyrrol-2-ylmethylene)cyclohexane-1,2-diaminato-κ^4^N]nickel(II)
• Formula: C16 H18 N4 Ni
• Calculated formula: C16 H18 N4 Ni
• Title of publication: [<i>N</i>,<i>N</i>'-Bis(pyrrol-2-ylmethylene)cyclohexane-1,2-diaminato-κ^4^<i>N</i>]nickel(II)
• Authors of publication: Chen, Jia-Mei; Ruan, Wen-Juan; Gao, Feng; Zhang, Ying-Hui; Zhu, Zhi-Ang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1546 - m1546
• a: 21.379 ± 0.003 Å
• b: 8.6247 ± 0.001 Å
• c: 17.475 ± 0.002 Å
• α: 90°
• β: 111.697 ± 0.002°
• γ: 90°
• Cell volume: 2993.9 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0957
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.1247
• Weighted residual factors for all reflections included in the refinement: 0.1358
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes