Information card for entry 8102724

Structure parameters

• Formula: C12 H34 Cl2 N6 Ni2 O14
• Calculated formula: C12 H34 Cl2 N6 Ni2 O14
• Title of publication: Crystal structure of [bis(diethylenetriamine-N1,N2,N3)]-(m-oxalato-O1,O2:O1',O2')-(dimethanol-O)dinickel(II) diperchlorate, [Ni2(C4H13N3)2(C2O4)(CH3OH)2](ClO4)2
• Authors of publication: Hong Qiang; Yong Hou; Zhi-Yun Dong; Feng-Mei Nie
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 3
• Pages of publication: 447
• a: 7.1239 ± 0.0001 Å
• b: 13.1635 ± 0.0002 Å
• c: 14.22 ± 0.0002 Å
• α: 90°
• β: 98.622 ± 0.001°
• γ: 90°
• Cell volume: 1318.42 ± 0.03 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1674
• Weighted residual factors for all reflections included in the refinement: 0.1753
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No