Information card for entry 8103197

Structure parameters

• Formula: C14 H42 Cr N6 Ni O8
• Calculated formula: C14 H42 Cr N6 Ni O8
• Title of publication: Crystal structure of catena-(?2-chromato-O,O')-3,10-bis-n-propyl-1,3,5,8,10,12-hexaazacyclo-tetradecane-nickel(II) tetrahydrate, Ni(C14H34N6)(CrO4) • 4H2O
• Authors of publication: Guang-Chuan Ou; Long-Sheng Zou; Zhi-Hui Yuan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 4
• Pages of publication: 543
• a: 10.507 ± 0.003 Å
• b: 10.72 ± 0.003 Å
• c: 12.222 ± 0.004 Å
• α: 89.232 ± 0.006°
• β: 70.67 ± 0.006°
• γ: 69.433 ± 0.005°
• Cell volume: 1208 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0721
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No