Information card for entry 8102861

Structure parameters

• Chemical name: nitronyl nitroxide nickel
• Formula: C30 H46 Cl2 N8 Ni O16
• Calculated formula: C30 H46 Cl2 N8 Ni O16
• Title of publication: Crystal structure of diaquabis[2-{2'-[(l'-methyl)benzimidazolyl]}-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide]nickel(II) bisperchlorate dihydrate, [Ni(H2O)2(C15H19N4O2)2][ClO4]2 · 2H2O
• Authors of publication: Feng-Yang Ju; Li Yang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 4
• Pages of publication: 765
• a: 13.958 ± 0.003 Å
• b: 15.904 ± 0.004 Å
• c: 18.514 ± 0.005 Å
• α: 90°
• β: 101.047 ± 0.003°
• γ: 90°
• Cell volume: 4033.7 ± 1.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1433
• Weighted residual factors for all reflections included in the refinement: 0.1535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No