Information card for entry 4334216

Structure parameters

• Chemical name: nickel (0) nitrosyl iodide bipyridine
• Formula: C10 H8 I N3 Ni O
• Calculated formula: C10 H8 I N3 Ni O
• SMILES: c1c[n]2[Ni](I)(N=O)[n]3c(c2cc1)cccc3
• Title of publication: Nitric Oxide Release from a Nickel Nitrosyl Complex Induced by One-Electron Oxidation
• Authors of publication: Ashley M. Wright; Homaira T. Zaman; Guang Wu; Trevor W. Hayton
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 3207 - 3216
• a: 13.9792 ± 0.0009 Å
• b: 11.8611 ± 0.0008 Å
• c: 7.7282 ± 0.0005 Å
• α: 90°
• β: 112.748 ± 0.004°
• γ: 90°
• Cell volume: 1181.73 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0252
• Residual factor for significantly intense reflections: 0.0199
• Weighted residual factors for significantly intense reflections: 0.0442
• Weighted residual factors for all reflections included in the refinement: 0.0456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No