Information card for entry 4301630

Structure parameters

• Formula: C68 H53 Ni2 O3 P2 S2
• Calculated formula: C68.01 H53 Ni2 O3.01 P2 S2
• Title of publication: Synthesis and Reactions of Mono- and Dinuclear Ni(I) Thiolate Complexes
• Authors of publication: Mikinao Ito; Tsuyoshi Matsumoto; Kazuyuki Tatsumi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 2215 - 2223
• a: 12.976 ± 0.0014 Å
• b: 23.768 ± 0.003 Å
• c: 19.638 ± 0.002 Å
• α: 90°
• β: 97.176 ± 0.0011°
• γ: 90°
• Cell volume: 6009.2 ± 1.2 ų
• Cell temperature: 173.1 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 significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.1402
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No