Information card for entry 7703308

Structure parameters

• Formula: C58 H59 Cl F6 N Ni2 P5 S3
• Calculated formula: C58 H59 Cl F6 N Ni2 P5 S3
• Title of publication: A bioinspired thiolate-bridged dinickel complex with a pendant amine: synthesis, structure and electrocatalytic properties.
• Authors of publication: Sun, Puhua; Yang, Dawei; Li, Ying; Wang, Baomin; Qu, Jingping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 7
• Pages of publication: 2151 - 2158
• a: 35.436 ± 0.004 Å
• b: 13.4228 ± 0.0015 Å
• c: 24.186 ± 0.003 Å
• α: 90°
• β: 91°
• γ: 90°
• Cell volume: 11502 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• 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: 0.0658
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1575
• Weighted residual factors for all reflections included in the refinement: 0.1653
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No