Information card for entry 4313443

Structure parameters

• Common name: [Ni3(dpa)4Cl2]2*4toluene*hexane
• Formula: C114 H110 Cl4 N24 Ni6
• Calculated formula: C108.924 H90.556 Cl4 N24 Ni6
• Title of publication: Oxidation of Ni3(dpa)4Cl2 and Cu3(dpa)4Cl2: Nickel-Nickel Bonding Interaction, but No Copper-Copper Bonds
• Authors of publication: John F. Berry; F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Xiaoping Wang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2418 - 2427
• a: 16.991 ± 0.002 Å
• b: 18.211 ± 0.002 Å
• c: 19.138 ± 0.003 Å
• α: 80.277 ± 0.005°
• β: 81.847 ± 0.008°
• γ: 63.449 ± 0.006°
• Cell volume: 5206.3 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No