Information card for entry 4316115

Structure parameters

• Formula: C36 H37 Cl2 N6 Ni O6.5
• Calculated formula: C36 H24 Cl2 N6 Ni O6.5
• Title of publication: Expanding Monomeric Pyrophosphate Complexes beyond Platinum
• Authors of publication: Nadia Marino; Anthony R. Vortherms; Amanda E. Hoffman; Robert P. Doyle
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 6790 - 6792
• a: 23.416 ± 0.002 Å
• b: 21.3012 ± 0.0017 Å
• c: 15.4121 ± 0.0012 Å
• α: 90°
• β: 108.133 ± 0.002°
• γ: 90°
• Cell volume: 7305.6 ± 1 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 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: 0.1209
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for significantly intense reflections: 0.2193
• Weighted residual factors for all reflections included in the refinement: 0.2558
• Goodness-of-fit parameter for all reflections included in the refinement: 0.977
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No