Information card for entry 1529310

Structure parameters

• Chemical name: 2-2, 18-18-doubly Pt(II)-bridged Ni(II) diporphyrin
• Formula: C147.31 H169.64 Cl21.9 N8 Ni2 Pt2
• Calculated formula: C147.31 H169.635 Cl21.9 N8 Ni2 Pt2
• Title of publication: Singly and doubly β-to-β platinum-bridged porphyrin dimers and their reductive eliminations
• Authors of publication: Jiang, Hua-Wei; Tanaka, Takayuki; Osuka, Atsuhiro
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 11
• Pages of publication: 6102
• a: 19.4832 ± 0.001 Å
• b: 20.2466 ± 0.0016 Å
• c: 21.267 ± 0.003 Å
• α: 86.76 ± 0.02°
• β: 81.4 ± 0.02°
• γ: 67.434 ± 0.011°
• Cell volume: 7659.8 ± 1.5 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1561
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No