Information card for entry 7106453

Structure parameters

• Formula: C55.5 H72 Br Cl Cu N P2
• Calculated formula: C55.5 H72 Br Cl Cu N P2
• Title of publication: Synthesis and coordination behavior of Cy(I) bis(phosphaethenyl)pyridine complexes.
• Authors of publication: Yumiko Nakajima; Yu Shiraishi; Takahiro Tsuchimoto; Fumiyuki Ozawa
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 6332
• a: 15.9441 ± 0.0002 Å
• b: 9.6494 ± 0.0001 Å
• c: 35.072 ± 0.0007 Å
• α: 90°
• β: 96.2821 ± 0.0008°
• γ: 90°
• Cell volume: 5363.46 ± 0.14 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0969
• Residual factor for significantly intense reflections: 0.0818
• Weighted residual factors for significantly intense reflections: 0.1827
• Weighted residual factors for all reflections included in the refinement: 0.1902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.241
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No