Information card for entry 8106677

Structure parameters

• Formula: C36 H29 Cu I N2 O3 P
• Calculated formula: C36 H29 Cu I N2 O3 P
• Title of publication: Crystal structure of di-μ-iodido-bis(6-(p-tolyl)-2,2′-bipyridine-κ2 N,N′)dicopper(I) — 2-(diphenylphosphoryl)benzoic acid (1/2), C36H29CuIN2O3P
• Authors of publication: Yang, Shengyun; Yao, Gang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 5
• Pages of publication: 783 - 784
• a: 9.4713 ± 0.0003 Å
• b: 11.8586 ± 0.0004 Å
• c: 14.7597 ± 0.0005 Å
• α: 93.525 ± 0.001°
• β: 90.61°
• γ: 108.99°
• Cell volume: 1563.74 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0661
• Weighted residual factors for all reflections included in the refinement: 0.0688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No