Information card for entry 4104447

Structure parameters

• Formula: C63 H54 Cl3 N3 O3.5 P
• Calculated formula: C63 H54 Cl3 N3 O3.5 P
• Title of publication: Organocopper(II) Complex of 21-Diphenylphosphoryl-Carbaporpholactone Hybrid: A Side-On Coordination Mode of Copper(II)
• Authors of publication: Norbert Grzegorzek; Miłosz Pawlicki; Ludmiła Szterenberg; Lechosław Latos-Grażyński
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 7224 - 7225
• a: 16.573 ± 0.003 Å
• b: 18.521 ± 0.004 Å
• c: 19.981 ± 0.004 Å
• α: 105.37 ± 0.03°
• β: 90.18 ± 0.03°
• γ: 94.18 ± 0.03°
• Cell volume: 5896 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1566
• Residual factor for significantly intense reflections: 0.0977
• Weighted residual factors for significantly intense reflections: 0.259
• Weighted residual factors for all reflections included in the refinement: 0.2938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No