Information card for entry 2007500

Structure parameters

• Chemical name: Iodo (1,10-Phenathroline-N,N')(Triphenylphosphine) Copper(I)
• Formula: C30 H23 Cu I N2 P
• Calculated formula: C30 H23 Cu I N2 P
• SMILES: I[Cu]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)[n]2cccc3ccc4ccc[n]1c4c23
• Title of publication: Iodo(1,10-phenanthroline-<i>N</i>,<i>N</i>')(triphenylphosphine)copper(I)
• Authors of publication: Jin, Qiong-Hua; Xin, Xiu-Lan; Dong, Cheng-Jun; Zhu, Hui-Ju
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 1087 - 1089
• a: 10.128 ± 0.002 Å
• b: 10.599 ± 0.002 Å
• c: 12.784 ± 0.004 Å
• α: 86.75 ± 0.02°
• β: 86.35 ± 0.02°
• γ: 79.079 ± 0.009°
• Cell volume: 1343.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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 significantly intense reflections: 0.0312
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No