Information card for entry 2213812

Structure parameters

• Chemical name: [1-(Diphenylphosphino)-2-(diphenylphosphinoyl)ethane-κP^1^]iodido(1,10- phenanthroline-κ^2^N,N')copper(I) dichloromethane solvate
• Formula: C39 H34 Cl2 Cu I N2 O P2
• Calculated formula: C39 H34 Cl2 Cu I N2 O P2
• SMILES: I[Cu]1([P](c2ccccc2)(c2ccccc2)CCP(=O)(c2ccccc2)c2ccccc2)[n]2cccc3ccc4ccc[n]1c4c23.ClCCl
• Title of publication: [1-(Diphenylphosphino)-2-(diphenylphosphinoyl)ethane-κ<i>P</i>^1^]iodido(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I) dichloromethane solvate
• Authors of publication: Xiao-Lin Zhang; Wen-Hong Wu; Qian-Yong Cao; Yong-Xiu Li; Lai-Tao Luo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1602 - m1603
• a: 11.1843 ± 0.0004 Å
• b: 12.1788 ± 0.0005 Å
• c: 15.0143 ± 0.0005 Å
• α: 73.457 ± 0.001°
• β: 83.292 ± 0.001°
• γ: 74.132 ± 0.002°
• Cell volume: 1884.07 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.1599
• Weighted residual factors for all reflections included in the refinement: 0.1668
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes