Information card for entry 4308924

Structure parameters

• Chemical name: P,P'-diphenylmethylenediphosphinate copper(II) Bipyridine aquo
• Formula: C23 H22 Cu N2 O5 P2
• Calculated formula: C23 H22 Cu N2 O5 P2
• SMILES: [Cu]12(OP(=O)(CP(=O)(O1)c1ccccc1)c1ccccc1)([OH2])[n]1c(c3[n]2cccc3)cccc1
• Title of publication: Inorganic-Organic Hybrids Formed by P,P'-Diphenylmethylenediphosphinate, pcp2-, with the Cu2+ Ion. X-ray Crystal Structures of [Cu(pcp)(H2O)2].H2O and [Cu(pcp)(bipy)(H2O)]
• Authors of publication: Samuele Ciattini; Ferdinando Costantino; Pablo Lorenzo-Luis; Stefano Midollini; Annabella Orlandini; Alberto Vacca
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4008 - 4016
• a: 7.135 ± 0.009 Å
• b: 10.87 ± 0.002 Å
• c: 16.271 ± 0.005 Å
• α: 99.26 ± 0.02°
• β: 99.94 ± 0.06°
• γ: 102.1 ± 0.05°
• Cell volume: 1189.7 ± 1.6 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 all reflections: 0.071
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No