Information card for entry 7041244

Structure parameters

• Chemical name: Dichlorido(2-(diphenylphosphanyl)-1-{[2-(diphenylphosphanyl)-1H-imidazole]methyl}-1H-imidazole-κ^2^<i>P,P'</i>)platinum(II)
• Formula: C31 H26 Cl2 N4 P2 Pt
• Calculated formula: C31 H26 Cl2 N4 P2 Pt
• SMILES: [Pt]1(Cl)(Cl)[P](c2ccccc2)(c2ccccc2)c2nccn2Cn2ccnc2[P]1(c1ccccc1)c1ccccc1
• Title of publication: Coordination of bis(azol-1-yl)methane-based bisphosphines towards Ru(II), Rh(I), Pd(II) and Pt(II): synthesis, structural and catalytic studies.
• Authors of publication: Bhat, Sajad A.; Pandey, Madhusudan K.; Mague, Joel T.; Balakrishna, Maravanji S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 46
• Journal issue: 1
• Pages of publication: 227 - 241
• a: 12.0662 ± 0.0008 Å
• b: 18.1114 ± 0.0012 Å
• c: 13.1999 ± 0.0009 Å
• α: 90°
• β: 92.314 ± 0.001°
• γ: 90°
• Cell volume: 2882.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0272
• Residual factor for significantly intense reflections: 0.0221
• Weighted residual factors for significantly intense reflections: 0.0499
• Weighted residual factors for all reflections included in the refinement: 0.0523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No