Information card for entry 2201290

Structure parameters

• Chemical name: {N-[tert-Butyl(phenyl)phosphino]-N'-diphenylphosphino-N,N'-dimethylurea- P,P'}dichloroplatinum(II) chloroform solvate
• Formula: C26 H31 Cl5 N2 O P2 Pt
• Calculated formula: C26 H31 Cl5 N2 O P2 Pt
• SMILES: [Pt]1(Cl)(Cl)[P](N(C)C(=O)N([P]1(c1ccccc1)c1ccccc1)C)(C(C)(C)C)c1ccccc1.C(Cl)(Cl)Cl
• Title of publication: {<i>N</i>-[<i>tert</i>-Butyl(phenyl)phosphino]-<i>N</i>'-diphenylphosphino-<i>N</i>,<i>N</i>'-dimethylurea-<i>P</i>,<i>P</i>'}dichloroplatinum(II) chloroform solvate
• Authors of publication: Jones, Peter G.; Schmutzler, Reinhard; Vogt, Roland
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: m476 - m477
• a: 16.38 ± 0.004 Å
• b: 15.653 ± 0.003 Å
• c: 24.074 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6172 ± 2 ų
• Cell temperature: 178 ± 2 K
• Ambient diffraction temperature: 178 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0866
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes