Information card for entry 7005812

Structure parameters

• Formula: C23 H17 Cl5 N2 Pt
• Calculated formula: C23 H17 Cl5 N2 Pt
• SMILES: [Pt]12(Cl)(Cl)([n]3ccccc3c3ccccc13)[n]1ccccc1c1ccccc21.ClC(Cl)Cl
• Title of publication: Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).
• Authors of publication: Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 29
• Pages of publication: 3170 - 3182
• a: 9.5988 ± 0.0004 Å
• b: 11.0181 ± 0.0005 Å
• c: 12.4407 ± 0.0005 Å
• α: 81.338 ± 0.001°
• β: 79.253 ± 0.001°
• γ: 64.686 ± 0.001°
• Cell volume: 1164.81 ± 0.09 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0427
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.0757
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No