Information card for entry 7117241

Structure parameters

• Formula: C26 H30 Cl3 N3 Pt
• Calculated formula: C26 H30 Cl3 N3 Pt
• SMILES: [Pt](Cl)(Cl)(Cl)[n]1ccccc1.n1(c[n+](cc1)c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C
• Title of publication: Two-step solid-state synthesis of PEPPSI-type compounds
• Authors of publication: Christopher J. Adams; Matteo Lusi; Emily M. Mutambi; A. Guy Orpen
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 9632
• a: 35.0384 ± 0.0012 Å
• b: 9.1217 ± 0.0003 Å
• c: 16.6331 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5316.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0576
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1018
• Weighted residual factors for all reflections included in the refinement: 0.1076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No