Information card for entry 7111677

Structure parameters

• Formula: C29 H39 Cl6 N3 Pt
• Calculated formula: C28 H37 Cl4 N3 Pt
• SMILES: [Pt]12(Cl)[n]3ccc(cc3c3cc(cc([n]13)c1cc(cc[n]21)C(C)(C)C)C(C)(C)C)C(C)(C)C.[Cl-].ClCCl
• Title of publication: Platinum(iv)-κ3-terpyridine complexes: synthesis with spectroscopic and structural characterization
• Authors of publication: Baddour, Frederick G.; Kahn, Michael I.; Golen, James A.; Rheingold, Arnold L.; Doerrer, Linda H.
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 27
• Pages of publication: 4968 - 4970
• a: 12.6476 ± 0.0008 Å
• b: 18.6217 ± 0.0012 Å
• c: 14.8974 ± 0.001 Å
• α: 90°
• β: 104.101 ± 0.001°
• γ: 90°
• Cell volume: 3402.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1402
• Weighted residual factors for all reflections included in the refinement: 0.1437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No