Information card for entry 4068845

Structure parameters

• Common name: KAG-4-250
• Chemical name: KAG-4-250
• Formula: C15 H27 Cl N P Pt
• Calculated formula: C15 H27 Cl N P Pt
• SMILES: [Pt]1(Cl)([P](Cc2[n]1cccc2)(C(C)(C)C)C(C)(C)C)C
• Title of publication: Insertion of Dioxygen into a Platinum(II)−Methyl Bond To Form a Platinum(II) Methylperoxo Complex
• Authors of publication: Grice, Kyle A.; Goldberg, Karen I.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 4
• Pages of publication: 953
• a: 9.7066 ± 0.0008 Å
• b: 15.2493 ± 0.001 Å
• c: 15.1463 ± 0.0015 Å
• α: 90°
• β: 128.854 ± 0.004°
• γ: 90°
• Cell volume: 1745.9 ± 0.3 ų
• Cell temperature: 546 ± 2 K
• Ambient diffraction temperature: 546 ± 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: 0.1177
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1241
• Weighted residual factors for all reflections included in the refinement: 0.144
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No