Information card for entry 4083509

Structure parameters

• Formula: C24 H23 F3 N4 O3 Pt S
• Calculated formula: C24 H23 F3 N4 O3 Pt S
• SMILES: [Pt]1([n]2cccc3ccn(c23)c2ccccc2n2ccc3ccc[n]1c23)(C)(C)C.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Steric Impact of Neutral N,N-Chelates on the Structure and Stability of Five-Coordinate Platinum(IV) Complexes:fac-PtIVMe3Complexes of BAB and BAM
• Authors of publication: Zhao, Shu-Bin; Wu, Gang; Wang, Suning
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 6
• Pages of publication: 1030
• a: 10.724 ± 0.0003 Å
• b: 24.2086 ± 0.0008 Å
• c: 9.2365 ± 0.0003 Å
• α: 90°
• β: 99.893 ± 0.001°
• γ: 90°
• Cell volume: 2362.26 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0219
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0374
• Weighted residual factors for all reflections included in the refinement: 0.0383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No