Information card for entry 4069366

Structure parameters

• Formula: C18 H18 Cl2 N4 O14 Pt
• Calculated formula: C18 H18 Cl2 N4 O14 Pt
• SMILES: [Pt]12(Cl)(Cl)([O]=N(=O)c3c1c(N(=O)=O)c(OC)c(OC)c3OC)[O]=N(=O)c1c2c(N(=O)=O)c(OC)c(OC)c1OC
• Title of publication: Mono(2,6-dinitroaryl)platinum(II) and Mono- and Bis(2,6-dinitroaryl)platinum(IV) Complexes
• Authors of publication: Vicente, José; Arcas, Aurelia; Gálvez-López, María-Dolores; Jones, Peter G.; Bautista, Delia
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 12
• Pages of publication: 3501
• a: 13.294 ± 0.0007 Å
• b: 10.7745 ± 0.0006 Å
• c: 16.8442 ± 0.0009 Å
• α: 90°
• β: 93.058 ± 0.002°
• γ: 90°
• Cell volume: 2409.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0572
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.0858
• Weighted residual factors for all reflections included in the refinement: 0.0886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.239
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No