Information card for entry 4306970

Structure parameters

• Formula: C12 H8 Cl2 N2 Pt
• Calculated formula: C12 H8 Cl2 N2 Pt
• SMILES: [Pt]1([n]2cccc3ccc4ccc[n]1c4c23)(Cl)Cl
• Title of publication: Selection and Discovery of Polymorphs of Platinum Complexes Facilitated by Polymer-Induced Heteronucleation
• Authors of publication: Adam L. Grzesiak; Adam J. Matzger
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 453 - 457
• a: 18.257 ± 0.01 Å
• b: 9.167 ± 0.005 Å
• c: 6.866 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1149.1 ± 1.1 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.034
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No