Information card for entry 4502942

Structure parameters

• Formula: C36 H30 Cl2 N2 O2 Pt
• Calculated formula: C36 H30 Cl2 N2 O2 Pt
• SMILES: [Pt](Cl)(Cl)([n]1ccc(C(O)(c2ccccc2)c2ccccc2)cc1)[n]1ccc(cc1)C(O)(c1ccccc1)c1ccccc1
• Title of publication: Supramolecular Architectures of Pt(II) Complexes Controlled by Hydrogen Bonds and by Guest Molecules
• Authors of publication: Bacchi, Alessia; Carcelli, Mauro; Pelagatti, Paolo; Rispoli, Gabriele; Rogolino, Dominga
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 1
• Pages of publication: 387
• a: 10.718 ± 0.001 Å
• b: 17.391 ± 0.002 Å
• c: 16.807 ± 0.002 Å
• α: 90°
• β: 95.796 ± 0.002°
• γ: 90°
• Cell volume: 3116.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0431
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.076
• Weighted residual factors for all reflections included in the refinement: 0.0792
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No