Information card for entry 4502934

Structure parameters

• Formula: C36.5 H30.5 Cl3.5 N2 O2 Pt
• Calculated formula: C36.5 H30.5 Cl3.5 N2 O2 Pt
• SMILES: C(c1cc[n](cc1)[Pt]([n]1ccc(C(c2ccccc2)(c2ccccc2)O)cc1)(Cl)Cl)(c1ccccc1)(c1ccccc1)O.C(Cl)(Cl)Cl
• 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: 13.526 ± 0.001 Å
• b: 15.172 ± 0.001 Å
• c: 17.955 ± 0.001 Å
• α: 79.538 ± 0.001°
• β: 71.919 ± 0.001°
• γ: 86.574 ± 0.001°
• Cell volume: 3444.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0744
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0711
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 0.846
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No