Information card for entry 7017093

Structure parameters

• Formula: C17 H15 I2 N2 P Pt
• Calculated formula: C17 H15 I2 N2 P Pt
• SMILES: [Pt]1(I)(I)[P](Nc2[n]1cccc2)(c1ccccc1)c1ccccc1
• Title of publication: Multiple hydrogen bondings in a platinum complex.
• Authors of publication: Tabei, Elham Sadat; Samouei, Hamidreza; Rashidi, Mehdi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 43
• Pages of publication: 11385 - 11388
• a: 8.8108 ± 0.0005 Å
• b: 27.2138 ± 0.0014 Å
• c: 8.9464 ± 0.0005 Å
• α: 90°
• β: 118.732 ± 0.003°
• γ: 90°
• Cell volume: 1881.01 ± 0.19 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: 0.0431
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0994
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No