Information card for entry 4329785

Structure parameters

• Formula: C46 H39 Cl N6 O Pt
• Calculated formula: C46 H38 Cl N6 O Pt
• SMILES: [Pt](Cl)([n]1[nH]c(cc1c1ccccc1)c1ccccc1)(n1nc(cc1c1ccccc1)c1ccccc1)[n]1[nH]c(cc1c1ccccc1)c1ccccc1.OC
• Title of publication: Syntheses and Luminescent Properties of 3,5-Diphenylpyrazolato-Bridged Heteropolynuclear Platinum Complexes. The Influence of Chloride Ligands on the Emission Energy Revealed by the Systematic Replacement of Chloride Ligands by 3,5-Dimethylpyrazolate
• Authors of publication: Seiji Akatsu; Yasunori Kanematsu; Taka-aki Kurihara; Shota Sueyoshi; Yasuhiro Arikawa; Masayoshi Onishi; Shoji Ishizaka; Noboru Kitamura; Yoshihide Nakao; Shigeyoshi Sakaki; Keisuke Umakoshi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7977 - 7992
• a: 15.8874 ± 0.001 Å
• b: 9.6977 ± 0.0004 Å
• c: 27.3674 ± 0.0016 Å
• α: 90°
• β: 105.624 ± 0.0009°
• γ: 90°
• Cell volume: 4060.7 ± 0.4 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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 significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.29
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No