Information card for entry 4318300

Structure parameters

• Formula: C30 H33 N3 O Pt
• Calculated formula: C30 H33 N3 O Pt
• SMILES: [Pt]12([n]3c(c4[n]2cccc4)cccc3)Oc2c(cc(cc2N1c1ccccc1)C(C)(C)C)C(C)(C)C
• Title of publication: o-Iminobenzosemiquinonato(1-) and o-Amidophenolato(2-) Complexes of Palladium(II) and Platinum(II): A Combined Experimental and Density Functional Theoretical Study
• Authors of publication: Xianru Sun; Hyungphil Chun; Knut Hildenbrand; Eberhard Bothe; Thomas Weyhermüller; Frank Neese; Karl Wieghardt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4295 - 4303
• a: 10.1892 ± 0.0009 Å
• b: 11.2083 ± 0.0009 Å
• c: 13.0067 ± 0.0012 Å
• α: 86.83 ± 0.01°
• β: 72.45 ± 0.01°
• γ: 65.53 ± 0.01°
• Cell volume: 1284.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0442
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for all reflections: 0.0698
• Weighted residual factors for significantly intense reflections: 0.0657
• Goodness-of-fit parameter for all reflections: 1.006
• Goodness-of-fit parameter for significantly intense reflections: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No