Information card for entry 4307909

Structure parameters

• Formula: C15 H16 Cl N O Pt S
• Calculated formula: C15 H16 Cl N O Pt S
• SMILES: [Pt]1(c2c(C(=[NH]1)c1ccccc1)cccc2)(Cl)[S](=O)(C)C
• Title of publication: First Example of the Solid-State Thermal Cyclometalation of Ligated Benzophenone Imine Giving Novel Luminescent Platinum(II) Species
• Authors of publication: Yulia Yu. Scaffidi-Domianello; Alexey A. Nazarov; Matti Haukka; Markus Galanski; Bernhard K. Keppler; Jacob Schneider; Pingwu Du; Richard Eisenberg; Vadim Yu. Kukushkin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4469 - 4482
• a: 10.0666 ± 0.0003 Å
• b: 10.5808 ± 0.0003 Å
• c: 14.757 ± 0.0003 Å
• α: 107.833 ± 0.002°
• β: 95.223 ± 0.002°
• γ: 92.213 ± 0.001°
• Cell volume: 1486.4 ± 0.07 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No