Information card for entry 4349140

Structure parameters

• Formula: C13 H18 Cl2 N4 Pt
• Calculated formula: C13 H18 Cl2 N4 Pt
• SMILES: [Pt]1(Cl)(Cl)[n]2nn(CCCCCC)cc2c2cccc[n]12
• Title of publication: Excited States of Triphenylamine-Substituted 2-Pyridyl-1,2,3-triazole Complexes.
• Authors of publication: Huff, Gregory S.; Lo, Warrick K. C.; Horvath, Raphael; Turner, Jack O.; Sun, Xue-Zhong; Weal, Geoffrey R.; Davidson, Hannah J.; Kennedy, Aaron D. W.; McAdam, C. John; Crowley, James D.; George, Michael W.; Gordon, Keith C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 23
• Pages of publication: 12238 - 12253
• a: 7.4108 ± 0.0004 Å
• b: 8.9317 ± 0.0005 Å
• c: 23.7139 ± 0.0014 Å
• α: 87.722 ± 0.005°
• β: 81.445 ± 0.005°
• γ: 89.483 ± 0.005°
• Cell volume: 1550.95 ± 0.15 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 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: 0.1621
• Residual factor for significantly intense reflections: 0.133
• Weighted residual factors for significantly intense reflections: 0.3802
• Weighted residual factors for all reflections included in the refinement: 0.3989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No