Information card for entry 4306587

Structure parameters

• Formula: C15 H12 Cl N3 Pt
• Calculated formula: C15 H12 Cl N3 Pt
• Title of publication: Cyclometalated Platinum(II) Complexes of Pyrazole-Based, N^C^N-Coordinating, Terdentate Ligands: the Contrasting Influence of Pyrazolyl and Pyridyl Rings on Luminescence
• Authors of publication: Stéphanie Develay; Octavia Blackburn; Amber L. Thompson; J. A. Gareth Williams
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11129 - 11142
• a: 16.8287 ± 0.0013 Å
• b: 8.8822 ± 0.0007 Å
• c: 18.3338 ± 0.0014 Å
• α: 90°
• β: 92.968 ± 0.001°
• γ: 90°
• Cell volume: 2736.8 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• 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: 0.0621
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No