Information card for entry 4339926

Structure parameters

• Formula: C40 H40 N6 Pt
• Calculated formula: C40 H40 N6 Pt
• SMILES: [Pt]12([n]3cc4ccccc4cc3c3n1nc1c3[C@H]3CC[C@@]1(C3(C)C)C)[n]1cc3ccccc3cc1c1n2nc2c1[C@H]1CC[C@@]2(C1(C)C)C
• Title of publication: Luminescent platinum(II) complexes containing isoquinolinyl indazolate ligands: synthetic reaction pathway and photophysical properties.
• Authors of publication: Chang, Sheng-Yuan; Kavitha, Jakka; Hung, Jui-Yi; Chi, Yun; Cheng, Yi-Ming; Li, Elise Y.; Chou, Pi-Tai; Lee, Gene-Hsiang; Carty, Arthur J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 7064 - 7074
• a: 7.0868 ± 0.0003 Å
• b: 16.9811 ± 0.0008 Å
• c: 30.3358 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3650.7 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.1261
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.295
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No