Information card for entry 4328905

Structure parameters

• Formula: C26 H28 B Cl F4 N4 Pt
• Calculated formula: C26 H28 B Cl F4 N4 Pt
• SMILES: [Pt]1([n]2c3c4[n]1cccc4ccc3ccc2)(Cl)c1ccccc1C[NH+]1CCCCC1.[B](F)(F)(F)[F-].N#CC
• Title of publication: Platinum(II) Diimine Complexes with Halide/Pseudohalide Ligands and Dangling Trialkylamine or Ammonium Groups
• Authors of publication: Sayandev Chatterjee; Jeanette A. Krause; Kumudu Madduma-Liyanage; William B. Connick
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4572 - 4587
• a: 9.3658 ± 0.0007 Å
• b: 26.227 ± 0.002 Å
• c: 11.0318 ± 0.0009 Å
• α: 90°
• β: 104.003 ± 0.002°
• γ: 90°
• Cell volume: 2629.3 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0621
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.775 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No