Information card for entry 4316899

Structure parameters

• Formula: C36 H40 N4 Pt
• Calculated formula: C36 H40 N4 Pt
• SMILES: [Pt]1([n]2c3c4[n]1cccc4ccc3ccc2)(c1ccccc1CN1CCCCC1)c1ccccc1CN1CCCCC1
• Title of publication: Intramolecular NH...Pt Interactions of Platinum(II) Diimine Complexes with Phenyl Ligands
• Authors of publication: Sayandev Chatterjee; Jeanette A. Krause; Allen G. Oliver; William B. Connick
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 9798 - 9808
• a: 11.202 ± 0.002 Å
• b: 17.076 ± 0.003 Å
• c: 18.359 ± 0.004 Å
• α: 90°
• β: 103.796 ± 0.006°
• γ: 90°
• Cell volume: 3410.5 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0575
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 0.775 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No