Information card for entry 2102882

Structure parameters

• Formula: C36 H36 B2 F8 N6 Pt
• Calculated formula: C36 H36 B2 F8 N6 Pt
• SMILES: [B](F)(F)(F)[F-].c1cc(cc2c3cc(cc[n]3[Pt]3([n]12)[n]1ccc(cc1c1cc(cc[n]31)C)C)C)C.n1c(c2nccc(c2)C)cc(cc1)C.[B](F)(F)(F)[F-]
• Title of publication: Ligand and coordination-plane distortions in platinum(II) complexes of isomers of dimethyl-2,2'-bipyridine
• Authors of publication: Maheshwari, Vidhi; Carlone, Maria; Fronczek, Frank R.; Marzilli, Luigi G.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 4
• Pages of publication: 603 - 611
• a: 7.3395 ± 0.001 Å
• b: 10.58 ± 0.002 Å
• c: 12.093 ± 0.002 Å
• α: 70.602 ± 0.009°
• β: 87.384 ± 0.012°
• γ: 79.978 ± 0.012°
• Cell volume: 872.1 ± 0.3 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.05
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.077
• Weighted residual factors for all reflections included in the refinement: 0.082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No