Information card for entry 7027136

Structure parameters

• Formula: C23 H18 B Cl F4 N4 Pt
• Calculated formula: C23 H15 B Cl F4 N4 Pt
• SMILES: [Pt]12(Cl)[n]3ccccc3c3cc(cc([n]13)c1cccc[n]21)c1ccccc1.[B](F)(F)(F)[F-].CC#N
• Title of publication: Luminescence properties of salts of the [Pt(4′Ph-terpy)Cl]+ chromophore: crystal structure of the red form of [Pt(4′Ph-terpy)Cl]BF4 (4′Ph-terpy = 4′-phenyl-2,2′∶6′,2″-terpyridine)
• Authors of publication: Büchner, Riaan; Cunningham, Corey T.; Field, John S.; Haines, Raymond J.; McMillin, David R.; Summerton, Grant C.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 5
• Pages of publication: 711
• a: 12.613 ± 0.0006 Å
• b: 13.6968 ± 0.0006 Å
• c: 14.5593 ± 0.0007 Å
• α: 71.114 ± 0.001°
• β: 85.649 ± 0.002°
• γ: 72.319 ± 0.001°
• Cell volume: 2266.7 ± 0.18 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for all reflections: 0.1175
• Weighted residual factors for significantly intense reflections: 0.1086
• Goodness-of-fit parameter for all reflections: 1.036
• Goodness-of-fit parameter for significantly intense reflections: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No