Information card for entry 4339317

Structure parameters

• Common name: [Pt(dmphen){CH2C6H4P(o-tolyl)2-C,P}]BArf
• Formula: C67 H44 B F24 N2 P Pt
• Calculated formula: C67 H44 B F24 N2 P Pt
• SMILES: [Pt]12([n]3c(ccc4ccc5ccc([n]1c5c34)C)C)[P](c1ccccc1C2)(c1ccccc1C)c1ccccc1C.[B-](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
• Title of publication: Synchronized fluxional motion and cyclometalation of ligands in platinum(II) complexes.
• Authors of publication: Romeo, Raffaello; D'Amico, Giuseppina; Guido, Emanuela; Albinati, Alberto; Rizzato, Silvia
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 25
• Pages of publication: 10681 - 10692
• a: 13.1892 ± 0.0014 Å
• b: 18.4213 ± 0.0019 Å
• c: 25.996 ± 0.003 Å
• α: 84.902 ± 0.003°
• β: 84.139 ± 0.003°
• γ: 87.121 ± 0.003°
• Cell volume: 6252.8 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0695
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No