Information card for entry 7031511

Structure parameters

• Common name: (tBuP(N)N)PtMe(pyr)
• Chemical name: (tBuP(N)N)PtMe(pyr)
• Formula: C39 H66 Cl2 N6 O2 P2 Pt2
• Calculated formula: C38.999 H66 Cl2.002 N6 O2 P2 Pt2
• Title of publication: Hemilability of P(X)N-type ligands (X = O, N-H): rollover cyclometalation and benzene C-H activation from (P(X)N)PtMe2 complexes.
• Authors of publication: Scheuermann, Margaret L.; Grice, Kyle A.; Ruppel, Matthew J.; Roselló-Merino, Marta; Kaminsky, Werner; Goldberg, Karen I.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 31
• Pages of publication: 12018 - 12025
• a: 30.661 ± 0.016 Å
• b: 9.818 ± 0.012 Å
• c: 17.841 ± 0.008 Å
• α: 90°
• β: 122.137 ± 0.013°
• γ: 90°
• Cell volume: 4548 ± 6 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No