Information card for entry 4089480

Structure parameters

• Formula: C30 H35 Cl2 Fe N P2 Pt
• Calculated formula: C30 H35 Cl2 Fe N P2 Pt
• SMILES: [Pt]1(Cl)(Cl)[PH](c2ccc3c4c(ccc([P]1(C(C)C)C(C)C)c24)CC3)[c]12[Fe]3456789([cH]1[cH]3[cH]4[cH]25)[cH]1[cH]6[cH]7[cH]8[cH]91.N#CC
• Title of publication: peri-Substituted Phosphino-Phosphonium Salts: Synthesis and Reactivity
• Authors of publication: Ray, Matthew J.; Slawin, Alexandra M. Z.; Bühl, Michael; Kilian, Petr
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 12
• Pages of publication: 3481
• a: 10.1942 ± 0.0017 Å
• b: 11.561 ± 0.002 Å
• c: 25.062 ± 0.005 Å
• α: 90°
• β: 92.122 ± 0.005°
• γ: 90°
• Cell volume: 2951.7 ± 0.9 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for all reflections included in the refinement: 0.0892
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No