Information card for entry 4304406

Structure parameters

• Formula: C46 H39 Fe N P2 Pt
• Calculated formula: C46 H39 Fe N P2 Pt
• SMILES: [Fe]123456789[c]%10([cH]1[cH]2[cH]3[cH]4%10)[P](c1ccccc1)(c1ccccc1)[Pt](c1ccccc1c1ccccn1)(C)[P](c1ccccc1)(c1ccccc1)[c]15[cH]6[cH]7[cH]8[cH]91
• Title of publication: Binuclear Cyclometalated Organoplatinum Complexes Containing 1,1'-Bis(diphenylphosphino)ferrocene as Spacer Ligand: Kinetics and Mechanism of MeI Oxidative Addition
• Authors of publication: Sirous Jamali; S. Masoud Nabavizadeh; Mehdi Rashidi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5441 - 5452
• a: 10.6124 ± 0.0009 Å
• b: 11.7917 ± 0.0013 Å
• c: 30.138 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3771.4 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0265
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0442
• Weighted residual factors for all reflections included in the refinement: 0.0452
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No