Information card for entry 7001207

Structure parameters

• Formula: C72 H56 F10 Fe2 P2 Pt2
• Calculated formula: C72 H56 F10 Fe2 P2 Pt2
• SMILES: C(#CC(C)(C)C)[P](c1ccccc1)(c1ccccc1)[Pt]1([C]2#[C]([c]35[cH]6[cH]7[cH]4[cH]3[Fe]49%1035678[cH]4[cH]3[cH]%10[cH]9[cH]84)[Pt]32([C]1#[C]3[c]12[cH]3[cH]4[cH]5[cH]1[Fe]16782345[cH]2[cH]1[cH]6[cH]7[cH]82)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F)[P](C#CC(C)(C)C)(c1ccccc1)c1ccccc1
• Title of publication: Platinum complexes having redox-active PPh2CCFc and/or CCFc as terminal or bridging ligands
• Authors of publication: Díez, Álvaro; Lalinde, Elena; Teresa Moreno, M.; Sánchez, Sergio
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 18
• Pages of publication: 3434 - 3446
• a: 14.067 ± 0.0002 Å
• b: 29.7506 ± 0.0005 Å
• c: 15.0209 ± 0.0003 Å
• α: 90°
• β: 93.731 ± 0.002°
• γ: 90°
• Cell volume: 6272.95 ± 0.19 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0773
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.0457
• Goodness-of-fit parameter for all reflections included in the refinement: 0.739
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No