Information card for entry 4326842

Structure parameters

• Formula: C92 H126 Fe2 N4 O13 Pt4
• Calculated formula: C92 H126 Fe2 N4 O13 Pt4
• SMILES: [Pt]12345[Pt]67([Pt]89([Pt]1([O]=C(O2)[c]12[Fe]%10%11%12%13%14%15%16([cH]1[cH]%10[cH]%11[cH]2%12)[cH]1[cH]%16[cH]%15[cH]%14[cH]%131)(OC(=[O]8)C)([O]=C(O4)C)[N](=CN9c1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1cc(cc(c1)C(C)(C)C)C(C)(C)C)([O]=C(O6)[c]12[Fe]4689%10%11%12([cH]1[cH]4[cH]6[cH]28)[cH]1[cH]9[cH]%10[cH]%11[cH]%121)OC(=[O]7)C)([O]=C(O3)C)[N](=CN5c1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1cc(cc(c1)C(C)(C)C)C(C)(C)C.O(CC)CC
• Title of publication: Interaction of Ferrocene Moieties Across a Square Pt4 Unit: Synthesis, Characterization, and Electrochemical Properties of Carboxylate-Bridged Bimetallic Pt4Fen (n= 2, 3, and 4) Complexes
• Authors of publication: Shinji Tanaka; Kazushi Mashima
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 11384 - 11393
• a: 16.327 ± 0.003 Å
• b: 18.739 ± 0.003 Å
• c: 19.046 ± 0.004 Å
• α: 69.166 ± 0.008°
• β: 76.65 ± 0.01°
• γ: 67.924 ± 0.009°
• Cell volume: 5015 ± 1.7 ų
• Cell temperature: 113 K
• Ambient diffraction temperature: 113 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.2466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No