Information card for entry 4302983

Structure parameters

• Formula: C140 H122 Fe4 O4 P4 Pt2
• Calculated formula: C140 H122 Fe4 O4 P4 Pt2
• SMILES: [C]1(#[C](c2ccccc2)[Pt]21[P]13[c]45[cH]6[cH]7[cH]8[cH]4[Fe]49%10%115678[c]5([cH]4[cH]9[cH]%10[cH]%115)[P]2(Oc2ccc(C(c4ccc(O[P]56[c]78[cH]9[cH]%10[cH]%11[cH]7[Fe]7%12%13%1489%10%11[c]8([cH]7[cH]%12[cH]%13[cH]%148)[P](Oc7ccc(C(c8ccc(O1)cc8)(C)C)cc7)([c]17[cH]8[cH]9[cH]%10[cH]1[Fe]1%11%12%13789%10[c]75[cH]1[cH]%11[cH]%12[cH]%137)[Pt]16[C](#[C]1c1ccccc1)c1ccccc1)cc4)(C)C)cc2)[c]12[cH]4[cH]5[cH]6[cH]1[Fe]17892456[c]23[cH]1[cH]7[cH]8[cH]92)c1ccccc1.c1ccccc1.c1ccccc1.c1ccccc1.c1ccccc1.c1ccccc1.c1ccccc1.c1ccccc1
• Title of publication: Synthesis of Binuclear Complexes Bound in an Enlarged Tetraphosphamacrocycle: Two Diphosphine Metal Units Linked in Front-to-Front Style
• Authors of publication: Tsutomu Mizuta; Yuta Inami; Kazuyuki Kubo; Katsuhiko Miyoshi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 7534 - 7536
• a: 26.75 ± 0.0002 Å
• b: 14.949 ± 0.0002 Å
• c: 30.406 ± 0.0003 Å
• α: 90°
• β: 111.831 ± 0.001°
• γ: 90°
• Cell volume: 11286.9 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• 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: 0.0488
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1217
• Weighted residual factors for all reflections included in the refinement: 0.1242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No