Information card for entry 4341083

Structure parameters

• Formula: C62 H82 Au Cl4 F6 Mo4 O4 P3
• Calculated formula: C62 H82 Au Cl4 F6 Mo4 O4 P3
• SMILES: [Mo]12345([Au]6([Mo]789%10([P]%116[Mo]6%12%13%14%15%16%17%18%19([c]%20%11[cH]6[cH]%12[cH]%13[cH]%14%20)[cH]6[c]%19([cH]%18[c]%17([cH]%16[c]%156C(C)(C)C)C(C)(C)C)C(C)(C)C)(C#[O])(C#[O])[cH]6[cH]%10[cH]9[cH]8[cH]76)[P]61[Mo]1789%10%11%12%13%14([cH]%156[cH]1[cH]7[cH]8[cH]9%15)[cH]1[c]%10([cH]%11[c]%12([cH]%13[c]%141C(C)(C)C)C(C)(C)C)C(C)(C)C)(C#[O])(C#[O])[cH]1[cH]2[cH]3[cH]4[cH]51.[P](F)(F)(F)(F)(F)[F-].ClCCl.ClCCl
• Title of publication: Gold(I) and related heterometallic derivatives of dimolybdenum complexes with asymmetric phosphinidene bridges.
• Authors of publication: Alvarez, Belén; Alvarez, M. Angeles; Amor, Inmaculada; García, M Esther; Ruiz, Miguel A.; Suárez, Jaime
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 10325 - 10339
• a: 17.5559 ± 0.0002 Å
• b: 11.5363 ± 0.0002 Å
• c: 36.3141 ± 0.0006 Å
• α: 90°
• β: 101.076 ± 0.001°
• γ: 90°
• Cell volume: 7217.71 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0685
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for significantly intense reflections: 0.1594
• Weighted residual factors for all reflections included in the refinement: 0.1713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No