Information card for entry 7039981

Structure parameters

• Formula: C24 H15 Bi Mo3 O9
• Calculated formula: C24 H15 Bi Mo3 O9
• SMILES: C(#[O])[Mo]1234(C#[O])(C#[O])([cH]5[cH]4[cH]3[cH]2[cH]15)[Bi]([Mo]1234(C#[O])(C#[O])(C#[O])[cH]5[cH]4[cH]3[cH]2[cH]15)[Mo]1234(C#[O])(C#[O])(C#[O])[cH]5[cH]4[cH]3[cH]2[cH]15
• Title of publication: Supramolecular adducts based on weak interactions between the trimeric Lewis acid complex (perfluoro-ortho-phenylene)mercury and polypnictogen complexes.
• Authors of publication: Fleischmann, Martin; Jones, James S.; Balázs, Gábor; Gabbaï, François P; Scheer, Manfred
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 35
• Pages of publication: 13742 - 13749
• a: 14.8747 ± 0.0006 Å
• b: 14.8747 ± 0.0006 Å
• c: 7.4995 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1437.01 ± 0.11 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 5
• Space group number: 159
• Hermann-Mauguin space group symbol: P 3 1 c
• Hall space group symbol: P 3 -2c
• Residual factor for all reflections: 0.1111
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.1526
• Weighted residual factors for all reflections included in the refinement: 0.162
• Goodness-of-fit parameter for all reflections included in the refinement: 0.92
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No