Information card for entry 4338982

Structure parameters

• Formula: C46 H42 Au2 Cl2 Mo N6 O4 P4
• Calculated formula: C46 H42 Au2 Cl2 Mo N6 O4 P4
• SMILES: [Au](Cl)[P]12N(C[P]([Mo]([P]34CN([P]([Au]Cl)(N(C3)c3ccccc3)N(C4)c3ccccc3)c3ccccc3)(C#[O])(C#[O])(C#[O])C#[O])(CN1c1ccccc1)CN2c1ccccc1)c1ccccc1
• Title of publication: Comparisons of phosphorus ligation properties in P(CH2NR)3P.
• Authors of publication: Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 22
• Pages of publication: 9351 - 9363
• a: 16.0152 ± 0.0008 Å
• b: 16.5984 ± 0.0008 Å
• c: 18.2588 ± 0.0009 Å
• α: 90°
• β: 92.0129 ± 0.001°
• γ: 90°
• Cell volume: 4850.7 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0522
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No