Information card for entry 4078004

Structure parameters

• Formula: C36 H56 Au Cl2 F6 P4 Sb
• Calculated formula: C36 H56 Au Cl2 F6 P4 Sb
• SMILES: [Au]([P](C(C)(C)C)(C(C)(C)C)c1ccccc1c1ccccc1)[P]1=C(C(C)(C)C)P=C(P=C1C(C)(C)C)C(C)(C)C.[Sb](F)(F)(F)(F)(F)[F-].ClCCl
• Title of publication: Cationic Gold(I) Complexes of 2,4,6-Tri-tert-butyl-1,3,5-triphosphabenzene
• Authors of publication: Townsend, Nell S.; Green, Michael; Russell, Christopher A.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 7
• Pages of publication: 2543
• a: 12.9395 ± 0.0003 Å
• b: 13.1635 ± 0.0003 Å
• c: 14.1076 ± 0.0004 Å
• α: 80.828 ± 0.001°
• β: 87.791 ± 0.001°
• γ: 64.854 ± 0.001°
• Cell volume: 2146.25 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0324
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No