Information card for entry 1512620

Structure parameters

• Formula: C39 H32 Au2 Cl2 N2 O4 P2 S2
• Calculated formula: C39 H32 Au2 Cl2 N2 O4 P2 S2
• Title of publication: Photochemical reactivity of Two Gold(I) Dinuclear Complexes, Cis/Trans-(AupNBT)2dppee: Isomerization for Cis-(AupNBT)2dppee Isomer, Wavelength Dependent Radical Substitution for trans‒(AupNBT)2dppee.
• Authors of publication: Janet B. Foley; Angela Herring; Bo Li; Evgeny Dikarev
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 392
• Pages of publication: 300 - 310
• a: 12.3682 ± 0.001 Å
• b: 13.1123 ± 0.001 Å
• c: 14.6372 ± 0.0012 Å
• α: 66.724 ± 0.001°
• β: 68.777 ± 0.001°
• γ: 80.153 ± 0.001°
• Cell volume: 2031.6 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0523
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No