Information card for entry 7212851

Structure parameters

• Common name: gold phosphonium
• Formula: C32 H22 Au N2 O4 P S4
• Calculated formula: C32 H22 Au N2 O4 P S4
• SMILES: [Au]12(SC3=C(S2)C(=O)NC3=O)SC2=C(S1)C(=O)NC2=O.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: The layered topology of a five components melaminium-melamine hybrid salt of a functional gold(iii) dithiolene complex
• Authors of publication: Ranganathan, Anupama; El-Ghayoury, Abdelkrim; Zorina, Leokadiya; Batail, Patrick
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 12
• Pages of publication: 4268
• a: 10.901 ± 0.001 Å
• b: 11.972 ± 0.001 Å
• c: 13.205 ± 0.001 Å
• α: 77.164 ± 0.004°
• β: 76.256 ± 0.003°
• γ: 74.665 ± 0.004°
• Cell volume: 1590.9 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0635
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0576
• Weighted residual factors for all reflections included in the refinement: 0.0614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No