Information card for entry 4339470

Structure parameters

• Formula: C25 H39 Au N O P S
• Calculated formula: C25 H39 Au N O P S
• SMILES: [Au](Sc1c(cccc1)C(=O)N)[P](C1CCCCC1)(C1CCCCC1)C1CCCCC1
• Title of publication: Supramolecular aggregation of mononuclear triorganophosphinegold(I) 2-mercaptobenzamides: solution structures, thermal decomposition, and photoluminescence.
• Authors of publication: Kang, Jun-Gill; Cho, Hyung-Kook; Park, Changmoon; Yun, Sock-Sung; Kim, Jae-Kyung; Broker, Grant A.; Smyth, Douglas R.; Tiekink, Edward R. T.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 20
• Pages of publication: 8228 - 8237
• a: 11.028 ± 0.002 Å
• b: 13.24 ± 0.007 Å
• c: 9.756 ± 0.002 Å
• α: 106.01 ± 0.03°
• β: 97.11 ± 0.02°
• γ: 108.65 ± 0.03°
• Cell volume: 1261.7 ± 0.9 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.039
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.067
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No