Information card for entry 4332763

Structure parameters

• Formula: C26 H22 Au N2 O3 P S
• Calculated formula: C26 H22 Au N2 O3 P S
• SMILES: [Au](S/C(=N\c1ccc(N(=O)=O)cc1)OC)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Luminescent Phosphine Gold(I) Thiolates: Correlation between Crystal Structure and Photoluminescent Properties in [R3PAu{SC(OMe)NC6H4NO2-4}] (R = Et, Cy, Ph) and [(Ph2P-R-PPh2){AuSC(OMe)NC6H4NO2-4}2] (R = CH2, (CH2)2, (CH2)3, (CH2)4, Fc)
• Authors of publication: Ho, Soo Yei; Cheng, Eddie Chung-Chin; Tiekink, Edward R. T.; Yam, Vivian Wing-Wah
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 20
• Pages of publication: 8165 - 8174
• a: 9.1839 ± 0.0003 Å
• b: 16.0097 ± 0.0006 Å
• c: 17.053 ± 0.0006 Å
• α: 90°
• β: 100.948 ± 0.001°
• γ: 90°
• Cell volume: 2461.69 ± 0.15 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 7
• 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: 0.04
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No