Information card for entry 4332764

Structure parameters

• Formula: C41 H36 Au2 N4 O6 P2 S2
• Calculated formula: C41 H36 Au2 N4 O6 P2 S2
• SMILES: [Au](S/C(=N\c1ccc(N(=O)=O)cc1)OC)[P](C[P](c1ccccc1)(c1ccccc1)[Au]S/C(=N\c1ccc(N(=O)=O)cc1)OC)(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: 27.944 ± 0.0014 Å
• b: 10.8454 ± 0.0006 Å
• c: 30.0702 ± 0.0015 Å
• α: 90°
• β: 115.497 ± 0.001°
• γ: 90°
• Cell volume: 8225.6 ± 0.7 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No