Information card for entry 4512700

Structure parameters

• Formula: C7 H9 Au N4 S2
• Calculated formula: C7 H9 Au N4 S2
• Title of publication: Photophysical Property ofcatena-Bis(thiocyanato)aurate(I) Complexes in Ionic Liquids
• Authors of publication: Aoyagi, Noboru; Shinha, Yusuke; Ikeda-Ohno, Atsushi; Haga, Yoshinori; Shimojo, Kojiro; Brooks, Neil R.; Izuoka, Akira; Naganawa, Hirochika; Kimura, Takaumi; Binnemans, Koen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 3
• Pages of publication: 1422
• a: 6.3317 ± 0.0006 Å
• b: 8.1709 ± 0.0008 Å
• c: 11.3131 ± 0.0009 Å
• α: 77.949 ± 0.003°
• β: 82.181 ± 0.002°
• γ: 89.668 ± 0.003°
• Cell volume: 566.92 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0933
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1271
• Weighted residual factors for all reflections included in the refinement: 0.1687
• Goodness-of-fit parameter for all reflections included in the refinement: 0.89
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No