Information card for entry 4104410

Structure parameters

• Chemical name: Au(tmdt)2
• Formula: C18 H12 Au S12
• Calculated formula: C18 H12 Au S12
• Title of publication: High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]
• Authors of publication: Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 7169 - 7174
• a: 5.7645 ± 0.001 Å
• b: 6.5657 ± 0.0009 Å
• c: 11.591 ± 0.002 Å
• α: 86.318 ± 0.014°
• β: 94.352 ± 0.015°
• γ: 102.41 ± 0.03°
• Cell volume: 426.69 ± 0.13 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Ambient diffracton pressure: 10660000 kPa
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor R(I) for significantly intense reflections: 0.035
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.49559 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No