Information card for entry 9014049

Structure parameters

• Mineral name: Realgar
• Formula: As S
• Calculated formula: As16 S16
• SMILES: [As]12[As]3S[As](S1)[As](S2)S3
• Title of publication: Crystal-structure properties and the molecular nature of hydrostatically compressed realgar Note: P = 3.97 GPa
• Authors of publication: Hejny, C.; Sagl, R.; Tobbens, D. M.; Miletich, R.; Wildner, M.; Nasdala, L.; Ullrich, A.; Balic-Zunic T
• Journal of publication: Physics and Chemistry of Minerals
• Year of publication: 2012
• Journal volume: 39
• Pages of publication: 399 - 412
• a: 8.827 Å
• b: 12.683 Å
• c: 6.213 Å
• α: 90°
• β: 106.95°
• γ: 90°
• Cell volume: 665.347 ų
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No