Information card for entry 4317197

Structure parameters

• Formula: C2 F N O S
• Calculated formula: C2 F N O S
• Title of publication: Vibrational Spectra, Crystal Structures, Constitutional and Rotational Isomerism of FC(O)SCN and FC(O)NCS
• Authors of publication: Luis A. Ramos; Sonia E. Ulic; Rosana M. Romano; Mauricio F. Erben; Christian W. Lehmann; Eduard Bernhardt; Helmut Beckers; Helge Willner; Carlos O. Della Védova
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 11142 - 11157
• a: 14.784 ± 0.002 Å
• b: 3.9255 ± 0.0006 Å
• c: 13.918 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 807.7 ± 0.2 ų
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No