Information card for entry 1542739

Structure parameters

• Formula: C14 H6 N2 S2
• Calculated formula: C14 H6 N2 S2
• Title of publication: The structure of poly-2,5-benzoxazole (ABPBO) and poly-2,6-benzothiazole (ABPBT) fibers by X-ray diffraction
• Authors of publication: Fratini, Albert V.; Cross, Elisa M.; O'brien, Joseph F.; Adams, W. Wade
• Journal of publication: Journal of Macromolecular Science, Part B
• Year of publication: 1985
• Journal volume: 24
• Journal issue: 1-4
• Pages of publication: 159 - 179
• a: 6.044 ± 0.006 Å
• b: 3.417 ± 0.007 Å
• c: 12.194 ± 0.018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 251.8 ± 0.7 ų
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.095
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No