Information card for entry 2003629

Structure parameters

• Common name: anthracenecarboxylic anhydride
• Chemical name: 5,5'-di(anthracenecarboxylic) anhydride
• Formula: C30 H18 O3
• Calculated formula: C30 H18 O3
• SMILES: C(=O)(OC(=O)c1c2ccccc2cc2c1cccc2)c1c2ccccc2cc2c1cccc2
• Title of publication: 5,5'-Di(anthracenecarboxylic) Anhydride
• Authors of publication: Blake, A. J.; Grimditch, R. S.; Schröder, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 7
• Pages of publication: 1472 - 1474
• a: 9.834 ± 0.005 Å
• b: 10.973 ± 0.006 Å
• c: 11.51 ± 0.006 Å
• α: 112.51 ± 0.02°
• β: 89.56 ± 0.02°
• γ: 107.24 ± 0.02°
• Cell volume: 1087.9 ± 1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0935
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections: 0.1724
• Weighted residual factors for significantly intense reflections: 0.1285
• Goodness-of-fit parameter for all reflections: 1.042
• Goodness-of-fit parameter for significantly intense reflections: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No