Information card for entry 2004431

Structure parameters

• Formula: C10 H6 O3
• Calculated formula: C10 H6 O3
• SMILES: O=C1OC(=O)C=C1c1ccccc1
• Title of publication: 2-Phenylmaleic Anhydride
• Authors of publication: Thomson, M. A.; Kar, M.; Anderson, O. P.; Lenz, T. G.; Vaughan, J. D.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 1
• Pages of publication: 168 - 169
• a: 6.547 ± 0.002 Å
• b: 7.057 ± 0.003 Å
• c: 9.687 ± 0.004 Å
• α: 107.48 ± 0.03°
• β: 102.07 ± 0.03°
• γ: 102.23 ± 0.03°
• Cell volume: 398.9 ± 0.3 ų
• Cell temperature: 155 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 significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.074
• Goodness-of-fit parameter for significantly intense reflections: 1.207
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No