Information card for entry 2214563

Structure parameters

• Common name: glutaric anhydride
• Chemical name: Oxacyclohexane-2,6-dione
• Formula: C5 H6 O3
• Calculated formula: C5 H6 O3
• SMILES: O1C(=O)CCCC1=O
• Title of publication: Oxacyclohexane-2,6-dione (glutaric anhydride)
• Authors of publication: Stefanowicz, Piotr; Jaremko, Mariusz; Jaremko, Łukasz; Lis, Tadeusz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3431 - o3431
• a: 5.41 ± 0.004 Å
• b: 7.52 ± 0.006 Å
• c: 13.18 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 536.2 ± 0.7 ų
• Cell temperature: 240 ± 2 K
• Ambient diffraction temperature: 240 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0486
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1122
• Weighted residual factors for all reflections included in the refinement: 0.1157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes