Information card for entry 2204833

Structure parameters

• Common name: 2,7-dihydroxynaphthalene
• Chemical name: Naphthalene-2,7-diol
• Formula: C10 H8 O2
• Calculated formula: C10 H8 O2
• SMILES: Oc1cc2c(ccc(O)c2)cc1
• Title of publication: Naphthalene-2,7-diol
• Authors of publication: Rozycka-Sokolowska, Ewa; Marciniak, Bernard; Pavlyuk, Volodymyr
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: o114 - o115
• a: 7.872 ± 0.002 Å
• b: 17.463 ± 0.003 Å
• c: 5.754 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 791 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.1178
• Weighted residual factors for all reflections included in the refinement: 0.1212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.196
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes