Information card for entry 2002929

Structure parameters

• Formula: C12 H8 O4
• Calculated formula: C12 H8 O4
• SMILES: OC(=O)c1ccc2c(c1)ccc(c2)C(=O)O
• Title of publication: Structures of 2,6-disubstituted naphthalenes
• Authors of publication: Kaduk, J.A.; Golab, J.T.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: 85 - 94
• a: 3.7061 ± 0.0008 Å
• b: 7.4688 ± 0.0014 Å
• c: 8.535 ± 0.002 Å
• α: 86.62 ± 0.02°
• β: 85.49 ± 0.02°
• γ: 87.99 ± 0.02°
• Cell volume: 235 ± 0.09 ų
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No