Information card for entry 2002930

Structure parameters

• Formula: C14 H12 O4
• Calculated formula: C14 H12 O4
• SMILES: COC(=O)c1ccc2c(c1)ccc(c2)C(=O)OC
• 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: 13.41931 ± 0.00014 Å
• b: 6.14869 ± 0.00005 Å
• c: 7.15257 ± 0.00005 Å
• α: 90°
• β: 100.4 ± 0.001°
• γ: 90°
• Cell volume: 580.471 ± 0.009 ų
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 1.15023 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No