Information card for entry 2001584

Structure parameters

• Formula: C32 H16 O6
• Calculated formula: C32 H16 O6
• SMILES: c1ccc2c(c1)c1cc3ccc4c(c3cc1cc2)cccc4.O=C1OC(=O)c2c1cc1C(=O)OC(=O)c1c2
• Title of publication: Structures of three electron donor–acceptor complexes of dibenz[<i>a</i>,<i>h</i>]anthracene (DBA)
• Authors of publication: Zacharias, D. E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 6
• Pages of publication: 1082 - 1087
• a: 20.784 ± 0.002 Å
• b: 7.357 ± 0.001 Å
• c: 7.524 ± 0.001 Å
• α: 90°
• β: 97.71 ± 0.01°
• γ: 90°
• Cell volume: 1140.1 ± 0.2 ų
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No