Information card for entry 2000762

Structure parameters

• Formula: C18 H15 N O3
• Calculated formula: C18 H15 N O3
• SMILES: O=C1c2cccc(c2C(=O)c2c1cccc2)N1CCOCC1
• Title of publication: Structure of 1-morpholinoanthraquinone at 110 K
• Authors of publication: Kaufmann, M.; Berger, D.; Härter, R.; Hirschi, D.; Bürgi, H.-B.; Raselli, A.; Röhr, C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 7
• Pages of publication: 1262 - 1265
• a: 12.456 ± 0.002 Å
• b: 6.735 ± 0.004 Å
• c: 16.135 ± 0.003 Å
• α: 90°
• β: 92.17 ± 0.01°
• γ: 90°
• Cell volume: 1352.6 ± 0.9 ų
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No