Information card for entry 2000960

Structure parameters

• Formula: C15 H17 Br N2 O3
• Calculated formula: C15 H17 Br N2 O3
• SMILES: N1(C(=O)C(CC1=O)c1cc(ccc1)Br)CN1CCOCC1
• Title of publication: Structure and conformation of <i>N</i>-(morpholinomethyl)-<i>m</i>-bromophenylsuccinimide
• Authors of publication: Kwiatkowski, W.; Karolak-Wojciechowska, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 4
• Pages of publication: 678 - 680
• a: 12.369 ± 0.002 Å
• b: 5.564 ± 0.001 Å
• c: 23.044 ± 0.004 Å
• α: 90°
• β: 100.49 ± 0.02°
• γ: 90°
• Cell volume: 1559.4 ± 0.5 ų
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No