Information card for entry 8101598

Structure parameters

• Formula: C16 H24 N2 O3
• Calculated formula: C16 H24 N2 O3
• SMILES: Oc1c(cccc1CN1CCOCC1)CN1CCOCC1
• Title of publication: Crystal structure of 2,6-di(morpholinomethyl)phenol, C~16~H~24~N~2~O~3~
• Authors of publication: Crisp, G. T.; Jensen, W. P.; Tiekink, E. R. T.; Turner, P. D.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1999
• Journal volume: 214
• Journal issue: 4
• Pages of publication: 521 - 522
• a: 14.528 ± 0.002 Å
• b: 11.4681 ± 0.0009 Å
• c: 9.503 ± 0.002 Å
• α: 90°
• β: 95.94 ± 0.01°
• γ: 90°
• Cell volume: 1574.7 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.044
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No