Information card for entry 8100674

Structure parameters

• Formula: C16 H18 O4 Se
• Calculated formula: C16 H18 O4 Se
• SMILES: [Se](=O)(=O)(CC(OCCO)c1ccccc1)c1ccccc1
• Title of publication: Crystal structure of 2-(1-phenylselenonyl-1-phenylethoxy)ethanol, C~16~H~18~O~4~Se
• Authors of publication: Cooper, M. A.; Ward, A. D.; Tiekink, E. R. T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 3
• Pages of publication: 345 - 346
• a: 9.831 ± 0.006 Å
• b: 17.72 ± 0.008 Å
• c: 9.706 ± 0.006 Å
• α: 90°
• β: 112.72 ± 0.04°
• γ: 90°
• Cell volume: 1560 ± 2 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No