Information card for entry 8100742

Structure parameters

• Common name: YISI
• Formula: C15 H12 O2
• Calculated formula: C15 H12 O2
• SMILES: c1(ccc(cc1)/C=C/C(=O)c1ccccc1)O
• Title of publication: Crystal structure of E-1-(phenyl)-3-(4-hydroxyphenyl)-2-propene-1- one, C~15~H~12~O~2~
• Authors of publication: Gupta, Sakuntala; Henk, Schenk; Kees, Goubitz; Yeow, Yeap Guan; Sen Gupta, S.P.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 4
• Pages of publication: 503 - 504
• a: 5.3685 ± 0.0004 Å
• b: 12.957 ± 0.002 Å
• c: 17.174 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1194.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No