[6-(Benzoyloxy)-1,4,5-trihydroxycyclohex-2-en-1-yl]methyl benzoate
✍ Scribed by Angchuan, Supattra ;Chantrapromma, Suchada ;Fun, Hoong-Kun ;Karalai, Chatchanok
- Publisher
- International Union of Crystallography
- Year
- 2005
- Tongue
- English
- Weight
- 329 KB
- Volume
- 61
- Category
- Article
- ISSN
- 1600-5368
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📜 SIMILAR VOLUMES
Cl À Á2H 2 O, both the cation and anion lie on special positions of site symmetry 2. The cation and anion, along with the water molecules of crystallization, are linked into a three-dimensional network by extensive hydrogen bonds.
Single-crystal X-ray study T = 150 K Mean '(C±C) = 0.009 A Ê R factor = 0.060 wR factor = 0.150 Data-to-parameter ratio = 12.6 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
The title compound, C 24 H 36 , crystallizes with two independent but very similar molecules in the asymmetric unit. The ring torsion angles about the double bonds are ca 13 ; the ring sp 2 bond angles at the three radialene-type junctions are ca 110 .
In the title molecule, C 24 H 20 N 2 O 5 , the cyclohexene ring adopts a half-chair conformation. The molecular structure shows some intra-and intermolecular hydrogen bonds.