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5,6-Dimethyl-1,2,9,10-tetrahydropyrano[3,2-f]chromene-3,8-dione

Authors :
Shailesh K. Goswami
Lyall R. Hanton
C. John McAdam
Stephen C. Moratti
Jim Simpson
Source :
Acta Crystallographica Section E, Vol 68, Iss 7, Pp o2216-o2216 (2012)
Publication Year :
2012
Publisher :
International Union of Crystallography, 2012.

Abstract

The title molecule, C14H14O4, lies on a twofold rotation axis that bisects the central benzene ring, with only one half-molecule in the asymmetric unit. The pyranone systems adopt distorted twist- boat conformations, with the two methylene C atoms displaced by 0.537 (1) and 0.163 (2) Å from the best-fit plane through the remaining five C and O atoms (r.m.s. deviation = 0.073 Å). In the crystal, bifurcated C—H...(O,O) hydrogen bonds link pairs of adjacent molecules in an obverse fashion, stacking molecules along c. These contacts are further stabilized by very weak π–π interactions between adjacent benzene rings with centroid–centroid distances of 4.1951 (4) Å. Additional C—H...O contacts link these stacks, giving a three-dimensional network.

Subjects

Subjects :
Crystallography
QD901-999

Details

Language :
English
ISSN :
16005368
Volume :
68
Issue :
7
Database :
Directory of Open Access Journals
Journal :
Acta Crystallographica Section E
Publication Type :
Academic Journal
Accession number :
edsdoj.74799bc4473a43758659a83b048f4d56
Document Type :
article
Full Text :
https://doi.org/10.1107/S1600536812027699