Z. Galdecki et al., CRYSTAL AND MOLECULAR-STRUCTURE OF METHYL IDEOXY-BETA-D,L-GLYCERO-HEX-4-ENOZ-2-ULOPYRANOSIDE, Polish Journal of Chemistry, 69(2), 1995, pp. 269-274
The unsaturated monosaccharide C9H14O5 crystallizes in the monoclinic
space group Cc (Z=4). The unit cell parameters are: a=13.905(3), b=7.3
56(1), c=11.522(2)Angstrom, beta=123.54(3)degrees. The structure was s
olved by direct methods and refined by anisotropic full-matrix least-s
quares method. The final R (wR) factors were 0.032 (0.042) for 1452 ob
served reflections, The dihydropyranone ring adopts a deformed sofa co
nformation with C2 atom deviating 0.477(2)Angstrom from the least-squa
res plane and methoxy and dioxolanyl substituents are in pseudoaxial a
nd pseudoequatorial positions, respectively. The average planes of six
-membered and five-membered rings are approximately co-planar.