TY - JOUR
T1 - (±)-(2,3,4,4a,5,6,7,8-Octahydro-2-oxonaphthalen-1-yl)acetic acid
T2 - Hydrogen-bonding pattern of the monohydrate of an unsaturated bicyclic γ-keto acid
AU - Lalancette, Roger A.
AU - Brunskill, Andrew P.J.
AU - Thompson, Hugh W.
PY - 2002/8
Y1 - 2002/8
N2 - The hydrogen-bonding pattern of the monohydrate of an unsaturated bicyclic γ-keto acid, (±)-(2,3,4,4a,5,6,7,8-octahydro-2-oxonaphthalen-1-yl)acetic acid, was discussed. In the compound, C12H16O3·H2O, the water of hydration accepted a hydrogen bond from the carboxyl group and donated hydrogen bonds to the carboxyl carbonyl and the ketone groups of two different neighbors, yielding a complex three-dimensional hydrogen-bonding array. There were two independent hydrated molecules in the asymmetric unit (Z′ = 2) related by a pseudo-translation.
AB - The hydrogen-bonding pattern of the monohydrate of an unsaturated bicyclic γ-keto acid, (±)-(2,3,4,4a,5,6,7,8-octahydro-2-oxonaphthalen-1-yl)acetic acid, was discussed. In the compound, C12H16O3·H2O, the water of hydration accepted a hydrogen bond from the carboxyl group and donated hydrogen bonds to the carboxyl carbonyl and the ketone groups of two different neighbors, yielding a complex three-dimensional hydrogen-bonding array. There were two independent hydrated molecules in the asymmetric unit (Z′ = 2) related by a pseudo-translation.
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U2 - 10.1107/S0108270102011526
DO - 10.1107/S0108270102011526
M3 - Article
C2 - 12154308
AN - SCOPUS:0036670088
SN - 0108-2701
VL - 58
SP - o491-o493
JO - Acta Crystallographica Section C: Crystal Structure Communications
JF - Acta Crystallographica Section C: Crystal Structure Communications
IS - 8
ER -