The crystal and mol. structures of the title compd. were detd. by x-ray diffraction. The structure was solved by direct methods and refined by full-matrix least-squares procedures to an R of 0.08. The crystals are triclinic, space group P‾1, with a 12.43(7), b 5.09(2), c 10.94(5), α 130°20'(10'), β 103°7'(12'), and γ 84°20'(12'); Z = 2. The carboxylic acid groups are disposed in planes nearly orthogonal to each other, as found in malonic acid. The mols. are linked in rows by H-bonds about symmetry centers. Partial nonstaggered conformations of the C6H13 groups are not obsd. [on SciFinder(R)]

Hexylmalonic acid, C9H16O4

LEPORE, UGO;
1976

Abstract

The crystal and mol. structures of the title compd. were detd. by x-ray diffraction. The structure was solved by direct methods and refined by full-matrix least-squares procedures to an R of 0.08. The crystals are triclinic, space group P‾1, with a 12.43(7), b 5.09(2), c 10.94(5), α 130°20'(10'), β 103°7'(12'), and γ 84°20'(12'); Z = 2. The carboxylic acid groups are disposed in planes nearly orthogonal to each other, as found in malonic acid. The mols. are linked in rows by H-bonds about symmetry centers. Partial nonstaggered conformations of the C6H13 groups are not obsd. [on SciFinder(R)]
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Utilizza questo identificativo per citare o creare un link a questo documento: http://hdl.handle.net/11588/491635
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