Betaine betainium hydrogen oxalate |
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Authors: | V. H. Rodrigues J. A. Paixão M. M. R. R. Costa A. Matos Beja |
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Affiliation: | CEMDRX, Departamento de Física, Faculdade de Ciências e Tecnologia, Universidade de Coimbra, P-3004-516 Coimbra, Portugal |
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Abstract: | The title compound, C5H12NO2+·C2HO4−·C5H11NO2 or HC2O4−·(HBET·BET)+ [BET is trimethylglycine (betaine); IUPAC name: 1-carboxy-N,N,N-trimethylmethanaminium hydroxide inner salt], contains pairs of betaine molecules bridged by an H atom, forming dimers linked by a strong hydrogen bond. The hydrogen oxalate anions have a rather unusual star conformation, with an internal torsion angle of 70.1 (4)°. The betaine–betainium dimers are anchored between two zigzag chains of hydrogen oxalate molecules hydrogen bonded head-to-tail running parallel to the b axis. An extended network of C—H⃛O interactions links the anionic chains to the cationic dimers. |
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