Artículos de revistas
Self-association and stereochemistry study of (5R)-4-methyl-5-phenyl-1,3,4-oxadiazinan-2-one
Registro en:
Zeitschrift Fur Kristallographie. Oldenbourg Verlag, v. 221, n. 3, n. 226, n. 230, 2006.
0044-2968
WOS:000236142500008
10.1524/zkri.2006.221.3.226
Autor
Rodrigues, A
Olivato, PR
Zukerman-Schpector, J
Rittner, R
Institución
Resumen
C10H12N2O2, M-r = 191.21, P2(1), a = 5.5771(7), b=27.841(3), c=6.906(1)(a) over circle, beta=111.937(9)degrees, Z=4, R-1 = 0.0462. The two independent molecules in the asymmetric unit are linked through two very strong quasi centrosymmetric hydrogen bonds. The oxadiazinone rings, of both molecules, show the pyramidal inversion at N-4 nitrogen, thus resulting in a C(R)N(S)-C(R)N(R) diastereomeric pair. The analysis of the IR N-H stretching band (in the solid and in carbon tetrachloride solution) and the C-13 NMR experiment at low temperature are in agreement with the Xray crystal structure. o TEXTO COMPLETO DESTE ARTIGO, ESTARÁ DISPONÍVEL À PARTIR DE AGOSTO DE 2015. 221 3 226 230