by Santa María, Dolores, Claramunt, Rosa M, Herranz, Fernando, Alkorta, Ibon and Elguero, José
Abstract:
The structure in solution and in the solid state of (+)-biotin methyl ester is discussed based on NMR chemical shifts measured in CDCl3 solution and in the solid state together with GIAO calculations at the B3LYP/6-311++ Gtextasteriskcenteredtextasteriskcentered theoretical level. In the solid state, only the …
Reference:
A theoretical and experimental NMR study of (+)-biotin methyl ester (Santa María, Dolores, Claramunt, Rosa M, Herranz, Fernando, Alkorta, Ibon and Elguero, José), In Journal of Molecular Structure, volume 920, 2009.
Bibtex Entry:
@article{SantaMaria:2009ku,
author = {Santa Mar{'i}a, Dolores and Claramunt, Rosa M and Herranz, Fernando and Alkorta, Ibon and Elguero, Jos{'e}},
title = {{A theoretical and experimental NMR study of (+)-biotin methyl ester}},
journal = {Journal of Molecular Structure},
year = {2009},
volume = {920},
number = {1-3},
pages = {323--326},
month = feb,
doi = {10.1016/j.molstruc.2008.11.027},
language = {English},
rating = {0},
date-added = {2013-11-24T10:33:06GMT},
date-modified = {2020-07-09T13:27:51GMT},
abstract = {The structure in solution and in the solid state of (+)-biotin methyl ester is discussed based on NMR chemical shifts measured in CDCl3 solution and in the solid state together with GIAO calculations at the B3LYP/6-311++ G{textasteriskcentered}{textasteriskcentered} theoretical level. In the solid state, only the ... 
},
url = {http://linkinghub.elsevier.com/retrieve/pii/S0022286008007618},
uri = {url{papers3://publication/doi/10.1016/j.molstruc.2008.11.027}}
}