Obtaining Molecular and Structural Information from 13C–14N Systems with 13C FIREMAT Experiments Export

@article{Strohmeier_Grant_JMagRes_2002, abstract = {The effect of dipolar coupling to 14 N on 13 C FIREMAT ( fi ve π re plicated m agic a ngle t urning) experiments is investigated. A method is developed for fitting the 13 C FIREMAT FID employing the full theory to extract the 13 C– 14 N dipolar and 13 C chemical shift tensor information. The analysis requires prior knowledge of the electric field gradient (EFG) tensor at the 14 N nucleus. In order to validate the method the analysis is done for the amino acids α-glycine, γ-glycine, l -alanine, l -asparagine, and l -histidine on FIREMAT FIDs recorded at 13 C frequencies of 50 and 100 MHz. The dipolar and chemical shift data obtained with this analysis are in very good agreement with the previous single-crystal 13 C NMR results and neutron diffraction data on α-glycine, l -alanine, and l -asparagine. The values for γ-glycine and l -histidine obtained with this new method are reported for the first time. The uncertainties in the EFG tensor on the resultant 13 C chemical shift and dipolar tensor values are assessed. }, author = {Strohmeier, M.}, citeulike-article-id = {6074668}, citeulike-linkout-0 = {http://dx.doi.org/10.1006/jmre.2002.2505}, citeulike-linkout-1 = {http://linkinghub.elsevier.com/retrieve/pii/S1090-7807(02)92505-X}, doi = {10.1006/jmre.2002.2505}, issn = {10907807}, journal = {Journal of Magnetic Resonance}, keywords = {amino\_acids, asparagine, c\_nmr, csa, glycine, histidine\_hcl\_h2o, nmr}, month = {April}, number = {2}, pages = {263--277}, posted-at = {2009-11-05 14:56:58}, priority = {0}, title = {Obtaining Molecular and Structural Information from 13C–14N Systems with 13C FIREMAT Experiments}, url = {http://dx.doi.org/10.1006/jmre.2002.2505}, volume = {155}, year = {2002} }

TY - JOUR ID - Strohmeier_Grant_JMagRes_2002 L3 - citeulike-article-id:6074668 N2 - The effect of dipolar coupling to 14 N on 13 C FIREMAT ( fi ve π re plicated m agic a ngle t urning) experiments is investigated. A method is developed for fitting the 13 C FIREMAT FID employing the full theory to extract the 13 C– 14 N dipolar and 13 C chemical shift tensor information. The analysis requires prior knowledge of the electric field gradient (EFG) tensor at the 14 N nucleus. In order to validate the method the analysis is done for the amino acids α-glycine, γ-glycine, l -alanine, l -asparagine, and l -histidine on FIREMAT FIDs recorded at 13 C frequencies of 50 and 100 MHz. The dipolar and chemical shift data obtained with this analysis are in very good agreement with the previous single-crystal 13 C NMR results and neutron diffraction data on α-glycine, l -alanine, and l -asparagine. The values for γ-glycine and l -histidine obtained with this new method are reported for the first time. The uncertainties in the EFG tensor on the resultant 13 C chemical shift and dipolar tensor values are assessed. IS - 2 JF - Journal of Magnetic Resonance SN - 10907807 EP - 277 TI - Obtaining Molecular and Structural Information from 13C–14N Systems with 13C FIREMAT Experiments VL - 155 SP - 263 KW - amino_acids KW - asparagine KW - c_nmr KW - csa KW - glycine KW - histidine_hcl_h2o KW - nmr AU - Strohmeier, M PY - 2002/04// UR - http://dx.doi.org/10.1006/jmre.2002.2505 ER -