Ab Initio Calculations and NMR Study of 15N Chemical Shielding Tensors of N7- and N9- Substituted Purine Derivatives

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Authors

TOUŠEK Jaromír MAREK Radek BRUS Jiří

Year of publication 2002
Type Article in Proceedings
Conference International Chemometric Conference CHEMOMETRIC VI
MU Faculty or unit

Faculty of Science

Citation
Field Physical chemistry and theoretical chemistry
Keywords 15N NMR chemical shifts tensors; Ab initio calculations
Description 15N MNR parametres of selected adenine and guanine derivatives were investigated using gradient inverse techniques. 15N CP/MAS spectra were recorded and quantum chemical calculations of chemical shielding tensors were carried out.
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