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The structural study of acetohydroxamic and oxalodihydroxamic acids in DMSO solution based on the DFT calculations of NMR spectra

✍ Scribed by Agnieszka Kaczor; Leonard M Proniewicz

Book ID: 103836559
Publisher: Elsevier Science
Year: 2004
Tongue: English
Weight: 296 KB
Volume: 704
Category: Article
ISSN: 0022-2860
DOI: 10.1016/j.molstruc.2004.01.067

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## Abstract 1‐Hydroxymethylindazole and 1‐hydroxymethylbenzotriazole have been studied in solution by ^1^H, ^13^C and ^15^N NMR spectroscopy and the X‐ray structure of the second compound determined. DFT and GIAO calculations have been used to discuss geometries, energies (comparatively with 2‐subs