3 NMR data are reported for 42 szoles, taken mostly at a standard concentration and in a common solvent (0.5 M dimethyl sulfoxide with a 0.01 M increment of Cr(acac), for each nitrogen atom present). Signal assignments were assisted by comparison witb ' " N line widths, the use of zJ(15N'H) coupling
A 15N NMR investigation of some azolopyridines
β Scribed by L. Stefaniak; John D. Roberts; M. Witanowski; B. T. Hamdi; G. A. Webb
- Publisher
- John Wiley and Sons
- Year
- 1984
- Tongue
- English
- Weight
- 421 KB
- Volume
- 22
- Category
- Article
- ISSN
- 0749-1581
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β¦ Synopsis
N NMR chemical shift data are presented for 14 azolopyridines, together with the results of INDO/S-SOS calculations of nitrogen shieldings. Previous ' " N NMR results for some of these compounds are reinterpreted. The ' " N data and their assignments are shown to be reliable for the indolizine nitrogen atom from arguments based on relative line widths. The pyridine-type nitrogens are more reliably assigned from the "N spectra combined with the results of the INDo/S-SOS calculations for individual molecules. A combination of ' " N and "N NMR spectra, together with the shielding calculations, provides a basis for unambiguous assignments of all the varions nitrogen environments considered.
π SIMILAR VOLUMES
N NMR Shielding measurements are reported for a series of derivatives of some thiolopyridines. The results obtained are used to provide quantitatively reliable estimates of three tautomeric equilibria involving the pyridine nitrogen atom.
## Abstract The ^13^C, ^15^N and ^77^Se NMR data (chemical shifts and coupling constants) of some cycloakenoβ1,2,3βselenadiazoles are presented. Extremely large ^77^Se chemical shifts are found. ^15^N, ^77^Se coupling constants, obtained at natural abundance, are reported for the first time. Strong