3-(5-Phenyl-2H-tetrazol-2-yl)pyridine

3-(5-Phenyl-2H-tetrazol-2-yl)pyridine was synthesized by treating 5-phenyl-1H-tetrazole with pyridin-3-ylboronic acid under Chan–Evans–Lam coupling conditions. The structure and identity were confirmed by 1H, 13C-NMR spectroscopy, IR spectroscopy, UV–Vis spectroscopy, high-resolution mass spectromet...

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Bibliographic Details
Published in:MolBank 2023-02, Vol.2023 (1), p.M1598
Main Authors: Ershov, Ivan S, Esikov, Kirill A, Nesterova, Olga M, Skryl’nikova, Mariya A, Khramchikhin, Andrey V, Shmaneva, Nadezda T, Chernov, Ivan S, Chernova, Ekaterina N, Puzyk, Aleksandra M, Sivtsov, Eugene V, Pavlyukova, Yuliya N, Trifonov, Rostislav E, Ostrovskii, Vladimir A
Format: Article
Language:English
Subjects:
3-(5-phenyl-2H-tetrazol-2-yl)pyridine
Analgesics
Analysis
Biological activity
Chemical synthesis
Diffraction
Hydrocarbons
Identification and classification
Infrared spectroscopy
Mass spectrometry
Methods
Molecular structure
Nitrogen
NMR spectroscopy
Nuclear magnetic resonance spectroscopy
Pyridine
Pyridines
Quantum chemistry
quantum chemistry calculation
Spectrum analysis
Structure
synthesis
Tetrazoles
X-ray diffraction analysis
X-rays
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Description
Summary:3-(5-Phenyl-2H-tetrazol-2-yl)pyridine was synthesized by treating 5-phenyl-1H-tetrazole with pyridin-3-ylboronic acid under Chan–Evans–Lam coupling conditions. The structure and identity were confirmed by 1H, 13C-NMR spectroscopy, IR spectroscopy, UV–Vis spectroscopy, high-resolution mass spectrometry, and TLC. The molecular structure was studied experimentally by sequential X-ray diffraction analysis and theoretically by DFT B3LYP quantum chemistry calculation.
ISSN:1422-8599
1422-8599
DOI:10.3390/M1598