Molecular structure, FT-IR, FT-Raman, NBO, HOMO and LUMO, MEP, NLO and molecular docking study of 2-[(E)-2-(2-bromophenyl)ethenyl]quinoline-6-carboxylic acid.

doi:10.1016/j.saa.2015.06.077

Paper

Molecular structure, FT-IR, FT-Raman, NBO, HOMO and LUMO, MEP, NLO and molecular docking study of 2-[(E)-2-(2-bromophenyl)ethenyl]quinoline-6-carboxylic acid.

Published Dec 5, 2015 · Rajeev T. Ulahannan, C. Panicker, H. Varghese

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

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33

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Abstract

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Study Snapshot

The compound 2-[(E)-2-(2-bromophenyl)ethenyl]quinoline-6-carboxylic acid shows potential inhibitory activity against PknB, which may lead to the development of new anti-tuberculostic agents.

PopulationOlder adults (50-71 years)

Sample size24

MethodsObservational

OutcomesBody Mass Index projections

ResultsSocial networks mitigate obesity in older groups.

Molecular structure, FT-IR, FT-Raman, NBO, HOMO and LUMO, MEP, NLO and molecular docking study of 2-[(E)-2-(2-bromophenyl)ethenyl]quinoline-6-carboxylic acid.

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