Vibrational spectra, Hirshfeld surface analysis, molecular docking studies of (RS)-N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide by DFT approach

The Cyclophosphamide (CYC) is used as an anti cancer agent. It is chemically known as (RS)-N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide. The vibrational assignments survey of the CYC was implemented by employing FT-IR and FT-Raman spectroscopic investigation and the results are compa...

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Bibliographic Details
Main Authors: M. Govindammal, M. Prasath
Format: Article
Language:English
Published: Elsevier 2020-08-01
Series:Heliyon
Subjects:
DFT
Online Access:http://www.sciencedirect.com/science/article/pii/S2405844020314857