title: FT-IR, FT-Raman and DFT calculations of 4-chloro-2-(3,4-dichlorophenylcarbamoyl)phenyl acetate.
abstract: FT-IR and FT-Raman spectra of 4-chloro-2-(3,4-dichlorophenylcarbamoyl)phenyl acetate were recorded and analyzed. Synthesis and elemental analysis are also reported. The vibrational wavenumbers of the compound have been computed on the basis of density functional theory using B3LYP/6-31G* basis set. The predicted infrared intensities and Raman activities are reported.
authors.affiliation: Department of Physics, MES Ponnani College, Ponnani South, Malappuram, Kerala, India.
authors.forename: V S
authors.initials: VS
authors.lastname: Madhavan
authors.forename: Hema Tresa
authors.initials: HT
authors.lastname: Varghese
authors.forename: Samuel
authors.initials: S
authors.lastname: Mathew
authors.forename: Jarmila
authors.initials: J
authors.lastname: Vinsova
authors.forename: C Yohannan
authors.initials: CY
authors.lastname: Panicker
mesh_terms: D002219:Carbamates / Q000737:chemistry; D008958:Models, Molecular; D010648:Phenylacetates / Q000737:chemistry*; D017550:Spectroscopy, Fourier Transform Infrared / Q000379:methods*; D013059:Spectrum Analysis, Raman / Q000379:methods*; D014732:Vibration
chemical_list: C539453:4-chloro-2-(3,4-dichlorophenylcarbamoyl)phenyl acetate; D002219:Carbamates; D010648:Phenylacetates; C025136:phenylacetic acid