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Infrared and Raman spectra of 2-chloro-2,2-difluoroacetamide (ClF2CC(O)NH2) |
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| Authors: | Ana G. Iriarte, Edgardo H. Cutin,Carlos O. Della V dova |
| Affiliation: | aInstituto de Química Física, Facultad de Bioquímica, Química y Farmacia, Universidad Nacional de Tucumán, San Lorenzo 456, (4000) Tucumán, Argentina bCEQUINOR (CONICET-UNLP) and Laboratorio de Servicios a la Industria y al Sistema Científico (UNLP-CIC-CONICET), Departamento de Química, Facultad de Ciencias Exactas, Universidad Nacional de La Plata, 47 esq. 115, (1900) La Plata, Argentina |
| Abstract: | The infrared and Raman spectra of 2-chloro-2,2-difluoroacetamide (ClF2CC(O)NH2) have been recorded and analyzed with the complement of results derived from computational chemistry calculations. Thus, delocalization effects and stabilization energies have been computed for the title molecule and a complete assignment has been also proposed. 13C, 19F and 1H NMR chemical shifts and coupling constants have been also measured for this substance. |
| Keywords: | 2-Chloro-2,2-difluoroacetamide Vibrational spectra NMR spectra Computational chemistry |
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