The e †ects of hydration on the structure and vibrational force Ðeld of the peptide group were examined by performing ab initio molecular orbital (MO) calculations on N-methylacetamide (NMA) and its clusters with up to three water molecules. The dielectric solvent e †ect was taken into account by th
✦ LIBER ✦
Force field of N-methylacetamide
✍ Scribed by J. Jakeš; B. Schneider
- Book ID
- 113371927
- Publisher
- Elsevier Science
- Year
- 1968
- Tongue
- English
- Weight
- 152 KB
- Volume
- 24
- Category
- Article
- ISSN
- 1386-1425
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Far-infrared spectra of N-methylacetamide and other monosubstituted amides were measured in the liquid state in the region from 250 to 60 cm. -I. Bands characteristic of the molecules with a peptide bond were found and assigned to the hydrogen-bond vibration and the C--N torsional vibration. Far-inf