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. 2023 Jan 27;4(1):102068. doi: 10.1016/j.xpro.2023.102068

Table 1.

Assignment to vibrations of the various molecules used in the present study

Analytes Peak position (cm-1) Assignments
Crystal violet9 918 Ring skeletal vibration
1181 Ring C−H bending a
1379 N-phenyl stretching
1530 and 1621 Ring C−C stretching
Adenine10 534 Wagging C2-H, N9-H13
621 Ring deformation
722 Ring breath
1125 Stretching C8-N9, bending N9-H, C8-H
1246 Rocking NH2, stretching C5-N7, N1-C2, C2-N3
1330 Stretching C5-N7, N1-C2, C3-N3, C5-C6, bending C2/8-H
1481 Stretching C2-N3, N1-C6, bending C2-H, scissoring NH2
Cytosine10 604 Bending C2=O
792 Ring breathing
1115 C=O
1251 Ring stretching C-N
1368 Bending N1-H, C5-H, C6-H
1524 Stretching N3-C4-C5
1641 Stretching C2=O
Penicillin-G11,12 985 β-lactam ring
1586 Stretching of C-O
1668 C=O