Geometry & MOs

Info

ID:	198639
PubChem CID:	79128618
Reduced:	SN2O2C16H16 (1)
Stoich.:	AB2C2D16E16 (1)
Weight, g/mol:	300.129634
ΔH_f, kcal/mol:	-39.53
Dipole, Da:	5.76
IP(EA), eV:	-8.64(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-5-methylphenyl)sulfanyl-N-(2,3-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N)SCC(=O)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations