Geometry & MOs

Info

ID:	252259
PubChem CID:	103110128
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	270.136828
ΔH_f, kcal/mol:	-35.9
Dipole, Da:	4.29
IP(EA), eV:	-8.43(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-2-methylphenyl)methyl]-2-(2-hydroxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1N)CNC(=O)C2=C(C=CS2)OC

DOS

IR

Vibrations