Geometry & MOs

Info

ID:	55814
PubChem CID:	17396608
Reduced:	O2N3C18H19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	302.082205
ΔH_f, kcal/mol:	-25.08
Dipole, Da:	3.33
IP(EA), eV:	-8.9(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetamido-N-(5-chloro-2-methylphenyl)benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CC(=O)NCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations