Geometry & MOs

Info

ID:	62521
PubChem CID:	26719830
Reduced:	OSN2H16C17 (1)
Stoich.:	ABC2D16E17 (1)
Weight, g/mol:	362.093643
ΔH_f, kcal/mol:	7.95
Dipole, Da:	6.12
IP(EA), eV:	-8.17(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-5-methoxy-N-(3-methylsulfanylphenyl)-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C(=O)NC3=CC(=CC=C3)SC

DOS

IR

Vibrations