Geometry & MOs

Info

ID:	56349
PubChem CID:	17425146
Reduced:	N3O4C17H19 (1)
Stoich.:	A3B4C17D19 (1)
Weight, g/mol:	300.111007
ΔH_f, kcal/mol:	-60.09
Dipole, Da:	8.44
IP(EA), eV:	-8.39(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxy-5-methylphenyl)-3-methyl-2-nitrobenzamide

Drug info:

PubChemData

Smile

CCNC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C)OC)[N+](=O)[O-]

DOS

IR

Vibrations