Geometry & MOs

Info

ID:	61122
PubChem CID:	26705854
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	340.96183
ΔH_f, kcal/mol:	-122.12
Dipole, Da:	5.19
IP(EA), eV:	-8.28(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2-chlorophenyl)-3-fluoro-4-methylbenzamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)/C=C/C2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations