Geometry & MOs

Info

ID:	289466
PubChem CID:	104356353
Reduced:	BrClSN2H4O4C8 (1)
Stoich.:	ABCD2E4F4G8 (1)
Weight, g/mol:	353.97707
ΔH_f, kcal/mol:	-93.08
Dipole, Da:	2.58
IP(EA), eV:	-10.8(-2.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-4-methoxyphenyl)-3-bromo-2-chlorobenzamide

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1C(=O)O)Cl)Br)S(=O)(=O)NC#N

DOS

IR

Vibrations