Geometry & MOs

Info

ID:	276454
PubChem CID:	103823378
Reduced:	BrClNO2C9H9 (1)
Stoich.:	ABCD2E9F9 (1)
Weight, g/mol:	337.98215
ΔH_f, kcal/mol:	-65.0
Dipole, Da:	4.94
IP(EA), eV:	-8.87(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-3-chloroanilino)-N-phenylacetamide

Drug info:

PubChemData

Smile

COC(=O)CNC1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations