Geometry & MOs

Info

ID:	264645
PubChem CID:	103479428
Reduced:	BrClON2C9H10 (1)
Stoich.:	ABCD2E9F10 (1)
Weight, g/mol:	351.9978
ΔH_f, kcal/mol:	-33.56
Dipole, Da:	0.86
IP(EA), eV:	-9.37(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-aminoethyl)-N-(2-bromo-3-chlorophenyl)benzamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=C(C(=CC=C1)Cl)Br)N

DOS

IR

Vibrations