Geometry & MOs

Info

ID:	279164
PubChem CID:	103841788
Reduced:	BrClON2C14H16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	330.01345
ΔH_f, kcal/mol:	-4.33
Dipole, Da:	2.09
IP(EA), eV:	-9.12(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]benzamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)C3=CC(=C(C=C3)Cl)Br

DOS

IR

Vibrations