Geometry & MOs

Info

ID:	277146
PubChem CID:	103827016
Reduced:	BrClON2H12C14 (1)
Stoich.:	ABCD2E12F14 (1)
Weight, g/mol:	339.9978
ΔH_f, kcal/mol:	-3.83
Dipole, Da:	3.97
IP(EA), eV:	-9.26(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(cyanomethyl)-N-cyclopentylbenzamide

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)NC(=O)C2=CC(=CC(=C2)Br)Cl)C

DOS

IR

Vibrations