Geometry & MOs

Info

ID:	276686
PubChem CID:	103824706
Reduced:	BrClON2H10C13 (1)
Stoich.:	ABCD2E10F13 (1)
Weight, g/mol:	325.98215
ΔH_f, kcal/mol:	6.01
Dipole, Da:	5.34
IP(EA), eV:	-9.21(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-chlorophenyl)-1-cyanocyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)C(=O)NC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations