Geometry & MOs

Info

ID:	198318
PubChem CID:	79085764
Reduced:	ON4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	292.109089
ΔH_f, kcal/mol:	-30.38
Dipole, Da:	1.97
IP(EA), eV:	-9.4(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-3-(2-cyanopiperazin-1-yl)propanamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)CN2CCNCC2C#N

DOS

IR

Vibrations