Geometry & MOs

Info

ID:	198317
PubChem CID:	79085648
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	264.195011
ΔH_f, kcal/mol:	46.63
Dipole, Da:	6.69
IP(EA), eV:	-9.02(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyanopiperazin-1-yl)-N-cycloheptylacetamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)CN3CCNCC3C#N

DOS

IR

Vibrations