Geometry & MOs

Info

ID:	199420
PubChem CID:	79243582
Reduced:	N3C17H21 (1)
Stoich.:	A3B17C21 (1)
Weight, g/mol:	274.215747
ΔH_f, kcal/mol:	47.11
Dipole, Da:	2.14
IP(EA), eV:	-8.47(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-cyclopentylpiperazin-1-yl)methyl]-N-methylpyridin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=CC=CC(=N1)CN2CC3=CC=CC=C3C2

DOS

IR

Vibrations