Geometry & MOs

Info

ID:	209164
PubChem CID:	80633798
Reduced:	N3C15H19 (1)
Stoich.:	A3B15C19 (1)
Weight, g/mol:	276.231397
ΔH_f, kcal/mol:	50.13
Dipole, Da:	0.8
IP(EA), eV:	-8.24(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(4-ethylpiperazin-1-yl)-5-methylpyridin-3-yl]butan-2-amine

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1)C2=NC=C(C=C2)CCN

DOS

IR

Vibrations