Geometry & MOs

Info

ID:	272553
PubChem CID:	103746130
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	238.179361
ΔH_f, kcal/mol:	-21.12
Dipole, Da:	5.97
IP(EA), eV:	-8.88(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[propan-2-yl(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amino]ethanol

Drug info:

PubChemData

Smile

CC(C)(C)C(CCO)NC1=NC=NC2=CC=CC=C21

DOS

IR

Vibrations