Geometry & MOs

Info

ID:	205049
PubChem CID:	80048218
Reduced:	ON4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	220.132411
ΔH_f, kcal/mol:	6.29
Dipole, Da:	1.45
IP(EA), eV:	-8.73(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]butan-1-ol

Drug info:

PubChemData

Smile

CCC(CO)NC1=NN2C(=CC=CC2=N1)C

DOS

IR

Vibrations