Geometry & MOs

Info

ID:	205050
PubChem CID:	80048219
Reduced:	ON4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	294.135972
ΔH_f, kcal/mol:	7.95
Dipole, Da:	2.19
IP(EA), eV:	-8.67(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

Drug info:

PubChemData

Smile

CCC(CO)NC1=NN2C=CC=C(C2=N1)C

DOS

IR

Vibrations