Geometry & MOs

Info

ID:	205046
PubChem CID:	80048091
Reduced:	ClON5C11H14 (1)
Stoich.:	ABC5D11E14 (1)
Weight, g/mol:	274.190595
ΔH_f, kcal/mol:	24.43
Dipole, Da:	4.62
IP(EA), eV:	-8.75(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C(=O)CCNC1=NN2C=C(C=CC2=N1)Cl

DOS

IR

Vibrations