Geometry & MOs

Info

ID:	348541
PubChem CID:	127273652
Reduced:	ON8C15H16 (1)
Stoich.:	AB8C15D16 (1)
Weight, g/mol:	321.15896
ΔH_f, kcal/mol:	86.81
Dipole, Da:	2.46
IP(EA), eV:	-9.73(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-quinolin-8-ylacetamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3=CN=C(C=C3)N4C=NC=N4

DOS

IR

Vibrations