Geometry & MOs

Info

ID:	348363
PubChem CID:	127273428
Reduced:	ON4C17H20 (1)
Stoich.:	AB4C17D20 (1)
Weight, g/mol:	337.153875
ΔH_f, kcal/mol:	3.97
Dipole, Da:	2.87
IP(EA), eV:	-9.46(-0.32)
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-(4-oxoquinolin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3=CC=CC4=C3CCC4

DOS

IR

Vibrations