Geometry & MOs

Info

ID:	143282
PubChem CID:	53179346
Reduced:	O3N6C17H20 (1)
Stoich.:	A3B6C17D20 (1)
Weight, g/mol:	390.180424
ΔH_f, kcal/mol:	2.98
Dipole, Da:	3.31
IP(EA), eV:	-9.64(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethylphenyl)-2-[6-(3-propyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

CCCC1=NOC(=N1)C2=CC=CN3C2=NN=C3CC(=O)N4CCOCC4

DOS

IR

Vibrations