Geometry & MOs

Info

ID:	324969
PubChem CID:	126678980
Reduced:	FO2N6H19C20 (1)
Stoich.:	AB2C6D19E20 (1)
Weight, g/mol:	487.157972
ΔH_f, kcal/mol:	5.84
Dipole, Da:	2.44
IP(EA), eV:	-8.54(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[4-(6-morpholin-4-ylpyridin-3-yl)-2-(trifluoromethoxy)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C(=O)C2=CC(=C(C=C2)F)COC3=CC(=NC4=C3NNN4)N

DOS

IR

Vibrations