Geometry & MOs

Info

ID:	324939
PubChem CID:	126678827
Reduced:	OF2N5C29H35 (1)
Stoich.:	AB2C5D29E35 (1)
Weight, g/mol:	432.115773
ΔH_f, kcal/mol:	-81.89
Dipole, Da:	7.66
IP(EA), eV:	-8.16(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)N1CCN(CC1)C2=CC=C(C=C2)C3=CC4=C(C=C3)N5C=C(N=C5CO4)CN6CCC(CC6)(F)F

DOS

IR

Vibrations