Geometry & MOs

Info

ID:	441528
PubChem CID:	135235776
Reduced:	F2O2N3H13C19 (1)
Stoich.:	A2B2C3D13E19 (1)
Weight, g/mol:	360.108562
ΔH_f, kcal/mol:	-59.31
Dipole, Da:	4.87
IP(EA), eV:	-9.5(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(methoxymethyl)phenyl]-2-[6-(trifluoromethyl)pyridin-3-yl]oxypyridine

Drug info:

PubChemData

Smile

CC(C1=NC=C(C=C1)OC2=C(C=CC=N2)C3=C4C(=CC=C3)N=CO4)(F)F

DOS

IR

Vibrations