Geometry & MOs

Info

ID:	441936
PubChem CID:	135246805
Reduced:	O2N4H22C23 (1)
Stoich.:	A2B4C22D23 (1)
Weight, g/mol:	366.079154
ΔH_f, kcal/mol:	47.65
Dipole, Da:	2.61
IP(EA), eV:	-8.75(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CCC2=CC=C(C=C2)OC3=C(C=CC=N3)C4=C(N=CC=C4)OC

DOS

IR

Vibrations