Geometry & MOs

Info

ID:	375370
PubChem CID:	131500120
Reduced:	NOF2H2C4 (2)
Stoich.:	ABC2D2E4 (2)
Weight, g/mol:	236.02089
ΔH_f, kcal/mol:	-225.21
Dipole, Da:	4.63
IP(EA), eV:	-9.98(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-fluoro-3-hydroxy-6-(trifluoromethoxy)pyridin-2-yl]acetonitrile

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=N1)OC(F)(F)F)F)CC#N)O

DOS

IR

Vibrations