Geometry & MOs

Info

ID:	336806
PubChem CID:	127255813
Reduced:	O2F3N3H8C13 (1)
Stoich.:	A2B3C3D8E13 (1)
Weight, g/mol:	213.021305
ΔH_f, kcal/mol:	-137.48
Dipole, Da:	5.42
IP(EA), eV:	-10.15(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-difluoropyridin-4-yl)-2,2,2-trifluoroethanol

Drug info:

PubChemData

Smile

COC(=O)C1=CN(N=C1)C2=CC(=C(C=C2)C#N)C(F)(F)F

DOS

IR

Vibrations