Geometry & MOs

Info

ID:	297478
PubChem CID:	117618705
Reduced:	NF3H8C11 (1)
Stoich.:	AB3C8D11 (1)
Weight, g/mol:	249.097663
ΔH_f, kcal/mol:	-120.06
Dipole, Da:	3.85
IP(EA), eV:	-9.66(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-6,6,6-trifluoro-2-pyridin-2-ylhexane-2,3-diol

Drug info:

PubChemData

Smile

CC1=C(C=CC2=C1C=CC=N2)C(F)(F)F

DOS

IR

Vibrations