Geometry & MOs

Info

ID:	262726
PubChem CID:	103312333
Reduced:	ON3F6C11H15 (1)
Stoich.:	AB3C6D11E15 (1)
Weight, g/mol:	248.027198
ΔH_f, kcal/mol:	-320.33
Dipole, Da:	4.57
IP(EA), eV:	-9.06(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-1-(furan-2-yl)-2-(trifluoromethyl)propan-1-ol

Drug info:

PubChemData

Smile

CCN1C(=C(C=N1)OC)C(C(C(F)(F)F)C(F)(F)F)NC

DOS

IR

Vibrations