Geometry & MOs

Info

ID:	338627
PubChem CID:	127259638
Reduced:	NO3H8C17F17 (1)
Stoich.:	AB3C8D17E17 (1)
Weight, g/mol:	607.044007
ΔH_f, kcal/mol:	-913.83
Dipole, Da:	3.76
IP(EA), eV:	-10.6(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-1,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluoronon-1-enoxy]-N-prop-2-enylbenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NCO)O/C(=C(/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\F)/F

DOS

IR

Vibrations