Geometry & MOs

Info

ID:	10552
PubChem CID:	104225
Reduced:	O2F5C8H9 (1)
Stoich.:	A2B5C8D9 (1)
Weight, g/mol:	232.05227
ΔH_f, kcal/mol:	-346.19
Dipole, Da:	3.94
IP(EA), eV:	-10.93(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,4,4,4-pentafluorobutyl 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCCC(C(F)(F)F)(F)F

DOS

IR

Vibrations