Geometry & MOs

Info

ID:	407745
PubChem CID:	135080500
Reduced:	O2F3C11H11 (1)
Stoich.:	A2B3C11D11 (1)
Weight, g/mol:	188.121258
ΔH_f, kcal/mol:	-200.96
Dipole, Da:	4.39
IP(EA), eV:	-9.09(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-tert-butyl-2-fluorobut-3-enoate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COC(=C)C(F)(F)F

DOS

IR

Vibrations