Geometry & MOs

Info

ID:	292963
PubChem CID:	117367158
Reduced:	F3O3H9C11 (1)
Stoich.:	A3B3C9D11 (1)
Weight, g/mol:	246.070365
ΔH_f, kcal/mol:	-252.92
Dipole, Da:	7.14
IP(EA), eV:	-9.8(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2,4-difluoro-6-methoxyphenyl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

C1CC1(C2=C(C(=CC=C2)C(F)(F)F)O)C(=O)O

DOS

IR

Vibrations