Geometry & MOs

Info

ID:	292683
PubChem CID:	117356991
Reduced:	FO5C11H11 (1)
Stoich.:	AB5C11D11 (1)
Weight, g/mol:	242.059052
ΔH_f, kcal/mol:	-221.09
Dipole, Da:	1.94
IP(EA), eV:	-9.32(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(7-fluoro-1,3-benzodioxol-5-yl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=C2C(=C(C=C1)F)OCO2)O

DOS

IR

Vibrations