Geometry & MOs

Info

ID:	293573
PubChem CID:	117393510
Reduced:	FO5C12H13 (1)
Stoich.:	AB5C12D13 (1)
Weight, g/mol:	256.074702
ΔH_f, kcal/mol:	-213.63
Dipole, Da:	3.3
IP(EA), eV:	-8.95(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(5-fluoro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)C1=CC(=C(C=C1OC)F)OC

DOS

IR

Vibrations