Geometry & MOs

Info

ID:	287235
PubChem CID:	104234142
Reduced:	FN2O2C13H19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	289.078407
ΔH_f, kcal/mol:	-112.17
Dipole, Da:	6.42
IP(EA), eV:	-8.86(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(1-aminoethyl)-2-fluorophenoxy]-1,1-dioxothiolan-3-ol

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC(C)C(=O)N(C)C)F)N

DOS

IR

Vibrations