Geometry & MOs

Info

ID:	287198
PubChem CID:	104233972
Reduced:	FNOSC17H18 (1)
Stoich.:	ABCDE17F18 (1)
Weight, g/mol:	255.127072
ΔH_f, kcal/mol:	-48.64
Dipole, Da:	1.89
IP(EA), eV:	-8.65(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(1-aminoethyl)-2-fluorophenoxy]-2,2-dimethylpropanoic acid

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2CC3=CC=CC=C3S2)F)N

DOS

IR

Vibrations