Geometry & MOs

Info

ID:	262589
PubChem CID:	103303045
Reduced:	SO2N3C10H17 (1)
Stoich.:	AB2C3D10E17 (1)
Weight, g/mol:	249.061278
ΔH_f, kcal/mol:	-63.31
Dipole, Da:	5.33
IP(EA), eV:	-9.07(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-amino-2-(2,4,5-trifluorophenyl)ethoxy]acetic acid

Drug info:

PubChemData

Smile

CCCCN(C)S(=O)(=O)C1=C(C=CC=N1)N

DOS

IR

Vibrations