Geometry & MOs

Info

ID:	288037
PubChem CID:	104309382
Reduced:	ClNO3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	219.027391
ΔH_f, kcal/mol:	-117.02
Dipole, Da:	7.7
IP(EA), eV:	-9.33(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-3-[methyl(2,2,2-trifluoroethyl)amino]propanoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(C)CC(C(=O)O)Cl

DOS

IR

Vibrations