Geometry & MOs

Info

ID:	341974
PubChem CID:	127264667
Reduced:	ClFNO2C11H15 (1)
Stoich.:	ABCD2E11F15 (1)
Weight, g/mol:	252.043233
ΔH_f, kcal/mol:	-162.65
Dipole, Da:	2.86
IP(EA), eV:	-9.55(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-(6-methylpyridin-3-yl)propanoic acid;dihydrochloride

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H](CC1=CC=C(C=C1)F)N.Cl

DOS

IR

Vibrations