Geometry & MOs

Info

ID:	338204
PubChem CID:	127258896
Reduced:	ClF2N2O2C8H9 (1)
Stoich.:	AB2C2D2E8F9 (1)
Weight, g/mol:	202.055384
ΔH_f, kcal/mol:	-185.3
Dipole, Da:	5.64
IP(EA), eV:	-10.14(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-(2,6-difluoropyridin-3-yl)propanoic acid

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1C[C@@H](C(=O)O)N)F)F.Cl

DOS

IR

Vibrations