Geometry & MOs

Info

ID:	374441
PubChem CID:	131329522
Reduced:	FN3H10C11 (1)
Stoich.:	AB3C10D11 (1)
Weight, g/mol:	339.94755
ΔH_f, kcal/mol:	16.72
Dipole, Da:	3.69
IP(EA), eV:	-9.01(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-amino-3-(6-chloro-4-iodopyridin-3-yl)butanoic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1F)NC(=C2)[C@@H](CC#N)N

DOS

IR

Vibrations