Geometry & MOs

Info

ID:	262534
PubChem CID:	103298923
Reduced:	FSN2O4C13H19 (1)
Stoich.:	ABC2D4E13F19 (1)
Weight, g/mol:	308.030077
ΔH_f, kcal/mol:	-205.19
Dipole, Da:	8.38
IP(EA), eV:	-10.19(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(3-fluoropyridin-2-yl)sulfonylamino]-4-methylsulfanylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)CC(CC(=O)O)NS(=O)(=O)C1=C(C=CC=N1)F

DOS

IR

Vibrations