Geometry & MOs

Info

ID:	6495
PubChem CID:	68759
Reduced:	SN2O6C7H14 (1)
Stoich.:	AB2C6D7E14 (1)
Weight, g/mol:	254.057257
ΔH_f, kcal/mol:	-270.89
Dipole, Da:	4.8
IP(EA), eV:	-10.55(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-5-oxo-5-(2-sulfoethylamino)pentanoic acid

Drug info:

PubChemData

Smile

C(CC(=O)NCCS(=O)(=O)O)[C@@H](C(=O)O)N

DOS

IR

Vibrations