Geometry & MOs

Info

ID:	408363
PubChem CID:	135081129
Reduced:	ClNOC11H14 (1)
Stoich.:	ABCD11E14 (1)
Weight, g/mol:	239.025229
ΔH_f, kcal/mol:	-38.52
Dipole, Da:	4.09
IP(EA), eV:	-9.79(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-amino-3-phenylsulfanylbutanedioate

Drug info:

PubChemData

Smile

C[C@@H](CCC(=O)C1=CC=C(C=C1)Cl)N

DOS

IR

Vibrations