Geometry & MOs

Info

ID:	12330
PubChem CID:	135117
Reduced:	N2S2O6C23H24 (1)
Stoich.:	A2B2C6D23E24 (1)
Weight, g/mol:	488.107579
ΔH_f, kcal/mol:	-207.77
Dipole, Da:	6.41
IP(EA), eV:	-9.64(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-2,3-bis[(2-benzoylsulfanylacetyl)amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](CNC(=O)CSC(=O)C1=CC=CC=C1)NC(=O)CSC(=O)C2=CC=CC=C2

DOS

IR

Vibrations