Geometry & MOs

Info

ID:	18783
PubChem CID:	548200
Reduced:	SN2O4C8H14 (1)
Stoich.:	AB2C4D8E14 (1)
Weight, g/mol:	234.067428
ΔH_f, kcal/mol:	-185.15
Dipole, Da:	4.51
IP(EA), eV:	-9.56(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-acetamido-3-(methylcarbamoylsulfanyl)propanoate

Drug info:

PubChemData

Smile

CC(=O)NC(CSC(=O)NC)C(=O)OC

DOS

IR

Vibrations