Geometry & MOs

Info

ID:	327100
PubChem CID:	126688997
Reduced:	NSO10C17H27 (1)
Stoich.:	ABC10D17E27 (1)
Weight, g/mol:	319.036188
ΔH_f, kcal/mol:	-471.36
Dipole, Da:	6.41
IP(EA), eV:	-10.33(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-acetamido-3-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxycarbonylsulfanyl]propanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OCOC(=O)N[C@@H](CSC(=O)OCOC(=O)C(C)(C)C)C(=O)O

DOS

IR

Vibrations