Geometry & MOs

Info

ID:	432078
PubChem CID:	135172210
Reduced:	SO5C9H12 (1)
Stoich.:	AB5C9D12 (1)
Weight, g/mol:	232.040545
ΔH_f, kcal/mol:	-225.32
Dipole, Da:	4.73
IP(EA), eV:	-9.94(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(2-methoxy-2-oxoethyl)-5-oxothiolane-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1CSC(=O)C1CC(=O)O

DOS

IR

Vibrations