Geometry & MOs

Info

ID:	337139
PubChem CID:	127256704
Reduced:	SO2C9H12 (1)
Stoich.:	AB2C9D12 (1)
Weight, g/mol:	188.01433
ΔH_f, kcal/mol:	-72.96
Dipole, Da:	2.43
IP(EA), eV:	-8.43(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1,1-dioxo-2H-thiopyran-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)CC1=CCSC=C1

DOS

IR

Vibrations