Geometry & MOs

Info

ID:	48124
PubChem CID:	10537323
Reduced:	OC3H5 (4)
Stoich.:	AB3C5 (4)
Weight, g/mol:	227.991486
ΔH_f, kcal/mol:	-194.37
Dipole, Da:	1.22
IP(EA), eV:	-9.75(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[hydroxy(methoxy)methylidene]-7H-thieno[2,3-c]thiopyran-4-one

Drug info:

PubChemData

Smile

CC1([C@H](C[C@H]1C2(OCCO2)C)C(=O)OC)C

DOS

IR

Vibrations