Geometry & MOs

Info

ID:	22179
PubChem CID:	596162
Reduced:	SO5H12C15 (1)
Stoich.:	AB5C12D15 (1)
Weight, g/mol:	304.040545
ΔH_f, kcal/mol:	-130.32
Dipole, Da:	3.64
IP(EA), eV:	-9.06(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] thiophene-2-carboxylate

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)C(=O)COC(=O)C3=CC=CS3

DOS

IR

Vibrations