Geometry & MOs

Info

ID:	373261
PubChem CID:	131312322
Reduced:	SO4H10C11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	240.025643
ΔH_f, kcal/mol:	-130.65
Dipole, Da:	2.27
IP(EA), eV:	-8.75(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-fluoro-6-(hydroxymethyl)-1-benzothiophene-3-carboxylate

Drug info:

PubChemData

Smile

COC1=C(C=CC2=C1C(=CS2)O)CC(=O)O

DOS

IR

Vibrations