Geometry & MOs

Info

ID:	405825
PubChem CID:	135075585
Reduced:	NC12H19 (1)
Stoich.:	AB12C19 (1)
Weight, g/mol:	265.965126
ΔH_f, kcal/mol:	-11.77
Dipole, Da:	1.04
IP(EA), eV:	-9.43(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;6-hydroxy-3-methyl-1-benzofuran-2-sulfonate

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)C(C)CC(C)C

DOS

IR

Vibrations