Geometry & MOs

Info

ID:	55178
PubChem CID:	17389858
Reduced:	NSO3H9C10 (1)
Stoich.:	ABC3D9E10 (1)
Weight, g/mol:	209.012259
ΔH_f, kcal/mol:	-84.61
Dipole, Da:	6.69
IP(EA), eV:	-9.93(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2,6-dimethylpyridine-3-sulfonate

Drug info:

PubChemData

Smile

CC1=NC2=C(C=CC=C2S(=O)(=O)O)C=C1

DOS

IR

Vibrations