Geometry & MOs

Info

ID:	55177
PubChem CID:	17389857
Reduced:	NNaSO3H8C10 (1)
Stoich.:	ABCD3E8F10 (1)
Weight, g/mol:	223.030314
ΔH_f, kcal/mol:	-133.73
Dipole, Da:	10.95
IP(EA), eV:	-9.61(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylquinoline-8-sulfonic acid

Drug info:

PubChemData

Smile

CC1=NC2=C(C=CC=C2S(=O)(=O)[O-])C=C1.[Na+]

DOS

IR

Vibrations