Geometry & MOs

Info

ID:	227547
PubChem CID:	87561965
Reduced:	ClNaSO3H8C14 (1)
Stoich.:	ABCD3E8F14 (1)
Weight, g/mol:	314.985862
ΔH_f, kcal/mol:	-120.19
Dipole, Da:	12.95
IP(EA), eV:	-8.91(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C2C=C3C(=CC2=C1)C=CC(=C3S(=O)(=O)[O-])Cl.[Na+]

DOS

IR

Vibrations