Geometry & MOs

Info

ID:	50309
PubChem CID:	12012826
Reduced:	NaPSO3H18C20 (1)
Stoich.:	ABCD3E18F20 (1)
Weight, g/mol:	370.079253
ΔH_f, kcal/mol:	-116.9
Dipole, Da:	2.79
IP(EA), eV:	-8.36(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-diphenylphosphanyl-2,4-dimethylbenzenesulfonic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1P(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)[O-])C.[Na+]

DOS

IR

Vibrations