Geometry & MOs

Info

ID:	224339
PubChem CID:	85341826
Reduced:	SO2H16C22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	349.222211
ΔH_f, kcal/mol:	53.64
Dipole, Da:	4.17
IP(EA), eV:	-9.28(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC(=CS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations