Geometry & MOs

Info

ID:	383205
PubChem CID:	134974795
Reduced:	NS2O4C23H23 (1)
Stoich.:	AB2C4D23E23 (1)
Weight, g/mol:	396.99973
ΔH_f, kcal/mol:	-85.0
Dipole, Da:	8.18
IP(EA), eV:	-7.86(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OCC[C@@H]2C[S+](=NC3=CC=CC=C23)(C4=CC=CC=C4)[O-]

DOS

IR

Vibrations