Geometry & MOs

Info

ID:	49610
PubChem CID:	11533357
Reduced:	SN5O5C24H27 (1)
Stoich.:	AB5C5D24E27 (1)
Weight, g/mol:	497.117809
ΔH_f, kcal/mol:	-78.91
Dipole, Da:	8.47
IP(EA), eV:	-8.81(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-(3,4,5-trimethoxyphenyl)-N-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]sulfinylethenesulfinamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2CN(CC3)C4=NC=NC5=C6C(=C(C=C54)OC)OCO6

DOS

IR

Vibrations