Geometry & MOs

Info

ID:	46908
PubChem CID:	10528293
Reduced:	SSiO4C26H32 (1)
Stoich.:	ABC4D26E32 (1)
Weight, g/mol:	467.842541
ΔH_f, kcal/mol:	-171.61
Dipole, Da:	5.6
IP(EA), eV:	-8.85(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(thian-4-ylidene)-[1,3]dithiolo[4,5-d][1,3]dithiol-5-ylidene]-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](C)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations