Geometry & MOs

Info

ID:

18931

PubChem CID:

551138

Reduced:

SN2C4 (2)

Stoich.:

AB2C4 (2)

Weight, g/mol:

215.956438

ΔHf, kcal/mol:

178.09

Dipole, Da:

1.66

IP(EA), eV:

-9.76(-2.72)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1,4-dithiine-2,3,5,6-tetracarbonitrile

Drug info:

PubChemData

Smile

C(#N)C1=C(SC(=C(S1)C#N)C#N)C#N

DOS

IR

Vibrations