Geometry & MOs

Info

ID:

215864

PubChem CID:

85085362

Reduced:

C13H20 (1)

Stoich.:

A13B20 (1)

Weight, g/mol:

177.010916

ΔHf, kcal/mol:

23.05

Dipole, Da:

1.12

IP(EA), eV:

-9.01(0.43)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-amino-3-sulfanylidene-2H-pyrazine-2,6-dicarbonitrile

Drug info:

PubChemData

Smile

CC(=C)C=CCCCC=C(C)C=C

DOS

IR

Vibrations