Geometry & MOs

Info

ID:

20859

PubChem CID:

586173

Reduced:

S2C15H16 (1)

Stoich.:

A2B15C16 (1)

Weight, g/mol:

260.069343

ΔHf, kcal/mol:

40.96

Dipole, Da:

3.15

IP(EA), eV:

-8.67(-0.27)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-methyl-2-[(2-methylphenyl)sulfanylmethylsulfanyl]benzene

Drug info:

PubChemData

Smile

CC1=CC=CC=C1SCSC2=CC=CC=C2C

DOS

IR

Vibrations