Geometry & MOs

Info

ID:	8427
PubChem CID:	77652
Reduced:	SC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	246.053693
ΔH_f, kcal/mol:	30.68
Dipole, Da:	2.28
IP(EA), eV:	-8.8(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1SSC2=CC=CC=C2C

DOS

IR

Vibrations