Geometry & MOs

Info

ID:	12505
PubChem CID:	138999
Reduced:	SC6H6 (2)
Stoich.:	AB6C6 (2)
Weight, g/mol:	220.038043
ΔH_f, kcal/mol:	46.79
Dipole, Da:	1.64
IP(EA), eV:	-7.94(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,8-bis(methylsulfanyl)naphthalene

Drug info:

PubChemData

Smile

CSC1=CC=CC2=C1C(=CC=C2)SC

DOS

IR

Vibrations