Geometry & MOs

Info

ID:	84344
PubChem CID:	49865938
Reduced:	OS2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	222.111208
ΔH_f, kcal/mol:	-73.8
Dipole, Da:	2.31
IP(EA), eV:	-8.3(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(3-methylbutylsulfinylsulfanyl)butane

Drug info:

PubChemData

Smile

C1CCC(CC1)SS(=O)C2CCCCC2

DOS

IR

Vibrations