Geometry & MOs

Info

ID:	18673
PubChem CID:	546094
Reduced:	SC5H11 (2)
Stoich.:	AB5C11 (2)
Weight, g/mol:	206.116293
ΔH_f, kcal/mol:	-51.49
Dipole, Da:	2.41
IP(EA), eV:	-8.68(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(butan-2-yldisulfanyl)hexane

Drug info:

PubChemData

Smile

CCCCCCSSC(C)CC

DOS

IR

Vibrations