Geometry & MOs

Info

ID:	249493
PubChem CID:	103089997
Reduced:	OSC15H22 (1)
Stoich.:	ABC15D22 (1)
Weight, g/mol:	204.154787
ΔH_f, kcal/mol:	-55.7
Dipole, Da:	1.59
IP(EA), eV:	-8.59(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7-dimethyl-1-methylsulfanyloctan-4-ol

Drug info:

PubChemData

Smile

CSCCCC(CC1=CC2=C(CCC2)C=C1)O

DOS

IR

Vibrations