Geometry & MOs

Info

ID:	249503
PubChem CID:	103090068
Reduced:	SO2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	246.107836
ΔH_f, kcal/mol:	-116.16
Dipole, Da:	3.97
IP(EA), eV:	-8.57(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylsulfanyl-1-naphthalen-1-ylbutan-1-ol

Drug info:

PubChemData

Smile

CSCCCC(C1CCOC2(C1)CCC2)O

DOS

IR

Vibrations