Geometry & MOs

Info

ID:	433123
PubChem CID:	135173260
Reduced:	SC10H18 (1)
Stoich.:	AB10C18 (1)
Weight, g/mol:	235.106457
ΔH_f, kcal/mol:	-4.93
Dipole, Da:	2.14
IP(EA), eV:	-8.4(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfanyl-4-(3-methylsulfanyloxypropyl)piperidine

Drug info:

PubChemData

Smile

CCC(C=CC)(C=CC)SC

DOS

IR

Vibrations