Geometry & MOs

Info

ID:	18903
PubChem CID:	550800
Reduced:	ClSC7H15 (1)
Stoich.:	ABC7D15 (1)
Weight, g/mol:	166.058299
ΔH_f, kcal/mol:	-41.23
Dipole, Da:	2.41
IP(EA), eV:	-8.82(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloroethylsulfanyl)-3-methylbutane

Drug info:

PubChemData

Smile

CC(C)CCSCCCl

DOS

IR

Vibrations