Geometry & MOs

Info

ID:	17874
PubChem CID:	524801
Reduced:	SC12H26 (1)
Stoich.:	AB12C26 (1)
Weight, g/mol:	202.175522
ΔH_f, kcal/mol:	-55.49
Dipole, Da:	1.56
IP(EA), eV:	-8.41(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-pentylsulfanylheptane

Drug info:

PubChemData

Smile

CCCCCCCSCCCCC

DOS

IR

Vibrations