Geometry & MOs

Info

ID:	2654
PubChem CID:	8195
Reduced:	SC12H26 (1)
Stoich.:	AB12C26 (1)
Weight, g/mol:	202.175522
ΔH_f, kcal/mol:	-58.78
Dipole, Da:	2.1
IP(EA), eV:	-8.92(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dodecane-1-thiol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCS

DOS

IR

Vibrations