Geometry & MOs

Info

ID:	204990
PubChem CID:	80039701
Reduced:	SC6H12 (2)
Stoich.:	AB6C12 (2)
Weight, g/mol:	232.131943
ΔH_f, kcal/mol:	-42.95
Dipole, Da:	0.86
IP(EA), eV:	-8.48(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-3-(3-methylcyclohexyl)sulfanylpropane-1-thiol

Drug info:

PubChemData

Smile

CC(C)SCC1(CCCCCC1)CS

DOS

IR

Vibrations