Geometry & MOs

Info

ID:	7973
PubChem CID:	74552
Reduced:	SC7H16 (1)
Stoich.:	AB7C16 (1)
Weight, g/mol:	132.097272
ΔH_f, kcal/mol:	-42.5
Dipole, Da:	2.24
IP(EA), eV:	-8.82(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylhexane-2-thiol

Drug info:

PubChemData

Smile

CCCCC(C)(C)S

DOS

IR

Vibrations