Geometry & MOs

Info

ID:	18110
PubChem CID:	538246
Reduced:	OSC8H16 (1)
Stoich.:	ABC8D16 (1)
Weight, g/mol:	160.092186
ΔH_f, kcal/mol:	-76.92
Dipole, Da:	1.55
IP(EA), eV:	-9.34(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-hexyl ethanethioate

Drug info:

PubChemData

Smile

CCCCCCSC(=O)C

DOS

IR

Vibrations