Geometry & MOs

Info

ID:	259874
PubChem CID:	103176227
Reduced:	NOSC10H15 (1)
Stoich.:	ABCD10E15 (1)
Weight, g/mol:	225.118735
ΔH_f, kcal/mol:	-30.02
Dipole, Da:	3.28
IP(EA), eV:	-8.83(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethyl-6-methylpyridin-3-yl)oxy-2-methylpropane-1-thiol

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)OCCS

DOS

IR

Vibrations