Geometry & MOs

Info

ID:	205191
PubChem CID:	80066871
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	287.119129
ΔH_f, kcal/mol:	-130.82
Dipole, Da:	4.96
IP(EA), eV:	-8.89(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethylsulfonyl-1-(6-methoxypyridin-3-yl)pentan-2-ol

Drug info:

PubChemData

Smile

COC1=NC=C(C=C1)CC(CCCC2CCCO2)O

DOS

IR

Vibrations