Geometry & MOs

Info

ID:	259816
PubChem CID:	103175345
Reduced:	NO2C12H19 (1)
Stoich.:	AB2C12D19 (1)
Weight, g/mol:	304.134241
ΔH_f, kcal/mol:	-90.51
Dipole, Da:	2.74
IP(EA), eV:	-8.79(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(chloromethyl)-6-propylpyridin-2-yl]oxy-2-ethyl-6-methylpyridine

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)OCC(C)(C)O

DOS

IR

Vibrations