Geometry & MOs

Info

ID:	289135
PubChem CID:	104337335
Reduced:	ClON3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	249.06689
ΔH_f, kcal/mol:	16.83
Dipole, Da:	2.59
IP(EA), eV:	-9.97(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(methoxymethyl)-6-(3-methylpyridin-4-yl)pyrimidine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)Cl)CC2=CC=CC=N2

DOS

IR

Vibrations