Geometry & MOs

Info

ID:	289137
PubChem CID:	104337383
Reduced:	ClN2O2C16H19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	282.032668
ΔH_f, kcal/mol:	-43.54
Dipole, Da:	3.82
IP(EA), eV:	-9.04(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-(3-chloro-4-methylphenyl)-2-(methoxymethyl)pyrimidine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)Cl)C2=CC=CC=C2OC(C)C

DOS

IR

Vibrations