Geometry & MOs

Info

ID:	289090
PubChem CID:	104335390
Reduced:	Cl2O2N3C14H15 (1)
Stoich.:	A2B2C3D14E15 (1)
Weight, g/mol:	263.08254
ΔH_f, kcal/mol:	-36.12
Dipole, Da:	1.89
IP(EA), eV:	-8.64(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-(methoxymethyl)-N-(4-methylphenyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)Cl)NC2=CC(=C(C=C2)OC)Cl

DOS

IR

Vibrations