Geometry & MOs

Info

ID:	262451
PubChem CID:	103293612
Reduced:	ClON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	278.093439
ΔH_f, kcal/mol:	2.29
Dipole, Da:	5.83
IP(EA), eV:	-8.52(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(2-chloro-6-methoxyphenyl)methyl]-2-methylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=NC=CC(=N1)NCC2=C(C=CC=C2Cl)OC

DOS

IR

Vibrations