Geometry & MOs

Info

ID:	275752
PubChem CID:	103817416
Reduced:	ClON4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	222.148061
ΔH_f, kcal/mol:	-0.49
Dipole, Da:	1.7
IP(EA), eV:	-9.02(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-6-(4-methylpiperidin-1-yl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

COC1=NC(=NC(=C1)NCCC2=CC=C(C=C2)Cl)N

DOS

IR

Vibrations