Geometry & MOs

Info

ID:	23729
PubChem CID:	605590
Reduced:	ClN5C9H14 (1)
Stoich.:	AB5C9D14 (1)
Weight, g/mol:	227.093773
ΔH_f, kcal/mol:	23.41
Dipole, Da:	3.62
IP(EA), eV:	-9.22(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC(=NC(=N2)N)CCl

DOS

IR

Vibrations