Geometry & MOs

Info

ID:	210555
PubChem CID:	80822648
Reduced:	ClN4C11H19 (1)
Stoich.:	AB4C11D19 (1)
Weight, g/mol:	263.210996
ΔH_f, kcal/mol:	-1.2
Dipole, Da:	3.79
IP(EA), eV:	-8.61(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dimethylpiperidin-1-yl)-4-N-propylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCCCC(C)NC1=NC(=NC=C1Cl)NC

DOS

IR

Vibrations