Geometry & MOs

Info

ID:	210131
PubChem CID:	80766849
Reduced:	N4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	240.114174
ΔH_f, kcal/mol:	10.78
Dipole, Da:	3.28
IP(EA), eV:	-8.58(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-4-(3,5-dimethylpiperidin-1-yl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1N2CCCCC2C)NC

DOS

IR

Vibrations