Geometry & MOs

Info

ID:	209349
PubChem CID:	80657119
Reduced:	ClN4C12H19 (1)
Stoich.:	AB4C12D19 (1)
Weight, g/mol:	254.129824
ΔH_f, kcal/mol:	12.34
Dipole, Da:	4.06
IP(EA), eV:	-8.87(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chloro-6-methylpyrimidin-2-yl)methyl]-5-methylpiperidin-3-amine

Drug info:

PubChemData

Smile

CC1CN(CCC1N)CC2=NC(=CC(=N2)Cl)C

DOS

IR

Vibrations