Geometry & MOs

Info

ID:	347734
PubChem CID:	127272796
Reduced:	ClON3C11H16 (1)
Stoich.:	ABC3D11E16 (1)
Weight, g/mol:	191.142248
ΔH_f, kcal/mol:	-31.32
Dipole, Da:	6.38
IP(EA), eV:	-8.88(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,4-dimethylpiperidin-1-yl)pyrimidine

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C2=C(C(=O)NN=C2)Cl)C

DOS

IR

Vibrations