Geometry & MOs

Info

ID:	203521
PubChem CID:	79840443
Reduced:	ClN3C13H14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	238.123676
ΔH_f, kcal/mol:	39.25
Dipole, Da:	6.45
IP(EA), eV:	-8.64(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(2,4-dimethylcyclohexyl)pyridin-4-amine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCNC2=C(C=NC=C2)Cl)N

DOS

IR

Vibrations