Geometry & MOs

Info

ID:	212275
PubChem CID:	81059974
Reduced:	Cl2N3H11C14 (1)
Stoich.:	A2B3C11D14 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	51.02
Dipole, Da:	2.25
IP(EA), eV:	-9.19(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[cyclohexyl(ethyl)amino]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)NC2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations