Geometry & MOs

Info

ID:	212413
PubChem CID:	81060469
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	50.89
Dipole, Da:	5.26
IP(EA), eV:	-8.8(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC1CC1)C2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations