Geometry & MOs

Info

ID:	212552
PubChem CID:	81060939
Reduced:	FN3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	23.08
Dipole, Da:	3.42
IP(EA), eV:	-9.09(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)N(C)C2=CC=C(C=C2)F

DOS

IR

Vibrations