Geometry & MOs

Info

ID:	212303
PubChem CID:	81060080
Reduced:	FN3C16H16 (1)
Stoich.:	AB3C16D16 (1)
Weight, g/mol:	243.173548
ΔH_f, kcal/mol:	18.68
Dipole, Da:	5.35
IP(EA), eV:	-9.02(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(3-methylcyclohexyl)amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)N(C)CC2=CC(=CC=C2)F

DOS

IR

Vibrations