Geometry & MOs

Info

ID:	212489
PubChem CID:	81060706
Reduced:	N3C17H17 (1)
Stoich.:	A3B17C17 (1)
Weight, g/mol:	283.148476
ΔH_f, kcal/mol:	64.27
Dipole, Da:	4.83
IP(EA), eV:	-8.46(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(4-fluorophenyl)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2N1C3=C(C(=NC(=C3)C)C)C#N

DOS

IR

Vibrations