Geometry & MOs

Info

ID:	212301
PubChem CID:	81060074
Reduced:	ClN3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	257.071975
ΔH_f, kcal/mol:	48.6
Dipole, Da:	3.6
IP(EA), eV:	-9.27(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chloroanilino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations