Geometry & MOs

Info

ID:	212276
PubChem CID:	81059975
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	251.142248
ΔH_f, kcal/mol:	18.11
Dipole, Da:	4.89
IP(EA), eV:	-8.84(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,5-dimethylanilino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCN(C1CCCCC1)C2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations