Geometry & MOs

Info

ID:	212360
PubChem CID:	81060267
Reduced:	ON4C13H18 (1)
Stoich.:	AB4C13D18 (1)
Weight, g/mol:	329.05276
ΔH_f, kcal/mol:	-18.27
Dipole, Da:	3.4
IP(EA), eV:	-9.52(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(4-bromophenyl)ethylamino]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCNC(=O)C(C)NC1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations