Geometry & MOs

Info

ID:	296159
PubChem CID:	117558474
Reduced:	ON3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	257.03559
ΔH_f, kcal/mol:	36.44
Dipole, Da:	5.15
IP(EA), eV:	-8.88(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chlorophenyl)-4-cyanopyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1NC(=O)C2=NC=CC(=C2)C#N

DOS

IR

Vibrations