Geometry & MOs

Info

ID:	272017
PubChem CID:	103717278
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	280.041483
ΔH_f, kcal/mol:	-21.8
Dipole, Da:	2.53
IP(EA), eV:	-7.62(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-4-fluorophenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)CNC2=CC(=C(C=C2)OCC)OC

DOS

IR

Vibrations