Geometry & MOs

Info

ID:	272893
PubChem CID:	103764140
Reduced:	BrClO2N3C14H17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	289.086269
ΔH_f, kcal/mol:	-81.91
Dipole, Da:	2.05
IP(EA), eV:	-9.57(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-carbamoyl-3-fluoro-2-methylphenyl)-2-oxo-1H-pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=C(C=C(C=C2)Cl)Br)CNC(=O)N

DOS

IR

Vibrations