Geometry & MOs

Info

ID:	318048
PubChem CID:	126648665
Reduced:	FO3N4C21H21 (1)
Stoich.:	AB3C4D21E21 (1)
Weight, g/mol:	401.175084
ΔH_f, kcal/mol:	-117.78
Dipole, Da:	4.54
IP(EA), eV:	-8.92(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-(2-ethoxycyclopropyl)-3-N-[(4-fluoro-3-methylphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC(=CN(C1=O)CC2=C3C=CNC3=CC=C2)C(=O)NC4CC(C4)F

DOS

IR

Vibrations