Geometry & MOs

Info

ID:	318027
PubChem CID:	126648424
Reduced:	N2O2H12C17 (1)
Stoich.:	A2B2C12D17 (1)
Weight, g/mol:	401.175084
ΔH_f, kcal/mol:	-2.54
Dipole, Da:	10.77
IP(EA), eV:	-9.67(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=CC3=C(C=C2)C(=C(C(=O)N3)C#N)O

DOS

IR

Vibrations