Geometry & MOs

Info

ID:	318061
PubChem CID:	126648785
Reduced:	ClN3O3C18H18 (1)
Stoich.:	AB3C3D18E18 (1)
Weight, g/mol:	357.14887
ΔH_f, kcal/mol:	-78.33
Dipole, Da:	2.14
IP(EA), eV:	-9.64(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-cyclopropyl-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=CC(=CC=C2)Cl)C(=O)NC3CC3

DOS

IR

Vibrations