Geometry & MOs

Info

ID:	77745
PubChem CID:	49658811
Reduced:	ClFO2N3H15C20 (1)
Stoich.:	ABC2D3E15F20 (1)
Weight, g/mol:	426.169191
ΔH_f, kcal/mol:	-7.8
Dipole, Da:	9.01
IP(EA), eV:	-9.09(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(benzylamino)-2-oxoethyl]-7-methyl-4-oxo-N-phenyl-1,8-naphthyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCN1C=C(C(=O)C2=C1C=CC(=C2)F)C3=NC(=NO3)C4=CC=CC=C4Cl

DOS

IR

Vibrations