Geometry & MOs

Info

ID:	16684
PubChem CID:	474726
Reduced:	F2N4O4H22C23 (1)
Stoich.:	A2B4C4D22E23 (1)
Weight, g/mol:	456.160912
ΔH_f, kcal/mol:	-181.45
Dipole, Da:	11.02
IP(EA), eV:	-9.36(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-6-fluoro-7-[4-[2-(4-fluorophenyl)-2-oxoethyl]piperazin-1-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN1C=C(C(=O)C2=CC(=C(N=C21)N3CCN(CC3)CC(=O)C4=CC=C(C=C4)F)F)C(=O)O

DOS

IR

Vibrations