Geometry & MOs

Info

ID:	1992
PubChem CID:	5517
Reduced:	F3O3N4H15C19 (1)
Stoich.:	A3B3C4D15E19 (1)
Weight, g/mol:	404.109625
ΔH_f, kcal/mol:	-187.38
Dipole, Da:	13.25
IP(EA), eV:	-9.26(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-aminopyrrolidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CN(CC1N)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=C(C=C(C=C4)F)F)C(=O)O)F

DOS

IR

Vibrations