Geometry & MOs

Info

ID:	17213
PubChem CID:	488656
Reduced:	FO3N4C18H23 (1)
Stoich.:	AB3C4D18E23 (1)
Weight, g/mol:	362.175419
ΔH_f, kcal/mol:	-148.97
Dipole, Da:	13.65
IP(EA), eV:	-9.14(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[3-(aminomethyl)pyrrolidin-1-yl]-1-tert-butyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCC(C3)CN)F)C(=O)O

DOS

IR

Vibrations