Geometry & MOs

Info

ID:	17210
PubChem CID:	488368
Reduced:	FO3N4C19H23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	374.175419
ΔH_f, kcal/mol:	-135.84
Dipole, Da:	13.81
IP(EA), eV:	-9.2(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-6-fluoro-7-[(1R,4R,6S)-6-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C[C@H]1[C@H]2C[C@@H](N1)CN2C3=C(C=C4C(=O)C(=CN(C4=N3)C(C)(C)C)C(=O)O)F

DOS

IR

Vibrations