Geometry & MOs

Info

ID:

17211

PubChem CID:

488371

Reduced:

FO3N4C20H25 (1)

Stoich.:

AB3C4D20E25 (1)

Weight, g/mol:

388.191069

ΔHf, kcal/mol:

-145.58

Dipole, Da:

12.85

IP(EA), eV:

 -9.14(-0.92)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-tert-butyl-6-fluoro-5-methyl-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)C)F

DOS

IR

Vibrations