Geometry & MOs

Info

ID:

231924

PubChem CID:

87574917

Reduced:

NCl2O3C19H21 (1)

Stoich.:

AB2C3D19E21 (1)

Weight, g/mol:

584.206461

ΔHf, kcal/mol:

-109.07

Dipole, Da:

4.96

IP(EA), eV:

 -9.02(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[(4Z)-3-(aminomethyl)-4-methoxyiminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;methanesulfonic acid;1-methylpyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC(COC1)OC2=CC=C(C=C2)C(C=O)(C3=CC=C(C=C3)Cl)N.Cl

DOS

IR

Vibrations