Geometry & MOs

Info

ID:

222950

PubChem CID:

85333454

Reduced:

Cl2O4N6C37H44 (1)

Stoich.:

A2B4C6D37E44 (1)

Weight, g/mol:

707.287903

ΔHf, kcal/mol:

-125.27

Dipole, Da:

14.19

IP(EA), eV:

 -8.74(-1.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[4-[2-[4-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]piperazin-1-yl]-2-oxoethyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)CNC(=O)C2=CC=CC=C2N(CC3CCCCC3)C(=NC(CC4=CC=C(C=C4)NC(=O)C5=C(C=NC=C5Cl)Cl)C(=O)O)N

DOS

IR

Vibrations