1-Cyclopropyl-7-[4-(2,2-Diphosphonoethyl)-1-Piperazinyl]-6-Fluoro-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C19H33FN3O9P2+
IUPAC Name 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)piperazin-1-yl]-6-fluoro-4-oxo-5,8-dihydro-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 528.426 g·mol−1
Heat of Formation -1954.1 ± 16.7 kJ·mol−1
Dipole Moment 8.50 ± 1.08 D
Volume 548.86 Å 3
Surface Area 451.57 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -0.85 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid
  • 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)piperazin-1-yl]-6-fluoro-4-keto-quinoline-3-carboxylic acid
  • 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)piperazin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)piperazin-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid
  • 3-quinolinecarboxylic acid, 1-cyclopropyl-7-[4-(2,2-diphosphonoethyl)-1-piperazinyl]-6-fluoro-1,4-dihydro-4-oxo-
  • ciprofloxin-1,1-bisphosphonate (hydrate)
InChIKey HUOZBLSEUZMUDA-UHFFFAOYSA-N
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