1-[(1R,2S)-2-Cyclohexylcyclopropyl]-6-Fluoro-4-Oxo-7-Piperazin-1-Yl-5,8-Dihydro-2H-Quinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C23H37FN3O3+ |
IUPAC Name | 1-[(1r,2s)-2-cyclohexylcyclopropyl]-6-fluoro-4-oxo-7-piperazin-1-yl-5,8-dihydro-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid |
Molecular Mass | 422.557 g·mol−1 |
Heat of Formation | -291.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.31 ± 1.08 D |
Volume | 470.57 Å 3 |
Surface Area | 403.35 Å 2 |
HOMO Energy | -8.83 ± 0.55 eV |
LUMO Energy | 2.13 ± eV |
Point Group Symmetry | C1 |
InChIKey | SAKVUSLCDKAMDJ-QDPKESIRSA-O |
QR Code | Generate QR Code |
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Elements | H C N O F |