(1S,5R,6S,7S,9R,11R,13R)-7-Fluoro-6-(4-Methylpiperazin-1-Yl)-10-Oxo-Spiro[4-Oxa-1-Azoniatricyclo[7.3.1.05,13]Tridecane-2,1'-Cyclopropane]-11-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C19H29FN3O4+ |
| IUPAC Name | (1s,5r,6s,7s,9r,11r,13r)-7-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-spiro[4-oxa-1-azoniatricyclo[7.3.1.05,13]tridecane-2,1'-cyclopropane]-11-carboxylic acid |
| Molecular Mass | 382.450 g·mol−1 |
| Heat of Formation | -516.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.76 ± 1.08 D |
| Volume | 416.76 Å 3 |
| Surface Area | 356.5 Å 2 |
| HOMO Energy | -8.62 ± 0.55 eV |
| LUMO Energy | 2.10 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AHJYOTQEKNLACP-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |