(1R,2S,3S,7S,9R,11S,15S,16S)-16-Methoxy-2-Methyl-4,12,14-Trioxa-2-Azoniatetracyclo[7.7.0.03,7.011,15]Hexadecan-8-One
Properties
| Property | Value |
|---|---|
| Formula | C14H22NO5+ |
| IUPAC Name | (1r,2s,3s,7s,9r,11s,15s,16s)-16-methoxy-2-methyl-4,12,14-trioxa-2-azoniatetracyclo[7.7.0.03,7.011,15]hexadecan-8-one |
| Molecular Mass | 284.328 g·mol−1 |
| Heat of Formation | -436.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.95 ± 1.08 D |
| Volume | 286.37 Å 3 |
| Surface Area | 261.12 Å 2 |
| HOMO Energy | -8.17 ± 0.55 eV |
| LUMO Energy | -0.91 ± eV |
| Point Group Symmetry | Cs |
| InChIKey | MRKXMWPTLUPWGU-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |