[(1R,2S,10R,12R,13S)-12-Cyano-7,18-Dimethoxy-6,17,21-Trimethyl-5,8,16,19-Tetraoxo-11,21-Diazapentacyclo[11.7.1.0~2,11~.0~4,9~.0~15,20~]Henicosa-4(9),6,15(20),17-Tetraen-10-Yl]Methyl (2Z)-2-Methyl-2-Butenoate
Properties
| Property | Value |
|---|---|
| Formula | C31H33N3O8 |
| IUPAC Name | [(1r,2s,10r,12r,13s)-12-cyano-7,18-dimethoxy-6,17,21-trimethyl-5,8,16,19-tetraoxo-11,21-diazapentacyclo[11.7.1.0 2,11 .0 4,9 .0 15,20 ]henicosa-4(9),6,15(20),17-tetraen-10-yl]methyl (2z)-2-methyl-2-butenoate |
| Molecular Mass | 575.609 g·mol−1 |
| Heat of Formation | -854.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.84 ± 1.08 D |
| Volume | 658.76 Å 3 |
| Surface Area | 454.57 Å 2 |
| HOMO Energy | -9.20 ± 0.55 eV |
| LUMO Energy | 1.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QOGBZZDZYZICFV-NZDGDHNMSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |