(2R,5S,11S,14S,17S,20S)-2-Benzyl-11-(Hydroxymethyl)-14-Isobutyl-17-{(1R)-1-[(2-Methyl-3-Buten-2-Yl)Oxy]Ethyl}-22-Thia-3,9,12,15,18,23-Hexaazatricyclo[18.2.1.0~5,9~]Tricos-1(23)-Ene-4,10,13,16,19-Pentone
Properties
| Property | Value |
|---|---|
| Formula | C35H50N6O7S |
| IUPAC Name | (2r,5s,11s,14s,17s,20s)-2-benzyl-11-(hydroxymethyl)-14-isobutyl-17-{(1r)-1-[(2-methyl-3-buten-2-yl)oxy]ethyl}-22-thia-3,9,12,15,18,23-hexaazatricyclo[18.2.1.0 5,9 ]tricos-1(23)-ene-4,10,13,16,19-pentone |
| Molecular Mass | 698.872 g·mol−1 |
| Heat of Formation | -1240.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.17 ± 1.08 D |
| Volume | 851.04 Å 3 |
| Surface Area | 617.61 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -0.51 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OOYFLPWTUQXPSY-FVULWXNXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |