2-Azabicyclo[16.3.1]Docosa-4,6,10,18,21-Pentaene-3,20,22-Trione, 9,13-Dihydroxy-8,14,19-Trimethoxy-4,10,12,16-Tetramethyl-, 9-Carbamate (8Ci)
Properties
Property | Value |
---|---|
Formula | C29H40N2O9 |
IUPAC Name | [(3r,5s,6r,7s,8z,10s,11s,12z,14e)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate |
Molecular Mass | 560.636 g·mol−1 |
Heat of Formation | -1376.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.69 ± 1.08 D |
Volume | 684.03 Å 3 |
Surface Area | 510.29 Å 2 |
HOMO Energy | -9.35 ± 0.55 eV |
LUMO Energy | -1.43 ± eV |
Point Group Symmetry | C1 |
InChIKey | QTQAWLPCGQOSGP-GKGSOXGJSA-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 |