(1R,2S,5S,8S,9S,14R,15R,17R,18R,21R,24R,26S,27S)-14-Chloro-5,15-Dihydroxy-2,9,26-Trimethyl-3,19,23,28-Tetraoxaoctacyclo[16.9.1.1~18,27~.0~1,5~.0~2,24~.0~8,17~.0~9,14~.0~21,26~]Nonacos-11-Ene-4,10,22,29-Tetrone
Properties
Property | Value |
---|---|
Formula | C28H31ClO10 |
IUPAC Name | 14-chloro-5,15-dihydroxy-2,9,26-trimethyl-3,19,23,28-tetraoxaoctacyclo[16.9.1.1 18,27 .0 1,5 .0 2,24 .0 8,17 .0 9,14 .0 21,26 ]nonacos-11-ene-4,10,22,29-tetrone |
Molecular Mass | 562.993 g·mol−1 |
Heat of Formation | -1665.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.56 ± 1.08 D |
Volume | 573.1 Å 3 |
Surface Area | 399.86 Å 2 |
HOMO Energy | -10.15 ± 0.55 eV |
LUMO Energy | 2.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | YNEPXUIPALKHAU-AMDDVFCUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Cl |