(4Ar,7As,7Bs,8R,9R)-9A-Acetoxy-4A,7B-Dihydroxy-3-(Hydroxymethyl)-1,1,6,8-Tetramethyl-5-Oxo-1A,1B,4,4A,5,7A,7B,8,9,9A-Decahydro-1H-Cyclopropa[3,4]Benzo[1,2-E]Azulen-9-Yl 5-Azido-2-Nitrobenzoate
Properties
Property | Value |
---|---|
Formula | C29H32N4O10 |
IUPAC Name | (4ar,7as,7bs,8r,9r)-9a-acetoxy-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1h-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl 5-azido-2-nitrobenzoate |
Molecular Mass | 596.585 g·mol−1 |
Heat of Formation | -936.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.86 ± 1.08 D |
Volume | 670.12 Å 3 |
Surface Area | 505.56 Å 2 |
HOMO Energy | -9.46 ± 0.55 eV |
LUMO Energy | 1.11 ± eV |
Point Group Symmetry | C1 |
InChIKey | IYQBSVIEHHARLS-OKGPVVPNSA-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 |