2-[1-(Benzyloxy)-2-Propanyl]-3-Methyl-6-Oxo-5-(2-Oxopropyl)Tetrahydro-2H-Pyran-4-Yl 3,5-Dinitrobenzoate
Properties
Property | Value |
---|---|
Formula | C26H28N2O10 |
IUPAC Name | cyclohepta-1,3,5-triene; 5-[[(1r,5r)-2,6-dinitro-4-(oxomethylene)-3-bicyclo[3.1.0]hexanylidene]methylene]-6-ethynyl-3-(oxiran-2-ylidenemethylene)tetrahydropyran-2,4-dione; formaldehyde |
Molecular Mass | 528.508 g·mol−1 |
Heat of Formation | 2786.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.61 ± 1.08 D |
Volume | 564.93 Å 3 |
Surface Area | 507.59 Å 2 |
HOMO Energy | -9.70 ± 0.55 eV |
LUMO Energy | -2.58 ± eV |
Point Group Symmetry | C1 |
InChIKey | QFCHHSMYAFEZCK-JZXQQEJRSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O N |