(1S,3S,4R)-1,2-Diacetoxy-5-Cyano-3,7-Dihydroxy-3-Methyl-6,11-Dioxo-2,3,4,5,6,11-Hexahydro-1H-Benzo[B]Carbazol-4-Yl 2-Methylpropanoate

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Formula C26H24N2O10
IUPAC Name [(1s,2r,3s,4r)-1,2-diacetoxy-5-cyano-3,7-dihydroxy-3-methyl-6,11-dioxo-2,4-dihydro-1h-benzo[h]carbazol-5-ium-4a-ylium-4-yl] 2-methylpropanoate
Molecular Mass 524.476 g·mol−1
Heat of Formation -1433.9 ± 16.7 kJ·mol−1
Dipole Moment 6.43 ± 1.08 D
Volume 579.14 Å 3
Surface Area 462.42 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy -1.84 ± eV
Point Group Symmetry C1
InChIKey AXAYEQMDEPTHTO-WSKLTFMVSA-N
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