(4S,4As,6S,8As)-6-[(1S)-7-Chloro-4-Hydroxy-1-Methyl-3-Oxo-1,3-Dihydro-2-Benzofuran-1-Yl]-4-(Dimethylamino)-3,8A-Dihydroxy-1,8-Dioxo-1,4,4A,5,6,7,8,8A-Octahydro-2-Naphthalenecarboxamide

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Formula C22H23ClN2O8
IUPAC Name (4s,4as,6s,8as)-6-[(1s)-7-chloro-4-hydroxy-1-methyl-3-oxo-isobenzofuran-1-yl]-4-(dimethylamino)-3,8a-dihydroxy-1,8-dioxo-4a,5,6,7-tetrahydro-4h-naphthalene-2-carboxamide
Molecular Mass 478.880 g·mol−1
Heat of Formation -1277.2 ± 16.7 kJ·mol−1
Dipole Moment 8.88 ± 1.08 D
Volume 517.78 Å 3
Surface Area 403.46 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -1.46 ± eV
Point Group Symmetry C1
InChIKey GFSLIMZISCAANG-AXVXPIMKSA-N
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