(2S,4R,5As,9Cs)-5A-Hydroxy-2-Methyl-4-(4-Oxo-3(4H)-Quinazolinyl)-4,5,5A,9C-Tetrahydro-3H-2A,9B-Diazacyclopenta[Jk]Fluorene-1,3(2H)-Dione

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Formula C22H18N4O4+
IUPAC Name (2s,4r,5as,9cs)-5a-hydroxy-2-methyl-4-(4-oxo-3(4h)-quinazolinyl)-4,5,5a,9c-tetrahydro-3h-2a,9b-diazacyclopenta[jk]fluorene-1,3(2h)-dione
Molecular Mass 402.403 g·mol−1
Heat of Formation -343.7 ± 16.7 kJ·mol−1
Dipole Moment 3.68 ± 1.08 D
Volume 438.61 Å 3
Surface Area 366.71 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -0.75 ± eV
Point Group Symmetry C1
InChIKey GEURDGODABUDHB-TYTLQBBQSA-N
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