(2S)-2-{1-[(Dimethylamino)Methyl]-2-Hydroxy-8-(Hydroxymethyl)-9-Oxo-9,11-Dihydroindolizino[1,2-B]Quinolin-7-Yl}-2-Hydroxybutanoic Acid

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Properties Simple | Detailed

Formula C23H26N3O6+
IUPAC Name (2s)-2-[1-[(dimethylamino)methyl]-2-hydroxy-8-(hydroxymethyl)-9-oxo-11h-indolizino[1,2-b]quinoline-5,10-diium-8,12a-diid-7-yl]-2-hydroxy-butanoic acid
Molecular Mass 440.469 g·mol−1
Heat of Formation -839.2 ± 16.7 kJ·mol−1
Dipole Moment 8.46 ± 1.08 D
Volume 496.1 Å 3
Surface Area 413.43 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 1.58 ± eV
Point Group Symmetry C1
InChIKey DPQJTQJZJNYUEC-QHCPKHFHSA-O
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