(5-Hydroxy-4-{[(1-Hydroxy-2-Oxo-6-Phenoxy-1,2-Dihydro-3-Quinolinyl)Amino]Methyl}-6-Methyl-3-Pyridinyl)Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C23H22N3O8P+
IUPAC Name [5-hydroxy-4-[[(1-hydroxy-2-oxo-6-phenoxy-3-quinolyl)amino]methyl]-6-methyl-3-pyridyl]methyl dihydrogen phosphate
Molecular Mass 499.410 g·mol−1
Heat of Formation -1189.2 ± 16.7 kJ·mol−1
Dipole Moment 5.24 ± 1.08 D
Volume 540.74 Å 3
Surface Area 477.05 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy 2.00 ± eV
Point Group Symmetry C1
InChIKey BVDVCYBTLXSYJB-UHFFFAOYSA-N
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