(4-{[(E)-(1,3-Benzothiazol-2-Ylcarbonyl)Diazenyl]Methyl}-5-Hydroxy-6-Methyl-3-Pyridinyl)Methyl Dihydrogen Phosphate

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Formula C16H15N4O6PS
IUPAC Name [4-[[(e)-1,3-benzothiazole-2-carbonylazo]methyl]-5-hydroxy-6-methyl-3-pyridyl]methyl dihydrogen phosphate
Molecular Mass 422.352 g·mol−1
Heat of Formation -853.4 ± 16.7 kJ·mol−1
Dipole Moment 5.73 ± 1.08 D
Volume 451.53 Å 3
Surface Area 382.15 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -1.56 ± eV
Point Group Symmetry C1
InChIKey GUGJKPFDBSWCQD-CZIZESTLSA-N
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