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

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Formula C15H15N4O5PS
IUPAC Name [4-[[(e)-1,3-benzothiazol-2-ylazo]methyl]-5-hydroxy-6-methyl-3-pyridyl]methyl dihydrogen phosphate
Molecular Mass 394.342 g·mol−1
Heat of Formation -721.7 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 417.25 Å 3
Surface Area 364.57 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy -1.50 ± eV
Point Group Symmetry C1
InChIKey IRSQGYHNYSBCCK-HTXNQAPBSA-N
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