(4-{[(5-Aminopentyl)Imino]Methyl}-5-Hydroxy-6-Methyl-3-Pyridinyl)Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C13H22N3O5P
IUPAC Name [4-[(e)-5-aminopentyliminomethyl]-5-hydroxy-6-methyl-3-pyridyl]methyl dihydrogen phosphate
Molecular Mass 331.305 g·mol−1
Heat of Formation -1112.3 ± 16.7 kJ·mol−1
Dipole Moment 4.55 ± 1.08 D
Volume 384.55 Å 3
Surface Area 364.48 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.22 ± eV
Point Group Symmetry C1
InChIKey NPYALNYUWCUSTP-OVCLIPMQSA-N
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