{5-Hydroxy-6-Methyl-4-[(2-{[(2-Nitrobenzoyl)Amino]Acetyl}Hydrazino)Methyl]-3-Pyridinyl}Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C17H20N5O9P
IUPAC Name [5-hydroxy-6-methyl-4-[[2-[2-[(2-nitrobenzoyl)amino]acetyl]hydrazino]methyl]-3-pyridyl]methyl dihydrogen phosphate
Molecular Mass 469.343 g·mol−1
Heat of Formation -1284.6 ± 16.7 kJ·mol−1
Dipole Moment 3.55 ± 1.08 D
Volume 500.88 Å 3
Surface Area 448.86 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -1.85 ± eV
Point Group Symmetry C1
Synonyms
  • [5-hydroxy-6-methyl-4-[[2-[2-[(2-nitrobenzoyl)amino]acetyl]hydrazinyl]methyl]pyridin-3-yl]methyl dihydrogen phosphate
  • [5-hydroxy-6-methyl-4-[[2-[2-[(2-nitrophenyl)carbonylamino]ethanoyl]hydrazinyl]methyl]pyridin-3-yl]methyl dihydrogen phosphate
  • [5-hydroxy-6-methyl-4-[[n'-[2-[(2-nitrobenzoyl)amino]acetyl]hydrazino]methyl]-3-pyridyl]methyl dihydrogen phosphate
  • [5-hydroxy-6-methyl-4-[[n'-[2-[[(2-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]hydrazino]methyl]-3-pyridyl]methyl dihydrogen phosphate
  • blp
InChIKey AJHNLRARXNOGMZ-UHFFFAOYSA-N
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