Formula |
C8H13N5O12P3 |
IUPAC Name |
2-(4-azido-5-hydroxy-2-nitro-anilino)ethyl-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphinic acid |
Molecular Mass |
464.136 g·mol−1 |
Heat of Formation |
-2367.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.53 ± 1.08 D |
Volume |
427.8 Å 3 |
Surface Area |
360.49 Å 2 |
HOMO Energy |
-9.30 ± 0.55 eV |
LUMO Energy |
-1.54 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-((4-azido-2-nitrophenyl)amino)ethyl triphosphate
- 2-[(4-azido-5-hydroxy-2-nitrophenyl)amino]ethyl-(hydroxy-phosphonooxyphosphoryl)oxyphosphinic acid
- triphosphoric acid, p-(2-((4-azido-2-nitrophenyl)amino)ethyl) ester
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CAS Number(s) |
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InChIKey |
CUUGUGJPLATVTD-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
P
C
H
O
N
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