[3-[(4-Azido-2-Nitro-Phenyl)Amino]-2-Hydroxy-Propyl]-(Hydroxy-Phosphonooxy-Phosphoryl)Oxy-Phosphinic Acid

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Properties Simple | Detailed

Formula C9H14N5O12P3
IUPAC Name [(2s)-3-(4-azido-2-nitro-anilino)-2-hydroxy-propyl]-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphinic acid
Molecular Mass 477.155 g·mol−1
Heat of Formation -606.5 ± 16.7 kJ·mol−1
Dipole Moment 4.84 ± 1.08 D
Volume 416.94 Å 3
Surface Area 382.71 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -2.93 ± eV
Point Group Symmetry C1
InChIKey ULCKHOPLHMISFV-SSDOTTSWSA-N
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