[3-({3-[2,4-Bis(2-Oxiranylmethyl)-3,5-Dioxo-1,2,4-Triazolidin-1-Yl]-2-Hydroxypropyl}Amino)-1-Hydroxy-1,1-Propanediyl]Bis(Phosphonic Acid)

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Formula C14H26N4O12P2
IUPAC Name [3-[[(2s)-3-[2,4-bis[[(2s)-oxiran-2-yl]methyl]-3,5-dioxo-1,2,4-triazolidin-1-yl]-2-hydroxy-propyl]amino]-1-hydroxy-1-phosphono-propyl]phosphonic acid
Molecular Mass 504.323 g·mol−1
Heat of Formation -2252.1 ± 16.7 kJ·mol−1
Dipole Moment 2.80 ± 1.08 D
Volume 550.14 Å 3
Surface Area 442.34 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
InChIKey KBWAPSNLDJIIQL-DCAQKATOSA-N
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