1-[3-Azido-5-O-(1-Borylene-1,3,5,5-Tetrahydroxy-3,5-Dioxido-1Lambda~5~,3Lambda~5~,5Lambda~5~-Triphosphoxan-1-Yl)-2,3-Dideoxypentofuranosyl]-5-Methyl-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C10H19BN5O12P3
IUPAC Name [[(2s,3s,5r)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-boranylidene-hydroxy-λ5-phosphanyl] phosphono hydrogen phosphate
Molecular Mass 505.016 g·mol−1
Heat of Formation -2676.6 ± 16.7 kJ·mol−1
Dipole Moment 3.88 ± 1.08 D
Volume 479.85 Å 3
Surface Area 377.08 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy -1.85 ± eV
Point Group Symmetry C1
InChIKey YRFDNFJEDDBNDW-NYNRLPRQSA-N
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Elements C B H O N P