Trihydrido{5'-O-[(1R)-1,3,3-Trihydroxy-3-Oxido-3Lambda~5~-Diphosphoxan-1-Yl-Kappap~1~]Thymidine}Boron

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Formula C10H17BN2O10P2
IUPAC Name [[(1z,3r,4e)-2,3-dihydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)penta-1,4-dienoxy]-hydroxy-phosphanyl] dihydrogen phosphate; hydron; λ2-borane
Molecular Mass 401.032 g·mol−1
Heat of Formation -2455.8 ± 16.7 kJ·mol−1
Dipole Moment 8.57 ± 1.08 D
Volume 438.74 Å 3
Surface Area 388.24 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -1.95 ± eV
Point Group Symmetry C1
InChIKey QDZZFSSDQOLCBV-TYNZIUOXSA-N
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