[(2R,3S,5R)-5-[[2-Amino-5-[Formyl-(Hydroxy-Methoxy-Dioxo-Blah,Blah-Dioxa-Blah-Oxoniapentacyclo[Blah]Nonadeca-Blah,Blah,Blah,Blah-Tetraenyl)Amino]-6-Oxo-1H-Pyrimidin-1-Ium-4-Yl]Amino]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C27H30N5O15P++
IUPAC Name [(2r,3s,5r)-5-[[2-amino-5-[formyl-(hydroxy-methoxy-dioxo-blah,blah-dioxa-blah-oxoniapentacyclo[blah]nonadeca-blah,blah,blah,blah-tetraenyl)amino]-6-oxo-1h-pyrimidin-1-ium-4-yl]amino]-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 695.525 g·mol−1
Heat of Formation -2676.2 ± 16.7 kJ·mol−1
Dipole Moment 15.78 ± 1.08 D
Volume 703.79 Å 3
Surface Area 487.36 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
InChIKey ATYDIVLPRYGUHN-MHRKVAGWSA-N
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