{[(9Ar)-2-Amino-4-Oxo-6,7-Di(Sulfanyl-Kappas)-9A,10-Dihydro-4H-Pyrano[3,2-G]Pteridin-8-Yl]Methyl Dihydrogenato(2-) Phosphate}(Hydroxy)Oxomolybdate(1-)

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Formula C10H8MoN5O8PS2
IUPAC Name {[(9ar)-2-amino-4-oxo-6,7-di(sulfanyl-kappas)-9a,10-dihydro-4h-pyrano[3,2-g]pteridin-8-yl]methyl dihydrogenato(2-) phosphate}(hydroxy)oxomolybdate(1-)
Molecular Mass 517.263 g·mol−1
Heat of Formation -685.1 ± 16.7 kJ·mol−1
Dipole Moment 16.79 ± 1.08 D
Volume 382.72 Å 3
Surface Area 317.82 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -0.50 ± eV
Point Group Symmetry C1
InChIKey LHAIYTXZRHTNKS-UHFFFAOYSA-K
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