2'-Deoxy-5'-O-{[2-(7,8-Dimethyl-2,4-Dioxo-3,4-Dihydrobenzo[G]Pteridin-10(2H)-Yl)Ethyl]Carbamoyl}Guanosine

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Properties Simple | Detailed

Formula C25H27N10O7++
IUPAC Name (e)-[(5s)-5-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)-5-hydroxy-pent-2-ynoxy]carbonyl-ethylidene-ammonium; 7,8-dimethylbenzo[g]pteridine-5,10-diium-2,4-dione; hydron; hydrate
Molecular Mass 581.561 g·mol−1
Heat of Formation -498.0 ± 16.7 kJ·mol−1
Dipole Moment 9.45 ± 1.08 D
Volume 677.81 Å 3
Surface Area 590.2 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -1.73 ± eV
Point Group Symmetry C1
InChIKey JIELMHTXDVQHJI-ARFHVFGLSA-N
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