1-(7-Bromo-8-Methyl-2,4-Dioxo-3,4-Dihydrobenzo[G]Pteridin-10(2H)-Yl)-1-Deoxy-5-O-Phosphonopentitol

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Properties Simple | Detailed

Formula C16H10BrN4O9P
IUPAC Name (e)-[7-bromo-8-methylene-1-[2,3,4-trioxo-5-[(3-oxo-1,2,3λ5-dioxaphosphiran-3-yl)oxy]pentyl]-1,4-diazacyclodeca-5,6-dien-9-yn-2-ylidene]-(oxomethyleneammoniocarbonyl)ammonium
Molecular Mass 513.150 g·mol−1
Heat of Formation 646.8 ± 16.7 kJ·mol−1
Dipole Moment 6.69 ± 1.08 D
Volume 461.97 Å 3
Surface Area 404.53 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -2.31 ± eV
Point Group Symmetry C1
InChIKey GLOVWERIXUQLIG-GVXVVHGQSA-N
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Elements P C O Br N