1-(2-Deoxy-5-O-Phosphonopentofuranosyl)-5-Nitrodihydro-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C9H14N3O10P
IUPAC Name [(2z)-2-hydroxyimino-3-[(z)-[2-[(3-oxo-1,2,3λ5-dioxaphosphiran-3-yl)oxycarbonyl]-3,6-dioxabicyclo[3.1.0]hexan-4-ylidene]amino]propanoyl]-(oxomethylene)ammonium
Molecular Mass 355.195 g·mol−1
Heat of Formation 3114.6 ± 16.7 kJ·mol−1
Dipole Moment 5.90 ± 1.08 D
Volume 463.74 Å 3
Surface Area 511.83 Å 2
HOMO Energy -6.60 ± 0.55 eV
LUMO Energy -3.80 ± eV
Point Group Symmetry C1
InChIKey ZYBJIJYGXJSDTC-UHFFFAOYSA-N
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