1-Deoxy-1-[(5-Nitroso-2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinyl)Amino]-D-Ribitol

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Properties Simple | Detailed

Formula C9H14N4O7++
IUPAC Name 5-nitroso-6-[[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]amino]pyrimidine-2,4-dione
Molecular Mass 290.230 g·mol−1
Heat of Formation -1043.3 ± 16.7 kJ·mol−1
Dipole Moment 11.66 ± 1.08 D
Volume 304.5 Å 3
Surface Area 286.23 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -1.03 ± eV
Point Group Symmetry C1
Synonyms
  • 5-nitroso-6-[[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]amino]uracil
  • 5-nitroso-6-ribityl-amino-2,4(1h,3h)-pyrimidinedione
  • lmz
InChIKey YMWIHKCBRFEJMH-RPDRRWSUSA-N
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