4-Amino-1-[(1S,4S,5R)-4,5-Dihydroxy-3-(Hydroxymethyl)-2-Cyclopenten-1-Yl]-2(1H)-Pyrimidinone

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Properties Simple | Detailed

Formula C10H13N3O4
IUPAC Name 4-amino-1-[(1s,4s,5r)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyrimidin-2-one
Molecular Mass 239.228 g·mol−1
Heat of Formation -564.6 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 263.67 Å 3
Surface Area 244.26 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • 2(1h)-pyrimidinone, 4-amino-1-[4,5-dihydroxy-3-(hydroxymethyl)-2-cyclopenten-1-yl]-
  • 4-amino-1-[(1s,4s,5r)-4,5-dihydroxy-3-(hydroxymethyl)-1-cyclopent-2-enyl]-2-pyrimidinone
  • 4-amino-1-[(1s,4s,5r)-4,5-dihydroxy-3-methylol-1-cyclopent-2-enyl]pyrimidin-2-one
InChIKey DUJGMZAICVPCBJ-CNUIFLNQSA-N
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