6-(5-O-Phosphono-β-D-Ribofuranosyl)Imidazo[1,2-C]Pyrimidin-5(6H)-One

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Properties Simple | Detailed

Formula C11H17N3O8P
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-(5-oxo-7,8-dihydro-3h-imidazo[1,2-c]pyrimidin-1-ium-3,7,8-triid-6-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 350.242 g·mol−1
Heat of Formation -1526.9 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 350.53 Å 3
Surface Area 302.65 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(5-ketoimidazo[1,2-c]pyrimidin-6-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(5-oxo-6-imidazo[1,2-c]pyrimidinyl)-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-3,4-dihydroxy-5-(5-oxoimidazo[1,2-c]pyrimidin-6-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • imidazo(1,2-c)pyrimidin-5(6h)-one, 6-(5-o-phosphono-beta-d-ribofuranosyl)-, homopolymer
  • poly(3,n(4)-ethenocytidylic acid)
CAS Number(s)
  • 42476-11-9
InChIKey VTLRYBAWSBITPD-PEBGCTIMSA-N
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