5,6-Trimethyleneuracil

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Properties Simple | Detailed

Formula C7H8N2O2++
IUPAC Name 6,7-dihydro-5h-cyclopenta[d]pyrimidine-2,4-dione
Molecular Mass 152.151 g·mol−1
Heat of Formation -340.4 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 171.44 Å 3
Surface Area 172.64 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
Synonyms
  • 1,5,6,7-tetrahydrocyclopenta[e]pyrimidine-2,4-dione
  • 1,5,6,7-tetrahydrocyclopenta[e]pyrimidine-2,4-quinone
  • 2,3,5,7-tetrahydro-5,7-diazaindene-4,6-dione
CAS Number(s)
  • 5466-00-2
InChIKey UPLURGSDLNKCSU-UHFFFAOYSA-N
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