5,5-Diphenyl-2,4,6(1H,3H,5H)-Pyrimidinetrione

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Properties Simple | Detailed

Formula C16H12N2O3
IUPAC Name 5,5-diphenylhexahydropyrimidine-2,4,6-trione
Molecular Mass 280.278 g·mol−1
Heat of Formation -294.9 ± 16.7 kJ·mol−1
Dipole Moment 1.83 ± 1.08 D
Volume 315.22 Å 3
Surface Area 273.94 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5,5-diphenyl-
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5,5-diphenyl- (9ci)
  • 5,5-di(phenyl)-1,3-diazinane-2,4,6-trione
  • 5,5-di(phenyl)barbituric acid
  • 5,5-di(phenyl)hexahydropyrimidine-2,4,6-trione
  • 5,5-diphenylbarbituric acid
  • barbituric acid, 5,5-diphenyl-
  • cbdive_011414
  • oprea1_285542
InChIKey IKVPZYAOGOJTLK-UHFFFAOYSA-N
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