5-[2-(3-Carboxyphenyl)Ethyl]-2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinecarboxylic Acid

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Formula C14H12N2O6++
IUPAC Name 5-[2-(3-carboxyphenyl)ethyl]-2,6-dioxo-pyrimidin-3-ium-5-ide-4-carboxylic acid
Molecular Mass 304.255 g·mol−1
Heat of Formation -976.2 ± 16.7 kJ·mol−1
Dipole Moment 1.23 ± 1.08 D
Volume 330.27 Å 3
Surface Area 298.1 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 1.38 ± eV
Point Group Symmetry C1
InChIKey NEPNOJKMVGCINS-UHFFFAOYSA-N
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