5,6-Dihydroxy-2-[(2-Phenyl-1H-Indol-3-Yl)Methyl]Pyrimidine-4-Carboxylic Acid

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Formula C20H15N3O4
IUPAC Name 5,6-dihydroxy-2-[(2-phenylindol-1-ium-3a-id-3-yl)methyl]pyrimidine-4-carboxylic acid
Molecular Mass 361.351 g·mol−1
Heat of Formation -296.9 ± 16.7 kJ·mol−1
Dipole Moment 2.59 ± 1.08 D
Volume 410.52 Å 3
Surface Area 343.55 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry C1
InChIKey JONQCFJPPWOWOJ-UHFFFAOYSA-N
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