3-[(1E,7E)-8-(2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinyl)-3,6-Dioxa-2,7-Diazaocta-1,7-Dien-1-Yl]Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C15H14N4O6 |
IUPAC Name | 3-[(e)-2-[(e)-(2,6-dioxo-5h-pyrimidin-3-ium-5-id-4-yl)methyleneamino]oxyethoxyiminomethyl]benzoic acid |
Molecular Mass | 346.295 g·mol−1 |
Heat of Formation | -534.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.63 ± 1.08 D |
Volume | 379.6 Å 3 |
Surface Area | 370.49 Å 2 |
HOMO Energy | -9.78 ± 0.55 eV |
LUMO Energy | 1.63 ± eV |
Point Group Symmetry | C1 |
InChIKey | TUYDQQMKXSQIQG-GONBZBRSSA-P |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |