10-(2,6-Dimethylphenyl)-3-Methyl-6,8-Disulfo-Benzo[G]Pteridine-1,5-Diium-9A-Ide-2,4-Dione
Properties
Property | Value |
---|---|
Formula | C19H21N4O8S2++ |
IUPAC Name | 10-(2,6-dimethylphenyl)-3-methyl-6,8-disulfo-benzo[g]pteridine-1,5-diium-9a-ide-2,4-dione |
Molecular Mass | 497.522 g·mol−1 |
Heat of Formation | -1014.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.71 ± 1.08 D |
Volume | 492.96 Å 3 |
Surface Area | 402.68 Å 2 |
HOMO Energy | -9.86 ± 0.55 eV |
LUMO Energy | -3.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | GIRTVOLXMGZHBE-UHFFFAOYSA-P |
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Elements | H S C O N |