6-Ethyl-3-Methyl-2,9-Dioxo-Thiazolo[5,4-F]Quinoline-3,6-Diium-8-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C14H21N2O4S+ |
IUPAC Name | 6-ethyl-3-methyl-2,9-dioxo-5,7-dihydro-4h-thiazolo[5,4-f]quinoline-3a,4,5,5a,7,8,9a,9b-octaide-8-carboxylic acid |
Molecular Mass | 313.393 g·mol−1 |
Heat of Formation | -520.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.96 ± 1.08 D |
Volume | 324.48 Å 3 |
Surface Area | 290.67 Å 2 |
HOMO Energy | -8.59 ± 0.55 eV |
LUMO Energy | 1.87 ± eV |
Point Group Symmetry | C1 |
InChIKey | PHAHXOVGVDUTMN-UHFFFAOYSA-O |
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Elements | H S C O N |