N-(2-Methyl-4,5-Dihydrothiazolo[4,5-H]Quinazoline-3,7,9-Triium-5A,9B-Diid-8-Yl)-3-Nitro-Cyclohexa-2,4-Dien-1-Imine
Properties
| Property | Value |
|---|---|
| Formula | C16H14N5O2S |
| IUPAC Name | n-(2-methyl-4,5-dihydrothiazolo[4,5-h]quinazoline-3,7,9-triium-5a,9b-diid-8-yl)-3-nitro-cyclohexa-2,4-dien-1-imine |
| Molecular Mass | 340.380 g·mol−1 |
| Heat of Formation | 449.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.27 ± 1.08 D |
| Volume | 367.95 Å 3 |
| Surface Area | 340.95 Å 2 |
| HOMO Energy | -9.09 ± 0.55 eV |
| LUMO Energy | 0.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NMQIIELNPCSRPN-ODLFYWEKSA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |