2-[(1R,3S,7R,9S)-8-(Dicyanomethylene)-5,11-Dithia-4,6,10,12-Tetrazatricyclo[7.3.0.03,7]Dodecan-2-Ylidene]Propanedinitrile
Properties
| Property | Value |
|---|---|
| Formula | C12H8N8S2 |
| IUPAC Name | 2-[(1r,3s,7r,9s)-8-(dicyanomethylene)-5,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodecan-2-ylidene]propanedinitrile |
| Molecular Mass | 328.376 g·mol−1 |
| Heat of Formation | 1184.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.99 ± 1.08 D |
| Volume | 330.55 Å 3 |
| Surface Area | 297.08 Å 2 |
| HOMO Energy | -9.87 ± 0.55 eV |
| LUMO Energy | -0.71 ± eV |
| Point Group Symmetry | C2v |
| InChIKey | FDCWSLLOWNTPAL-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | S C N |