(2S,4R,5R)-6,6-Dibromo-3,3-Dimethyl-4,7-Dioxo-4Λ4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carbonitrile
Properties
| Property | Value |
|---|---|
| Formula | C8H8Br2N2O2S |
| IUPAC Name | (2s,4r,5r)-6,6-dibromo-3,3-dimethyl-4,7-dioxo-4λ4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile |
| Molecular Mass | 356.034 g·mol−1 |
| Heat of Formation | 9.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.36 ± 1.08 D |
| Volume | 289.1 Å 3 |
| Surface Area | 240.93 Å 2 |
| HOMO Energy | -9.54 ± 0.55 eV |
| LUMO Energy | 1.97 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DQIQPIUMKAOUGS-OTLRQTHMSA-N |
| QR Code | Generate QR Code |
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| Elements | C H O N S Br |