(1R,2S,8R,9S)-1,9,10,11,12,12-Hexachloro-4,6-Dioxa-5-Thiatricyclo[7.2.1.0~2,8~]Dodec-10-Ene 5-Oxide
Properties
Property | Value |
---|---|
Formula | C9H6Cl6O3S |
IUPAC Name | (1r,2s,8r,9s)-1,9,10,11,12,12-hexachloro-4,6-dioxa-5-thiatricyclo[7.2.1.0 2,8 ]dodec-10-ene 5-oxide |
Molecular Mass | 406.925 g·mol−1 |
Heat of Formation | -559.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.50 ± 1.08 D |
Volume | 344.6 Å 3 |
Surface Area | 268.31 Å 2 |
HOMO Energy | -9.97 ± 0.55 eV |
LUMO Energy | 1.96 ± eV |
Point Group Symmetry | Cs |
InChIKey | RDYMFSUJUZBWLH-LLXUDWAZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O Cl |