4-(5-Sulfanyl-3H-1,2-Dithiol-3-Ylidene)-2,5-Cyclohexadien-1-One
Properties
Property | Value |
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Formula | C9H6OS3 |
IUPAC Name | 4-(5-sulfanyldithiol-3-ylidene)cyclohexa-2,5-dien-1-one |
Molecular Mass | 226.338 g·mol−1 |
Heat of Formation | 156.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.48 ± 1.08 D |
Volume | 240.94 Å 3 |
Surface Area | 227.2 Å 2 |
HOMO Energy | -8.42 ± 0.55 eV |
LUMO Energy | -2.43 ± eV |
Point Group Symmetry | Cs |
Synonyms |
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CAS Number(s) |
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InChIKey | ROGBQLVTFIEBAV-UHFFFAOYSA-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 |