| Revision as of 16:26, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 456618337 of page 1,4,7-Trithiacyclononane for the Chem/Drugbox validation project (updated: 'CASNo'). |
Latest revision as of 12:34, 2 February 2024 edit Mykhal (talk | contribs)Extended confirmed users5,563 editsm ref title: typography per print, |
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} |
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{{chembox |
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{{chembox |
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| verifiedrevid = 399186764 |
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| Watchedfields = changed |
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| ImageFile = 9-ane-S3.svg |
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| verifiedrevid = 477205778 |
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| ImageSize = |
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| IUPACName = 1,4,7-Trithionane |
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| ImageFile = 1,4,7-Trithiacyclononane.svg |
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| ImageSize = 130 |
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| OtherNames = 1,4,7-Trithiacyclononane, Triethylene trisulfide, 9-ane-S3, aneS<sub>3</sub> |
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| ImageFile1 = 1,4,7-Trithiacyclononane-3D-balls.png |
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| Section1 = {{Chembox Identifiers |
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| ImageSize1 = 160 |
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| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
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| ImageAlt1 = 1,4,7-Trithiacyclononane molecule |
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| PIN = 1,4,7-Trithionane |
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| OtherNames = 1,4,7-Trithiacyclononane, Triethylene trisulfide, 9-ane-S3, aneS<sub>3</sub> |
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|Section1={{Chembox Identifiers |
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| CASNo_Ref = {{cascite|correct|CAS}} |
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| CASNo = 6573-11-1 |
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| UNII_Ref = {{fdacite|correct|FDA}} |
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| UNII = UD7TP2TQQ7 |
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| ChEBI_Ref = {{ebicite|correct|EBI}} |
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| ChEBI = 37418 |
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| ChEMBL = 1965619 |
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| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
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| ChemSpiderID = 331656 |
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| ChemSpiderID = 331656 |
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| EINECS = 621-680-0 |
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| PubChem = 373835 |
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| InChI = 1/C6H12S3/c1-2-8-5-6-9-4-3-7-1/h1-6H2 |
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| InChI = 1/C6H12S3/c1-2-8-5-6-9-4-3-7-1/h1-6H2 |
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| InChIKey = PQNPKQVPJAHPSB-UHFFFAOYAS |
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| InChIKey = PQNPKQVPJAHPSB-UHFFFAOYAS |
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| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChIKey = PQNPKQVPJAHPSB-UHFFFAOYSA-N |
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| StdInChIKey = PQNPKQVPJAHPSB-UHFFFAOYSA-N |
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| SMILES = C1CSCCSCCS1 |
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| CASNo_Ref = {{cascite|correct|??}} |
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| CASNo = <!-- blanked - oldvalue: 6573-11-1 --> |
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| PubChem = 373835 |
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| SMILES = C1CSCCSCCS1 |
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| ChEBI_Ref = {{ebicite|correct|EBI}} |
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| ChEBI = 37418 |
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}} |
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| Section2 = {{Chembox Properties |
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|Section2={{Chembox Properties |
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| Formula = C<sub>6</sub>H<sub>12</sub>S<sub>3</sub> |
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| Formula = C<sub>6</sub>H<sub>12</sub>S<sub>3</sub> |
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| MolarMass = 180.35 g/mol |
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| MolarMass = 180.35 g/mol |
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| Appearance = Colourless solid |
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| Appearance = Colourless solid |
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| Density = |
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| Density = |
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| MeltingPt = 78 - 81 °C |
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| MeltingPtC = 78 to 81 |
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| BoilingPt = Decomp. |
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| BoilingPt = decomposes |
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| Solubility = Insoluble |
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| SolubleOther = ]s, ] |
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| Solubility = Insoluble |
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| SolubleOther = ]s, ] |
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| Section7 = {{Chembox Hazards |
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|Section7={{Chembox Hazards |
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| MainHazards = Toxic ('''T''') |
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| MainHazards = Toxic |
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| RPhrases = {{R36/37/38}} |
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| GHSPictograms = {{GHS07}} |
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| GHSSignalWord = Warning |
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| SPhrases = {{S26}}, {{S36}} |
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| HPhrases = {{H-phrases|315|319|335}} |
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| FlashPt = |
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| PPhrases = {{P-phrases|261|264|271|280|302+352|304+340|305+351+338|312|321|332+313|337+313|362|403+233|405|501}} |
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| Section8 = {{Chembox Related |
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| OtherAnions = |
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| OtherCpds = ], ], ] |
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| OtherCompounds = ], ], ] |
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'''1,4,7-Trithiacyclononane''', also called 9-ane-S3, is the ] with the formula (CH<sub>2</sub>CH<sub>2</sub>S)<sub>3</sub>. This cyclic ] is most often encountered as a ] in ], where it forms ]es. |
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9-ane-S3 forms complexes with many metal ions, including those considered ], such as copper(II) and iron(II).<ref>{{cite journal |author1=Kueppers, H. J. |author2=Wieghardt, K. |author3=Nuber, B. |author4=Weiss, J. W. |author5=Bill, E. |author6=Trautwein, A. X. | date = 1987 | title = Crown Thioether Chemistry of Iron(II/III). Synthesis and Characterization of Low-Spin Bis(1,4,7-trithiacyclononane)iron(III) and crystal structure of aneS<sub>3</sub>)(aneS<sub>3</sub>(O))](ClO<sub>4</sub>)<sub>2</sub>·2NaClO<sub>4</sub>·H<sub>2</sub>O | journal = Inorganic Chemistry | volume = 26 | issue = 22| pages = 3762–3769(8) | doi = 10.1021/ic00269a028}}</ref> Most of its complexes have the formula <sup>2+</sup> and are ]. The point group of <sup>2+</sup> is S<sub>6</sub>. |
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==Synthesis== |
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This compound was first reported in 1977,<ref>{{cite journal |author1=Gerber, D. |author2=Chongsawangvirod, P. |author3=Leung, A. K. |author4=Ochrymowycz, L. A. | date = 1977 | title = Synthesis of the Torsionally Strained Monocyclic Polythiaether 1,4,7-Trithiacyclononane | journal = Journal of Organic Chemistry | volume = 42 | issue = 15| pages = 2644–2645 | doi = 10.1021/jo00435a030}}</ref> and the current synthesis entails the assembly within the ] of a metal ion followed by ]:<ref>{{cite journal |author1=Sellmann, D. |author2=Zapf, L. | date = 1984 | title = Simple Route to 1,4,7-Trithiacyclononane | journal = Angewandte Chemie | volume = 96 | issue = 10| pages = 799–800(2) | doi = 10.1002/ange.19840961019}}</ref> |
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==References== |
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<references/> |
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{{DEFAULTSORT:Trithiacyclononane, 1,4,7-}} |
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