Crystallography Open Database
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COD ID  |
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Space group |
Cell parameters | Cell volume |
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|---|---|---|---|---|---|---|
| 7213253 | CIF | C36 H32 N4 O6 | P -1 | 8.932; 9.67; 10.105 100.95; 105.61; 106.37 | 772.4 | Rigolet, Séverinne; Mélot, Jean Marie; Vébrel, Joel; Chiaroni, Angèle; Riche, Claude The reaction of α- and ω-methylenelactams with nitrones. Influence of electronic and geometric factors on the stereoselectivity of their 1,3-dipolar cycloaddition Journal of the Chemical Society, Perkin Transactions 1, 2000, 1095 |
| 7213254 | CIF | C23 H27 Cl2 Co N2 O4 | P 1 21/c 1 | 12.4467; 11.4978; 19.0943 90; 125.34; 90 | 2229.1 | Blaauw, Rolf; Kingma, Irene E.; Laan, Jan H.; van der Baan, Juul L.; Balt, Sijbe; de Bolster, Martinus W. G.; Klumpp, Gerhard W.; Smeets, Wilberth J. J.; Spek, Anthony L. Bridged (β-alkoxyalkyl)CoIII(salen) complexes by intramolecular alkoxycobaltation of unactivated alkenes: new models for coenzyme B12 Journal of the Chemical Society, Perkin Transactions 1, 2000, 1199 |
| 7213257 | CIF | C14 H18 Cl4 O4 | P b c a | 15.857; 17.205; 13.287 90; 90; 90 | 3625 | Ohkita, Masakazu; Sano, Kieko; Dohba, Sotoyuki; Fujita, Yuko; Suzuki, Takanori; Tsuji, Takashi A 2,3,5,6-tetramethylenebicyclo[2.2.0]hexane derivative: a novel bisdiene molecule that produces a Dewar benzene skeleton upon two successive Diels‒Alder reactions with dienophiles Journal of the Chemical Society, Perkin Transactions 1, 2000, 1971 |
| 7213258 | CIF | C30 H26 O2 | P 1 21/c 1 | 11.419; 11.0908; 17.519 90; 90.025; 90 | 2218.7 | Ohkita, Masakazu; Sano, Kieko; Dohba, Sotoyuki; Fujita, Yuko; Suzuki, Takanori; Tsuji, Takashi A 2,3,5,6-tetramethylenebicyclo[2.2.0]hexane derivative: a novel bisdiene molecule that produces a Dewar benzene skeleton upon two successive Diels‒Alder reactions with dienophiles Journal of the Chemical Society, Perkin Transactions 1, 2000, 1971 |
| 7213259 | CIF | C19 H18 O4 S3 | C 1 c 1 | 20.672; 10.8482; 8.7192 90; 104.683; 90 | 1891.5 | Di Vitta, Claudio; de Arruda Campos, Ivan P.; Farah, João P. S.; Zukerman-Schpector, Júlio New reductive addition of hard nucleophiles to 6,7-bis(methylsulfanyl)-1,4-dihydro-1,4-methanonaphthalene-5,8-dione Journal of the Chemical Society, Perkin Transactions 1, 2000, 3692 |
| 7213260 | CIF | C24 H25 N O2 | P 1 21/n 1 | 7.6743; 24.817; 10.629 90; 101.216; 90 | 1985.7 | Clayden, Jonathan; Westlund, Neil; Beddoes, Roy L.; Helliwell, Madeleine Atroposelective attack of nucleophiles and electrophiles on 2-acyl-1-naphthamides and their enolates Journal of the Chemical Society, Perkin Transactions 1, 2000, 1351 |
| 7213261 | CIF | C21 H29 N O2 | P b c a | 12.404; 19.6149; 16.222 90; 90; 90 | 3946.9 | Clayden, Jonathan; Westlund, Neil; Beddoes, Roy L.; Helliwell, Madeleine Atroposelective attack of nucleophiles and electrophiles on 2-acyl-1-naphthamides and their enolates Journal of the Chemical Society, Perkin Transactions 1, 2000, 1351 |
| 7213262 | CIF | C19 H23 N O2 | P 1 21/c 1 | 10.1424; 16.7857; 10.7011 90; 114.446; 90 | 1658.5 | Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S. Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control Journal of the Chemical Society, Perkin Transactions 1, 2000, 1363 |
| 7213263 | CIF | C21 H27 N O2 | P 1 21/c 1 | 11.4254; 20.1558; 16.4936 90; 99.506; 90 | 3746.1 | Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S. Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control Journal of the Chemical Society, Perkin Transactions 1, 2000, 1363 |
| 7213264 | CIF | C20 H28 N2 O | P b c a | 16.219; 11.966; 18.823 90; 90; 90 | 3653.1 | Clayden, Jonathan; McCarthy, Catherine; Westlund, Neil; Frampton, Christopher S. Atroposelective attack of nucleophiles on 2-formyl-1-naphthamides and their derivatives: chelation and non-chelation control Journal of the Chemical Society, Perkin Transactions 1, 2000, 1363 |
| 7213265 | CIF | C24 H27 N O2 | P 1 21 1 | 9.358; 11.813; 9.917 90; 114.44; 90 | 998.1 | Clayden, Jonathan; Westlund, Neil; Frampton, Christopher S. Atropisomeric diastereoisomers from nucleophilic attack on 8-acyl-1-naphthamides Journal of the Chemical Society, Perkin Transactions 1, 2000, 1379 |
| 7213269 | CIF | C23 H19 N2 O3.5 | P b c n | 25.868; 7.826; 18.105 90; 90; 90 | 3665.2 | Kumar, Subodh; Hundal, Geeta; Paul, Dharam; Hundal, Maninder Singh; Singh, Harjit Heterocalixarenes. Part 4. Synthesis of oxocalix[1]heterocycle[2]arenes: a unique H-bonding network in calix[1]benzimidazol-2-one[2]arene· 1/2 H2O † Journal of the Chemical Society, Perkin Transactions 1, 2000, 2295 |
| 7213270 | CIF | C20 H16 N2 O4 | P 1 21/n 1 | 12.259; 8.865; 15.943 90; 110.46; 90 | 1623.3 | Kumar, Subodh; Hundal, Geeta; Paul, Dharam; Hundal, Maninder Singh; Singh, Harjit Heterocalixarenes. Part 4. Synthesis of oxocalix[1]heterocycle[2]arenes: a unique H-bonding network in calix[1]benzimidazol-2-one[2]arene· 1/2 H2O † Journal of the Chemical Society, Perkin Transactions 1, 2000, 2295 |
| 7213271 | CIF | C24 H32 Fe O | P -1 | 6.0101; 11.636; 14.551 80.22; 81.78; 88.121 | 992.5 | Carroll, Michael A.; White, Andrew J. P.; Widdowson, David A.; Williams, David J. Efficient regio- and diastereo-controlled synthesis of 1,1′- and 1,1′,2,2′-functionalised ferrocenes and the formation of 2-oxa[3]ferrocenophanes Journal of the Chemical Society, Perkin Transactions 1, 2000, 1551 |
| 7213272 | CIF | C24 H32 Fe O | P 1 21/c 1 | 5.864; 28.331; 12.241 90; 98.36; 90 | 2012 | Carroll, Michael A.; White, Andrew J. P.; Widdowson, David A.; Williams, David J. Efficient regio- and diastereo-controlled synthesis of 1,1′- and 1,1′,2,2′-functionalised ferrocenes and the formation of 2-oxa[3]ferrocenophanes Journal of the Chemical Society, Perkin Transactions 1, 2000, 1551 |
| 7213274 | CIF | C34 H46 O3 | P -3 | 22.3915; 22.3915; 10.4686 90; 90; 120 | 4545.5 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213275 | CIF | C35 H46 Br Cl3 O3 | P 21 21 2 | 19.0851; 19.4641; 9.5618 90; 90; 90 | 3552 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213276 | CIF | C35 H45 Br Cl2 O2 | P 21 21 21 | 9.3103; 12.5249; 28.9201 90; 90; 90 | 3372.4 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213277 | CIF | C40 H58 O6 | P -1 | 10.2038; 13.5294; 14.9405 96.034; 94.077; 110.752 | 1905 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213278 | CIF | C34 H44 O3 | P -1 | 11.1823; 12.6574; 12.8089 103.779; 108.435; 111.672 | 1463.07 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213279 | CIF | C62.67 H100.33 Li3 O7.67 | P 1 21/c 1 | 20.9835; 10.8817; 27.2374 90; 98.486; 90 | 6151.2 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213280 | CIF | C42.4 H54.8 O3.8 | P -1 | 11.9562; 12.7398; 13.4304 97.043; 90.828; 105.813 | 1951 | Dinger, Maarten B.; Scott, Michael J. Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741 |
| 7213283 | CIF | C9 H8 F5 O2.5 | C 1 2/c 1 | 25.133; 6.757; 11.032 90; 105.44; 90 | 1805.9 | Batsanov, Andrei S.; Brooke, Gerald M.; Holling, Darren; Kenwright, Alan M. Pyrolysis reactions of nonafluorobiphenyl-4-yl prop-2-enyl ether: a remarkable rearrangement reaction of an intramolecular Diels‒Alder product Journal of the Chemical Society, Perkin Transactions 1, 2000, 1731 |
| 7213284 | CIF | C26 H25 O4 P | P -1 | 10.047; 13.6137; 18.555 97.04; 104.117; 106.888 | 2303.4 | Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones Journal of the Chemical Society, Perkin Transactions 1, 2000, 1723 |
| 7213285 | CIF | C31 H30 O4 P | C 1 2/c 1 | 25.351; 12.9583; 16.409 90; 103.679; 90 | 5237.6 | Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones Journal of the Chemical Society, Perkin Transactions 1, 2000, 1723 |
| 7213286 | CIF | C29 H21 O4 P | P 1 21/n 1 | 8.938; 22.265; 11.629 90; 95.56; 90 | 2303.3 | Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones Journal of the Chemical Society, Perkin Transactions 1, 2000, 1723 |
| 7213287 | CIF | C27 H25 N2 O4 P | P -1 | 9.263; 11.217; 11.839 77.81; 89.5; 82.39 | 1191.5 | Schobert, Rainer; Siegfried, Sven; Nieuwenhuyzen, Mark; Milius, Wolfgang; Hampel, Frank Selective C-acylation of CH-active dicarbonyl compounds with ketenylidenetriphenylphosphorane: syntheses and structures of 3-phosphoranylideneacyltetronic acids, 3-phosphoranylideneacyl-4-oxocoumarins, and 4-phosphoranylideneacylpyrazol-5-ones Journal of the Chemical Society, Perkin Transactions 1, 2000, 1723 |
| 7213290 | CIF | C13 H6 Cl F5 O | P 1 21/c 1 | 8.914; 10.407; 13.607 90; 95.68; 90 | 1256.1 | Kovtonyuk, Vladimir N.; Kobrina, Ljubov S.; Gatilov, Yurij V.; Bagryanskaya, Irina Yu.; Fröhlich, Roland; Haufe, Günter Reactions of polyfluorinated cyclohexadienones with diazoalkanes. Part 1. Formation of cyclopropanes from polyfluorinated cyclohexa-2,4-dienones with diazomethane and phenyldiazomethane Journal of the Chemical Society, Perkin Transactions 1, 2000, 1929 |
| 7213291 | CIF | C13 H6 Cl F5 O | P 1 21/c 1 | 11.205; 13.755; 7.725 90; 91.28; 90 | 1190.3 | Kovtonyuk, Vladimir N.; Kobrina, Ljubov S.; Gatilov, Yurij V.; Bagryanskaya, Irina Yu.; Fröhlich, Roland; Haufe, Günter Reactions of polyfluorinated cyclohexadienones with diazoalkanes. Part 1. Formation of cyclopropanes from polyfluorinated cyclohexa-2,4-dienones with diazomethane and phenyldiazomethane Journal of the Chemical Society, Perkin Transactions 1, 2000, 1929 |
| 7213301 | CIF | C19 H20 N2 O2 | P 1 21/n 1 | 10.04; 12.331; 12.675 90; 99.651; 90 | 1547 | Banwell, Martin; Edwards, Alison; Smith, Jason; Hamel, Ernest; Verdier-Pinard, Pascal Convergent synthesis and preliminary biological evaluation of (±)-B-norrhazinal † Journal of the Chemical Society, Perkin Transactions 1, 2000, 1497 |
| 7213302 | CIF | C13 H22 N2 O4 | P 42 | 12.6541; 12.6541; 9.2145 90; 90; 90 | 1475.48 | Hammer, Kristin; Wang, Jing; Falck-Pedersen, Mette Lene; Rømming, Christian; Undheim, Kjell Stereoselectivity in the synthesis of conformationally constrained vicinally dihydroxylated cyclic α-amino acids Journal of the Chemical Society, Perkin Transactions 1, 2000, 1691 |
| 7213303 | CIF | C16 H28 N2 O4 | P 1 21 1 | 9.7253; 8.7384; 10.9031 90; 109.013; 90 | 876.03 | Hammer, Kristin; Wang, Jing; Falck-Pedersen, Mette Lene; Rømming, Christian; Undheim, Kjell Stereoselectivity in the synthesis of conformationally constrained vicinally dihydroxylated cyclic α-amino acids Journal of the Chemical Society, Perkin Transactions 1, 2000, 1691 |
| 7213304 | CIF | C16 H16 N2 O3 | P b c a | 7.176; 17.805; 20.947 90; 90; 90 | 2676.4 | Jones, Raymond C. F.; Dimopoulos, Paschalis; Coles, Simon C.; Light, Mark E.; Hursthouse, Michael B. Synthesis of imidazo[1,2-a]pyridines from unactivated 2-alkyl-4,5-dihydroimidazoles through conjugate N-addition Journal of the Chemical Society, Perkin Transactions 1, 2000, 2331 |
| 7213305 | CIF | C17 H18 N2 O | P -1 | 8.831; 11.534; 13.182 90.34; 92.49; 90.79 | 1341.3 | Jones, Raymond C. F.; Dimopoulos, Paschalis; Coles, Simon C.; Light, Mark E.; Hursthouse, Michael B. Synthesis of imidazo[1,2-a]pyridines from unactivated 2-alkyl-4,5-dihydroimidazoles through conjugate N-addition Journal of the Chemical Society, Perkin Transactions 1, 2000, 2331 |
| 7213306 | CIF | C25 H28 N2 O4 | P -1 | 11.0117; 10.6661; 12.2753 65.331; 65.329; 62.908 | 1119.42 | Jones, Raymond C. F.; Dimopoulos, Paschalis; Coles, Simon C.; Light, Mark E.; Hursthouse, Michael B. Synthesis of imidazo[1,2-a]pyridines from unactivated 2-alkyl-4,5-dihydroimidazoles through conjugate N-addition Journal of the Chemical Society, Perkin Transactions 1, 2000, 2331 |
| 7213307 | CIF | C46 H58 N4 O32 S | P 1 21 1 | 13.724; 14.03; 17.657 90; 110.19; 90 | 3190.9 | Bau, Robert; Jin, Kevin Kai Crystal structure of vinblastine Journal of the Chemical Society, Perkin Transactions 1, 2000, 2079 |
| 7213308 | CIF | C36 H38 O10 | P -1 | 8.781; 8.807; 21.478 79.22; 79.78; 73.48 | 1550.6 | Lee, Liang-Hui; Lynch, Vincent; Lagow, Richard J. The synthesis and structural characterization of the first bis(benzocrown ethers) with polyyne linkages † Journal of the Chemical Society, Perkin Transactions 1, 2000, 2805 |
| 7213309 | CIF | C32 H38 O10 | P 1 21/c 1 | 13.344; 5.1406; 21.862 90; 100.95; 90 | 1472.3 | Lee, Liang-Hui; Lynch, Vincent; Lagow, Richard J. The synthesis and structural characterization of the first bis(benzocrown ethers) with polyyne linkages † Journal of the Chemical Society, Perkin Transactions 1, 2000, 2805 |
| 7213310 | CIF | C30 H27 N3 O12 P4 | P 21 21 21 | 9.4387; 18.424; 19.358 90; 90; 90 | 3366.3 | Wang, Wenhu; Cao, Ruzhen; Liu, Lunzu The synthesis of novel trisphosphoranylphosphine and its oxide Journal of the Chemical Society, Perkin Transactions 1, 2000, 1673 |
| 7213311 | CIF | C17 H17 N O2 S | P 1 21 1 | 5.4491; 8.7088; 14.951 90; 94.31; 90 | 707.5 | Ali, Akbar; Uddin Ahmad, Viqar; Leistner, Joachim; Liebscher, Jürgen Optically active 1,5-benzothiazepin-4-ones by ring transformation of 5-ylidene-1,3-dioxan-4-ones with 2-aminothiophenol Journal of the Chemical Society, Perkin Transactions 1, 2000, 1897 |
| 7213312 | CIF | C13 H17 N O2 S | P 21 21 21 | 8.5736; 12.007; 12.669 90; 90; 90 | 1304.2 | Ali, Akbar; Uddin Ahmad, Viqar; Leistner, Joachim; Liebscher, Jürgen Optically active 1,5-benzothiazepin-4-ones by ring transformation of 5-ylidene-1,3-dioxan-4-ones with 2-aminothiophenol Journal of the Chemical Society, Perkin Transactions 1, 2000, 1897 |
| 7213313 | CIF | C22 H24 O3 | P 1 21/n 1 | 5.5486; 17.8452; 19.0424 90; 91.93; 90 | 1884.43 | Avery, Thomas D.; Greatrex, Ben W.; Taylor, Dennis K.; Tiekink, Edward R. T. Exploitation of ylide steric bulk to alter cyclopropanation outcome during the reaction of 1,2-dioxines and stabilised phosphorus ylides Journal of the Chemical Society, Perkin Transactions 1, 2000, 1319 |
| 7213315 | CIF | C12 H26 O3 | P -1 | 7.347; 7.874; 12.715 71.339; 78.603; 81.054 | 679.77 | Delas, Christophe; Blacque, Olivier; Moïse, Claude Study of a tandem aldol‒Tischtschenko reaction between chiral enolsilanes and aldehydes catalyzed by titanium(IV) isopropoxide Journal of the Chemical Society, Perkin Transactions 1, 2000, 2265 |
| 7213316 | CIF | C12 H26 O3 | P 1 21/n 1 | 9.6044; 12.3674; 11.9674 90; 106.324; 90 | 1364.2 | Delas, Christophe; Blacque, Olivier; Moïse, Claude Study of a tandem aldol‒Tischtschenko reaction between chiral enolsilanes and aldehydes catalyzed by titanium(IV) isopropoxide Journal of the Chemical Society, Perkin Transactions 1, 2000, 2265 |
| 7213317 | CIF | C29 H32 N2 O2 S2 | P 1 21/c 1 | 12.504; 11.299; 19.8 90; 113.3; 90 | 2569 | Halfpenny, Joan; Sloman, Zachary S. An effective self-templating ring closure method for mixed donor thiophene-based macrocycles Journal of the Chemical Society, Perkin Transactions 1, 2000, 1877 |
| 7213318 | CIF | C19.5 H18 Cl Fe N O9 | P 1 21/c 1 | 11.432; 24.74; 7.678 90; 92.45; 90 | 2170 | Ley, Steven V.; Wright, Edward A. 1,7-Asymmetric induction of chirality in a Mukaiyama aldol reaction using π-allyltricarbonyliron lactone complexes: highly diastereoselective synthesis of α-substituted β-hydroxy carbonyl compounds Journal of the Chemical Society, Perkin Transactions 1, 2000, 1677 |
| 7213319 | CIF | C28 H25 N3 | P 21 a b | 9.527; 12.367; 18.594 90; 90; 90 | 2190.8 | Mahato, Shashi B.; Garai, Subhadra; Weber, Manuela; Luger, Peter Synthesis of novel 1-methylindole trimer and tetramer under Friedel‒Crafts reaction conditions and determination of their structures by X-ray crystallography Journal of the Chemical Society, Perkin Transactions 1, 2000, 2767 |
| 7213320 | CIF | C36 H30 N4 | P -1 | 10.595; 11.125; 13.02 78.57; 68.32; 86.25 | 1397.8 | Mahato, Shashi B.; Garai, Subhadra; Weber, Manuela; Luger, Peter Synthesis of novel 1-methylindole trimer and tetramer under Friedel‒Crafts reaction conditions and determination of their structures by X-ray crystallography Journal of the Chemical Society, Perkin Transactions 1, 2000, 2767 |
| 7213321 | CIF | C11 H10 O4 | P -1 | 6.667; 7.607; 10.567 73.34; 86.35; 75.58 | 497.2 | Canali, Laetitia; Cowan, Elaine; Deleuze, Hervé; Gibson, Colin L.; Sherrington, David C. Polystyrene and polymethacrylate resin-supported Jacobsen’s alkene epoxidation catalyst Journal of the Chemical Society, Perkin Transactions 1, 2000, 2055 |
| 7213324 | CIF | C12 H24 F6 N4 S2 | P b c a | 14.34; 11.781; 22.032 90; 90; 90 | 3722.1 | Kolomeitsev, Alexander; Médebielle, Maurice; Kirsch, Peer; Lork, Enno; Röschenthaler, Gerd-Volker Synthesis, structure and reactivity of a trifluoromethyl sulfide anionic salt stabilized with tetrakis(dimethylamino)ethylene dication (TDAE2+) Journal of the Chemical Society, Perkin Transactions 1, 2000, 2183 |
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