Crystallography Open Database

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7156270 CIFC H Br0 N OP 1 21/n 17.8543; 20.6582; 8.3912
90; 116.689; 90
1216.46Wang, Rui-Xiang; Yuan, Si-Tian; Liu, Jin-Biao; Wu, Jie; Qiu, Guanyinsheng
Regioselective 5-exo-dig oxy-cyclization of 2-alkynylbenzamide for the synthesis of isobenzofuran-1-imines and isobenzofuran.
Organic & biomolecular chemistry, 2018, 16, 4501-4508
7157985 CIFC H Cl F N P RuC 1 2/c 112.9079; 14.7545; 35.0697
90; 95.042; 90
6653.17Huang, Ming; Li, Yinwu; Lan, Xiao-Bing; Liu, Jiahao; Zhao, Cunyuan; Liu, Yan; Ke, Zhuofeng
Ruthenium(II) complexes with N-heterocyclic carbene-phosphine ligands for the <i>N</i>-alkylation of amines with alcohols.
Organic & biomolecular chemistry, 2021, 19, 3451-3461
7156581 CIFC H Cl NP -110.4828; 13.6099; 13.9679
76.703; 79.086; 80.64
1889.45Ling, Fei; Xiao, Lian; Fang, Lu; Feng, Cong; Xie, Zhen; Lv, Yaping; Zhong, Weihui
B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>-catalyzed Markovnikov addition of indoles to aryl alkynes: an approach toward bis(indolyl)alkanes.
Organic & biomolecular chemistry, 2018, 16, 9274-9278
7155457 CIFC H Cl N OP -19.5682; 9.6574; 14.765
88.829; 86.829; 76.122
1322.5Zhang, Lin; Xiao, Pin; Guan, Xiaoxue; Huang, Zhouliang; Zhang, Jingping; Bi, Xihe
Silver-mediated radical coupling reaction of isocyanides and alcohols/phenols in the presence of water: unprecedented hydration and radical coupling reaction sequence.
Organic & biomolecular chemistry, 2017, 15, 1580-1583
7158285 CIFC H Cl N O SP -17.0134; 7.0858; 15.5319
96.28; 90.168; 104.398
742.77Singh, Rashmi; Sharma, Vishal Prasad; Yadav, Priyanka; Sonker, Priyanka; Singh, Radhey Mohan; Tewari, Ashish Kumar
Sodium sulphide promoted synthesis of fused quinoline at room temperature.
Organic & biomolecular chemistry, 2021, 19, 8108-8112
7156571 CIFC H F N OP 1 21/c 112.992; 9.8081; 18.9141
90; 97.2446; 90
2390.92Fu, Qiang; Wang, Rui; Liang, Fushun; Guan, Wei
Aza-tricycles containing a perfluoroalkyl group: synthesis, structure and fluorescence.
Organic & biomolecular chemistry, 2018, 16, 8950-8954
7157736 CIFC H N OP b c a12.9152; 15.907; 18.038
90; 90; 90
3705.8Liu, Siyuan; Wang, Hang; Wang, Baomin
Catalyst-free construction of spiro [benzoquinolizidine-chromanones] <i>via</i> a tandem condensation/1,5-hydride transfer/cyclization process.
Organic & biomolecular chemistry, 2020, 18, 8839-8843
7153614 CIFC H N O SP b c a13.4815; 8.2127; 28.9529
90; 90; 90
3205.65Sivaraman, Mahalingam; Perumal, Paramasivan T.
Synthesis of tetracyclic chromenones via platinum(ii) chloride catalysed cascade cyclization of enediyne-enones.
Organic & biomolecular chemistry, 2014, 12, 1318-1327
7158817 CIFC H OP -16.0447; 7.273; 33.48
90; 90.036; 90
1471.9Zhang, Sheng; Xie, Zhilong; Ye, Zhanqiang; Zhang, Mingyang; Li, Dongdeng; Yamaguchi, Masahiko; Bao, Ming
Synthesis of trans-Stilbenes via Phosphine-Catalyzed Coupling Reaction of Benzylic Halides
Organic & Biomolecular Chemistry, 2022
7159706 CIFC1.063 H1.875 N0.125 O0.125F d d 217.3542; 22.6322; 8.8875
90; 90; 90
3490.7Singh, Hanuman; Chenna, Akshay; Gangwar, Upanshu; Dutta, Souvik; Kurur, Narayanan D.; Goel, Gaurav; Haridas, V.
Bispidine as a promising scaffold for designing molecular machines.
Organic & biomolecular chemistry, 2023, 21, 9054-9060
7159825 CIFC1.54 H1.38 N0.46P -16.3402; 7.4033; 10.8259
102.832; 92.959; 114.223
445.98Pal, Koustav; Srinivasu, Vinjamuri; Biswas, Sourabh; Sureshkumar, Devarajulu
Visible light-induced organo-photocatalyzed route to synthesize substituted pyrazoles.
Organic & biomolecular chemistry, 2024, 22, 2384-2388
7158194 CIFC1.55 H1.45 O0.45P n a 219.97; 11.919; 12.5827
90; 90; 90
1495.23Chen, Yan-Shan; Zheng, Yu; Chen, Zhi-Jun; Xie, Zhen-Zhen; He, Xian-Chen; Xiao, Jun-An; Chen, Kai; Xiang, Hao-Yue; Yang, Hua
A phosphine-catalysed one-pot domino sequence to access cyclopentene-fused coumarins.
Organic & biomolecular chemistry, 2021, 19, 7074-7080
7156830 CIFC1.69 H1.38 B0.12 F0.25 N0.25P 1 21/c 112.522; 15.93; 13.262
90; 114.631; 90
2404.7Lv, Fan; Yu, Yang; Hao, Erhong; Yu, Changjiang; Wang, Hua; Boens, Noël; Jiao, Lijuan
Highly regioselective α-formylation and α-acylation of BODIPY dyes via tandem cross-dehydrogenative coupling with in situ deprotection.
Organic & biomolecular chemistry, 2019, 17, 5121-5128
7157700 CIFC1.9 H1.9 Cl0.1 F0.3 N0.1 O0.2 S0.1P -18.692; 10.4626; 12.9164
106.067; 98.907; 110.261
1017.1Wang, Xiaonan; Gao, Yuan; Wei, Zhonglin; Cao, Jungang; Liang, Dapeng; Lin, Yingjie; Duan, Haifeng
Enantioselective addition of thiols to trifluoromethyl ketimines: synthesis of <i>N</i>,<i>S</i>-ketals.
Organic & biomolecular chemistry, 2020, 18, 7431-7436
7154065 CIFC10 H10 Br2 O4P 1 21/n 18.937; 5.0321; 13.3138
90; 96.958; 90
594.34Atzori, Matteo; Pop, Flavia; Cauchy, Thomas; Mercuri, Maria Laura; Avarvari, Narcis
Thiophene-benzoquinones: synthesis, crystal structures and preliminary coordination chemistry of derived anilate ligands.
Organic & biomolecular chemistry, 2014, 12, 8752-8763
7151583 CIFC10 H10 Cl F5 OP 1 c 18.7576; 13.7337; 9.8743
90; 106.53; 90
1138.54DiMartino, Gianluca; Hursthouse, Michael B.; Light, Mark E.; Percy, Jonathan M.; Spencer, Neil S.; Tolley, Malcolm
Syntheses of selectively fluorinated cyclodecenones: the first deployment of the neutral oxy-Cope rearrangement in organofluorine chemistry
Organic & Biomolecular Chemistry, 2003, 1, 4423
7151584 CIFC10 H10 Cl F5 OP 21 21 217.979; 9.742; 14.053
90; 90; 90
1092.4DiMartino, Gianluca; Hursthouse, Michael B.; Light, Mark E.; Percy, Jonathan M.; Spencer, Neil S.; Tolley, Malcolm
Syntheses of selectively fluorinated cyclodecenones: the first deployment of the neutral oxy-Cope rearrangement in organofluorine chemistry
Organic & Biomolecular Chemistry, 2003, 1, 4423
7151594 CIFC10 H10 Cl I N4 OP 1 21/c 14.8021; 11.86; 21.79
90; 95.098; 90
1236.1Taddei, David; Kilian, Petr; Slawin, Alexandra M. Z.; Derek Woollins, J.
Synthesis and full characterisation of 6-chloro-2-iodopurine, a template for the functionalisation of purines.
Organic & biomolecular chemistry, 2004, 2, 665-670
7157940 CIFC10 H10 Cl N OP 1 21 15.1792; 13.1666; 6.8217
90; 97.057; 90
461.664Goodwin, Rosemary J.; Blyth, Mitchell T.; Fung, Alfred K. K.; Smith, Leesa M.; Norcott, Philip L.; Tanovic, Sara; Coote, Michelle L.; White, Nicholas G.
Simple acyclic molecules containing a single charge-assisted O-H group can recognize anions in acetonitrile : water mixtures.
Organic & biomolecular chemistry, 2021, 19, 2794-2803
7159173 CIFC10 H10 Cl N O2P 1 21 15.5304; 8.5314; 10.1412
90; 93.371; 90
477.655Podrezova, Ekaterina V.; Okhina, Alina A.; Rogachev, Artem D.; Baykov, Sergey V.; Kirschning, Andreas; Yusubov, Mekhman S.; Soldatova, Natalia S.; Postnikov, Pavel S.
Ligand-free Ullmann-type arylation of oxazolidinones by diaryliodonium salts.
Organic & biomolecular chemistry, 2023, 21, 1952-1957
7154109 CIFC10 H10 Cl N O4 SP 21 21 217.3279; 14.173; 22.626
90; 90; 90
2349.9Wang, You-Qing; Cui, Xiao-Yu; Ren, Yuan-Yuan; Zhang, Yongna
A highly enantioselective and regioselective organocatalytic direct Mannich reaction of methyl alkyl ketones with cyclic imines benzo[e][1,2,3]oxathiazine 2,2-dioxides.
Organic & biomolecular chemistry, 2014, 12, 9101-9104
7153666 CIFC10 H10 Cl2P 1 21 17.4192; 7.6708; 8.1477
90; 101.304; 90
454.7Boyd, Derek R.; Sharma, Narain D.; Kaik, Magdalena; McIntyre, Peter B. A.; Malone, John F.; Stevenson, Paul J.
Reactions of enantiopure cyclic diols with sulfuryl chloride.
Organic & biomolecular chemistry, 2014, 12, 2128-2136
7156283 CIFC10 H10 F2 N4 O8P b c n12.1505; 10.471; 10.2881
90; 90; 90
1308.9Zhang, Jian; Ling, Yi-Fei; Wang, Gui-Xiang; Zhang, Lin; Luo, Jun
Synthesis of two new gem-fluoronitro containing tetranitroadamantanes and property comparison with their nitro and gem-dinitro analogues.
Organic & biomolecular chemistry, 2018, 16, 4784-4788
7150338 CIFC10 H10 F2 O6P -17.3657; 7.5078; 10.1384
77.063; 78.383; 89.452
534.86Arany, Andrea; Crowley, Patrick J.; Fawcett, John; Hursthouse, Michael B.; Kariuki, Benson M.; Light, Mark E.; Moralee, Andrew C.; Percy, Jonathan M.; Salafia, Vittoria
Highly-functionalised difluorinated (hydroxymethyl)conduritol analogues via the Diels-Alder reactions of a difluorinated dienophile.
Organic & biomolecular chemistry, 2004, 2, 455-465
7156835 CIFC10 H10 F3 N O2P 1 21 16.6617; 6.6834; 22.736
90; 95.148; 90
1008.19Otevrel, Jan; Svestka, David; Bobal, Pavel
Bianthryl-based organocatalysts for the asymmetric Henry reaction of fluoroketones.
Organic & biomolecular chemistry, 2019, 17, 5244-5248
7152656 CIFC10 H10 F5 N O4P -16.4262; 9.951; 10.4639
73.787; 86.704; 75.894
623.11Kondratov, Ivan S.; Dolovanyuk, Violetta G.; Tolmachova, Nataliya A.; Gerus, Igor I.; Bergander, Klaus; Fröhlich, Roland; Haufe, Günter
Reactions of β-alkoxyvinyl polyfluoroalkyl ketones with ethyl isocyanoacetate and its use for the synthesis of new polyfluoroalkyl pyrroles and pyrrolidines.
Organic & biomolecular chemistry, 2012, 10, 8778-8785
7151585 CIFC10 H10 F6 OP -15.996; 8.007; 11.386
80.9; 87.03; 78.66
529.1DiMartino, Gianluca; Hursthouse, Michael B.; Light, Mark E.; Percy, Jonathan M.; Spencer, Neil S.; Tolley, Malcolm
Syntheses of selectively fluorinated cyclodecenones: the first deployment of the neutral oxy-Cope rearrangement in organofluorine chemistry
Organic & Biomolecular Chemistry, 2003, 1, 4423
7158781 CIFC10 H10 N2 OP 1 21/c 16.3685; 7.0657; 18.9967
90; 97.181; 90
848.11Kuznetsova, E. A.; Smolobochkin, A. V.; Rizbayeva, T. S.; Gazizov, A. S.; Voronina, J. K.; Lodochnikova, O. A.; Gerasimova, D. P.; Dobrynin, A. B.; Syakaev, V. V.; Shurpik, D. N.; Stoikov, I. I.; Burilov, A. R.; Pudovik, M. A.; Sinyashin, O. G.
Diastereoselective intramolecular cyclization/Povarov reaction cascade for the one-pot synthesis of polycyclic quinolines.
Organic & biomolecular chemistry, 2022, 20, 5515-5519
7154567 CIFC10 H10 N2 O2 S4P c a b6.8237; 8.5474; 22.3448
90; 90; 90
1303.26Le Gal, Y.; Ameline, D.; Bellec, N.; Vacher, A.; Roisnel, T.; Dorcet, V.; Jeannin, O.; Lorcy, D.
Efficient routes towards a series of 5,5'-bithiazolidinylidenes as π-electron acceptors.
Organic & biomolecular chemistry, 2015, 13, 8479-8486
7150129 CIFC10 H10 N2 O5P 1 21 15.6; 24.29; 7.74
90; 96.24; 90
1046.6Cwik, Agnieszka; Fuchs, Aliz; Hell, Zoltán; Böjtös, Ildikó; Halmai, Dóra; Bombicz, Petra
Modified Mg : Al hydrotalcite in the synthesis of oxazolidin-2-ones.
Organic & biomolecular chemistry, 2005, 3, 967-969
7150078 CIFC10 H10 N2 O5 SP 1 21/c 15.1517; 11.726; 18.705
90; 94.289; 90
1126.8Fifer, Nathan L.; White, Jonathan M.
Determining the sigma-donor ability of the cyclopropane C-C bond.
Organic & biomolecular chemistry, 2005, 3, 1776-1780
7153981 CIFC10 H10 N2 SP 1 21/c 17.1352; 12.292; 11.175
90; 94.168; 90
977.5Sadler, Scott A.; Tajuddin, Hazmi; Mkhalid, Ibraheem A. I.; Batsanov, Andrei S.; Albesa-Jove, David; Cheung, Man Sing; Maxwell, Aoife C.; Shukla, Lena; Roberts, Bryan; Blakemore, David C.; Lin, Zhenyang; Marder, Todd B.; Steel, Patrick G.
Iridium-catalyzed C-H borylation of pyridines.
Organic & biomolecular chemistry, 2014, 12, 7318-7327
7158018 CIFC10 H10 N2 SP -18.4613; 11.5857; 20.5398
105.707; 100.475; 90.015
1903.4Xiang, Lingling; Wu, Haiting; Liang, Yunshi; Deng, Huiying; He, Yiting; Xu, Qin; Zhang, Jing
Ag(I)-Catalyzed rapid access to 2-amino-4-methylenethiazolines with potential applications in bioconjugation chemistry.
Organic & biomolecular chemistry, 2021, 19, 4060-4066
7155516 CIFC10 H10 OR 3 :H19.0072; 19.0072; 5.7243
90; 90; 120
1790.97Ma, Fujie; Chen, Jingchao; Yang, Fan; Shinde, Madhuri Vikas; Zhou, Yongyun; Fan, Baomin
Palladium/zinc co-catalyzed asymmetric transfer hydrogenation of oxabenzonorbornadienes with alcohols as hydrogen sources.
Organic & biomolecular chemistry, 2017, 15, 2359-2362
7152977 CIFC10 H11 Br Cl N O3P 1 21 18.9755; 6.9472; 9.1777
90; 90.968; 90
572.19Kubelka, Tomáš; Slavětínská, Lenka; Eigner, Václav; Hocek, Michal
Synthesis of 2,6-disubstituted pyridin-3-yl C-2'-deoxyribonucleosides through chemoselective transformations of bromo-chloropyridine C-nucleosides.
Organic & biomolecular chemistry, 2013, 11, 4702-4718
7154756 CIFC10 H11 Cl N3 O4 PP -15.927; 8.999; 13.598
106.549; 97.092; 94.09
685.6Pramanik, Mukund M. D.; Rastogi, Namrata
Synthesis of α-diazo-β-keto esters, phosphonates and sulfones via acylbenzotriazole-mediated acylation of a diazomethyl anion.
Organic & biomolecular chemistry, 2015, 13, 11567-11571
7151045 CIFC10 H11 Cl OP 21 21 214.9735; 10.531; 17.521
90; 90; 90
917.7Haak, Robert M.; Tarabiono, Chiara; Janssen, Dick B.; Minnaard, Adriaan J.; de Vries, Johannes G.; Feringa, Ben L.
Synthesis of enantiopure chloroalcohols by enzymatic kinetic resolution.
Organic & biomolecular chemistry, 2007, 5, 318-323
7151175 CIFC10 H11 Fe N O4P b c a11.3721; 9.835; 20.671
90; 90; 90
2311.9Williams, Iwan; Reeves, Keith; Kariuki, Benson M.; Cox, Liam R.
Stereoselective synthesis of 2-dienyl-substituted piperidines using an eta4-dienetricarbonyliron complex as the stereocontrolling element in a double reductive amination cascade.
Organic & biomolecular chemistry, 2007, 5, 3325-3329
7151003 CIFC10 H11 N O2P 1 21 113.076; 4.98; 21.362
90; 103.18; 90
1354.4Boyd, Derek R.; Sharma, Narain D.; Coen, Gerard P.; Hempenstall, Francis; Ljubez, Vera; Malone, John F.; Allen, Christopher C. R.; Hamilton, John T. G.
Regioselectivity and stereoselectivity of dioxygenase catalysed cis-dihydroxylation of mono- and tri-cyclic azaarene substrates
Organic & Biomolecular Chemistry, 2008, 6, 3957-3966
7151231 CIFC10 H11 N O2P 21 21 215.9454; 8.1078; 18.0676
90; 90; 90
870.93Davies, Stephen G.; Garner, A. Christopher; Roberts, Paul M.; Smith, Andrew D.; Sweet, Miles J.; Thomson, James E.
Oxazinanones as chiral auxiliaries: synthesis and evaluation in enolate alkylations and aldol reactions.
Organic & biomolecular chemistry, 2006, 4, 2753-2768
7152008 CIFC10 H11 N O2P 1 21 18.4105; 5.6321; 10.022
90; 107.78; 90
452.05Devi, Rema B.; Henrot, Matthias; De Paolis, Michaël; Maddaluno, Jacques
Domino alkylation/oxa-Michael of 1,3-cyclohexanediones: Steering the C/O-chemoselectivity to reach tetrahydrobenzofuranones.
Organic & biomolecular chemistry, 2011, 9, 6509-6512
7155568 CIFC10 H11 N O2P n a 2114.32966; 8.77119; 14.61018
90; 90; 90
1836.33Lebel, Helene; Mamani Laparra, Laura; Khalifa, Maroua; Trudel, Carl; Audubert, Clément; Szponarski, Mathieu; Dicaire-Leduc, Cédric; Azek, Emna; Ernzerhof, Matthias
Synthesis of Oxazolidinones: Rhodium-Catalyzed C‒H Amination of N-Mesyloxycarbamates.
Org. Biomol. Chem., 2017
7159606 CIFC10 H11 N O2 S2P 1 21/c 110.8649; 8.9005; 11.386
90; 91.427; 90
1100.72Tiwari, Shubham; Chandrashekharappa, Sandeep; Gururaja, Guddeangadi N.
Nucleophilic sulfur controlled efficient ketothioamide synthesis from tribromomethyl carbinols.
Organic & biomolecular chemistry, 2023, 21, 8563-8572
7156019 CIFC10 H11 N O2 S3P 1 21/c 16.1417; 9.665; 20.803
90; 97.498; 90
1224.3Anitha, Mandala; Swamy, K. C. Kumara
Synthesis of thiazolidine-thiones, imino-thiazolidines and oxazolidines via the base promoted cyclisation of epoxy-sulfonamides and heterocumulenes.
Organic & biomolecular chemistry, 2018, 16, 402-413
7150081 CIFC10 H11 N O3P 1 21/c 111.1796; 7.2234; 12.745
90; 115.033; 90
932.5Fifer, Nathan L.; White, Jonathan M.
Determining the sigma-donor ability of the cyclopropane C-C bond.
Organic & biomolecular chemistry, 2005, 3, 1776-1780
7152209 CIFC10 H11 N O5P 21 21 216.4826; 6.8123; 9.0139
90; 90; 90
1012.12Gharpure, Santosh J.; Vijayasree, U.; Reddy, S. Raja Bhushan
Stereoselective synthesis and applications of nitrogen substituted donor-acceptor cyclopropanes (N-DACs) in the divergent synthesis of azacycles.
Organic & biomolecular chemistry, 2012, 10, 1735-1738
7157696 CIFC10 H12 B F4 N3P b c a14.4577; 10.5526; 15.7197
90; 90; 90
2398.3Byrne, Joseph P.; Albrecht, Martin
Anion-cation synergistic metal-free catalytic oxidative homocoupling of benzylamines by triazolium iodide salts.
Organic & biomolecular chemistry, 2020, 18, 7379-7387
7155805 CIFC10 H12 B N3 O2P 1 c 18.5138; 5.9254; 10.259
90; 105.511; 90
498.69Gu, Han; Chio, Tak Ian; Lei, Zhen; Staples, Richard J.; Hirschi, Jennifer S.; Bane, Susan
Formation of hydrazones and stabilized boron-nitrogen heterocycles in aqueous solution from carbohydrazides and ortho-formylphenylboronic acids
Org. Biomol. Chem., 2017
7157069 CIFC10 H12 Br NP 21 21 2116.0321; 6.1532; 9.7828
90; 90; 90
965.06Yuan, Minglei; Mbaezue, Ifenna I.; Zhou, Zhi; Topic, Filip; Tsantrizos, Youla S.
P-Chiral, N-phosphoryl sulfonamide Brønsted acids with an intramolecular hydrogen bond interaction that modulates organocatalysis.
Organic & biomolecular chemistry, 2019, 17, 8690-8694
7152188 CIFC10 H12 Br N O2P 21 21 215.812; 6.7788; 25.807
90; 90; 90
1016.75Clerici, Paolo; Wennemers, Helma
Mono thiomalonates as thioester enolate equivalents‒enantioselective 1,4-addition reactions to nitroolefins under mild conditions.
Organic & biomolecular chemistry, 2012, 10, 110-113

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