Crystallography Open Database

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7152101 CIFC16 H11 Cl2 N O3P 1 21/n 16.393; 9.37; 26.44
90; 92.38; 90
1582Lu, Shen-Ci; Wang, Wei-Xia; Gao, Pan-Liang; Zhang, Wei; Tu, Zhi-Feng
Photoinduced chlorine atom-transfer cyclization/photohydrolysis of 3-acyl-2-chloro-N-(ω-phenylalkynyl)pyrroles: a one-pot synthesis of benzoyl-substituted fused pyrroles.
Organic & biomolecular chemistry, 2012, 10, 232-235
7152102 CIFC53 H54 N10 O13P -114.3728; 14.5231; 14.9321
66.097; 62.095; 73.914
2503.44Klein, Jörg M; Saggiomo, Vittorio; Reck, Lisa; Lüning, Ulrich; Sanders, Jeremy K. M.
Dynamic combinatorial libraries for the recognition of heavy metal ions.
Organic & biomolecular chemistry, 2012, 10, 60-66
7152103 CIFC27 H31 N5 O8C 1 c 18.0009; 25.2757; 12.9386
90; 92.918; 90
2613.16Klein, Jörg M; Saggiomo, Vittorio; Reck, Lisa; Lüning, Ulrich; Sanders, Jeremy K. M.
Dynamic combinatorial libraries for the recognition of heavy metal ions.
Organic & biomolecular chemistry, 2012, 10, 60-66
7152104 CIFC22 H15 N O S2P 1 21/c 111.8038; 16.2989; 19.3777
90; 105.682; 90
3589.3Maurya, Hardesh K.; Tandon, Vishnu K.; Kumar, Brijesh; Kumar, Abhinav; Huch, Volker; Ram, Vishnu Ji
Non-catalytic approach to the synthesis of partially reduced 'S' shaped dioxathia- and oxadithiahelicenes through base induced inter- and intramolecular C-C bond formation.
Organic & biomolecular chemistry, 2012, 10, 605-613
7152105 CIFC17 H13 Cl N2 O2 SP c a 218.7105; 8.3893; 41.097
90; 90; 90
3003.2Maurya, Hardesh K.; Tandon, Vishnu K.; Kumar, Brijesh; Kumar, Abhinav; Huch, Volker; Ram, Vishnu Ji
Non-catalytic approach to the synthesis of partially reduced 'S' shaped dioxathia- and oxadithiahelicenes through base induced inter- and intramolecular C-C bond formation.
Organic & biomolecular chemistry, 2012, 10, 605-613
7152106 CIFC23 H17 N O2 SP 1 21/n 17.723; 9.374; 24.947
90; 95.26; 90
1798.4Maurya, Hardesh K.; Tandon, Vishnu K.; Kumar, Brijesh; Kumar, Abhinav; Huch, Volker; Ram, Vishnu Ji
Non-catalytic approach to the synthesis of partially reduced 'S' shaped dioxathia- and oxadithiahelicenes through base induced inter- and intramolecular C-C bond formation.
Organic & biomolecular chemistry, 2012, 10, 605-613
7152107 CIFC31 H58 Cl3 Dy N8 O10P -110.8844; 14.3626; 15.4658
113.395; 103.121; 99.252
2074.15Milne, Mark; Chicas, Kirby; Li, Alex; Bartha, Robert; Hudson, Robert H. E.
ParaCEST MRI contrast agents capable of derivatization via"click" chemistry.
Organic & biomolecular chemistry, 2012, 10, 287-292
7152108 CIFC31 H58 Cl3 N8 Nd O10P -111.1524; 13.9136; 15.2106
110.878; 103.133; 100.034
2061.4Milne, Mark; Chicas, Kirby; Li, Alex; Bartha, Robert; Hudson, Robert H. E.
ParaCEST MRI contrast agents capable of derivatization via"click" chemistry.
Organic & biomolecular chemistry, 2012, 10, 287-292
7152109 CIFC31 H57 Cl3 N8 O10 TbP -110.8916; 14.362; 15.4604
113.338; 103.205; 99.22
2075Milne, Mark; Chicas, Kirby; Li, Alex; Bartha, Robert; Hudson, Robert H. E.
ParaCEST MRI contrast agents capable of derivatization via"click" chemistry.
Organic & biomolecular chemistry, 2012, 10, 287-292
7152110 CIFC31 H53 Cl3 N8 O10 YbP -110.8858; 14.3185; 15.4483
113.484; 102.767; 99.404
2067Milne, Mark; Chicas, Kirby; Li, Alex; Bartha, Robert; Hudson, Robert H. E.
ParaCEST MRI contrast agents capable of derivatization via"click" chemistry.
Organic & biomolecular chemistry, 2012, 10, 287-292
7152111 CIFC30 H22 F2 N2 OC 1 c 112.828; 11.141; 16.665
90; 103.208; 90
2318.7Zhou, Rong; Wang, Jianfang; Tian, Junjun; He, Zhengjie
Phosphine-catalyzed [4 + 2] annulation and vinylogous addition reactions between 1,4-dien-3-ones and 1,1-dicyanoalkenes.
Organic & biomolecular chemistry, 2012, 10, 773-781
7152113 CIFC10 H8 N2 OP 1 21/c 110.3225; 11.2447; 16.7681
90; 114.116; 90
1776.5Li, Ping; Teng, Bo-Tao; Jin, Fa-Gen; Li, Xin-Sheng; Zhu, Wei-Dong; Xie, Jian-Wu
Synthesis of functionalized 2,3-dihydroisoxazoles by domino reactions in water and unexpected ring-opening reactions of 2,3-dihydroisoxazoles.
Organic & biomolecular chemistry, 2012, 10, 244-247
7152114 CIFC6 H8 O4P 21 21 216.2773; 9.4898; 10.1036
90; 90; 90
601.87Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152115 CIFC6 H8 O4P 21 21 216.7114; 10.2593; 17.4506
90; 90; 90
1201.55Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152116 CIFC6 H8 O4P 1 21 15.0789; 11.0036; 10.9164
90; 90.128; 90
610.07Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152117 CIFC6 H8 O4P 21 21 215.6736; 9.5781; 10.7239
90; 90; 90
582.76Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152118 CIFC6 H8 O4P 21 21 216.4573; 9.4912; 10.0281
90; 90; 90
614.6Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152119 CIFC6 H8 O4P 21 21 216.1219; 8.5353; 11.8539
90; 90; 90
619.39Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152120 CIFC6 H8 O4P 1 21 16.6936; 7.0452; 6.707
90; 99.357; 90
312.08Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152121 CIFC6 H8 O4P 1 21 16.1357; 5.1847; 9.4064
90; 93.064; 90
298.81Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152122 CIFC6 H7 F O3P 1 21 17.698; 8.773; 8.885
90; 94.976; 90
597.78Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152123 CIFC6 H7 F O3P 1 21 18.193; 7.164; 10.941
90; 109.287; 90
606.14Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152124 CIFC6 H7 F O3P 21 21 216.3628; 9.2072; 10.1628
90; 90; 90
595.37Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152125 CIFC6 H7 F O3P 21 21 215.7591; 6.2197; 16.2984
90; 90; 90
583.81Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152126 CIFC6 H7 F O3P 1 21 16.1181; 7.1297; 6.9272
90; 94.628; 90
301.18Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152127 CIFC6 H7 F O3P 21 21 216.271; 7.6812; 12.1999
90; 90; 90
587.65Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152128 CIFC6 H7 F O3P 21 21 216.3457; 7.8536; 12.1288
90; 90; 90
604.46Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152129 CIFC6 H7 F O3P 21 21 217.2178; 8.7675; 9.5
90; 90; 90
601.18Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152130 CIFC6 H7 F O3P 15.1716; 5.2806; 6.082
68.403; 67.501; 80.743
142.64Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152131 CIFC6 H7 F O3P 21 21 216.7058; 8.1556; 10.7504
90; 90; 90
587.94Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152132 CIFC13 H13 F O4P 1 21 16.224; 10.6879; 8.8554
90; 106.7; 90
564.23Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan
Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride.
Organic & biomolecular chemistry, 2012, 10, 394-403
7152133 CIFC17 H16 N4 OP 1 21/c 16.203; 13.362; 18.973
90; 106.802; 90
1505.4Han, Feng; Yang, Lei; Li, Zhen; Xia, Chungu
Acidic-functionalized ionic liquid as an efficient, green and reusable catalyst for hetero-Michael addition of nitrogen, sulfur and oxygen nucleophiles to α,β-unsaturated ketones.
Organic & biomolecular chemistry, 2012, 10, 346-354
7152134 CIFC16 H15 N3 OP 1 21/c 19.912; 13.636; 10.633
90; 104.257; 90
1392.9Han, Feng; Yang, Lei; Li, Zhen; Xia, Chungu
Acidic-functionalized ionic liquid as an efficient, green and reusable catalyst for hetero-Michael addition of nitrogen, sulfur and oxygen nucleophiles to α,β-unsaturated ketones.
Organic & biomolecular chemistry, 2012, 10, 346-354
7152135 CIFC42 H57 N3 O21P -113.063; 13.707; 13.95
99.713; 99.524; 99.393
2380.7Nieto-García, Olaia; Lago-Santomé, Hugo; Cagide-Fagín, Fernando; Ortiz-Lara, Juan Carlos; Alonso, Ricardo
A formal [3+3]-annulation-based approach to pancratistatins: total synthesis of (±)-7-deoxy-pancratistatin and its 2-epi and 2,4-diepi analogues.
Organic & biomolecular chemistry, 2012, 10, 825-834
7152136 CIFC15 H23 N O2P -18.9268; 8.9385; 9.3112
68.989; 78.429; 74.952
665Gignoux, Camille; Newton, Annabella F.; Barthelme, Alexandre; Lewis, William; Alcaraz, Marie-Lyne; Stockman, Robert A.
Combining two-directional synthesis and tandem reactions: a short formal synthesis of halichlorine.
Organic & biomolecular chemistry, 2012, 10, 67-69
7152137 CIFC87 H111 Br2 Cl9 N4 O9P 1 21/c 115.9979; 29.8312; 20.5629
90; 105.044; 90
9477El Moll, Hani; Sémeril, David; Matt, Dominique; Toupet, Loïc; Harrowfield, Jean-Jacques
Resorcin[4]arene-derived mono-, bis- and tetra-imidazolium salts as ligand precursors for Suzuki-Miyaura cross-coupling.
Organic & biomolecular chemistry, 2012, 10, 372-382
7152138 CIFC15 H15 Cl N2 OP 1 21/n 18.466; 7.2644; 22.2712
90; 95.081; 90
1364.31Hardin Narayan, Alison R.; Sarpong, Richmond
Indolizinones as synthetic scaffolds: fundamental reactivity and the relay of stereochemical information.
Organic & biomolecular chemistry, 2012, 10, 70-78
7152139 CIFC16 H15 N O4C 1 2/c 122.2396; 12.8939; 10.309
90; 110.568; 90
2767.7Hardin Narayan, Alison R.; Sarpong, Richmond
Indolizinones as synthetic scaffolds: fundamental reactivity and the relay of stereochemical information.
Organic & biomolecular chemistry, 2012, 10, 70-78
7152140 CIFC27 H20P 1 21/c 113.908; 11.0651; 12.376
90; 91.176; 90
1904.2Peng, Shiyong; Wang, Lei; Wang, Jian
Iron-catalyzed ene-type propargylation of diarylethylenes with propargyl alcohols.
Organic & biomolecular chemistry, 2012, 10, 225-228
7152141 CIFC26 H24 N4 S6P b c a16.337; 9.364; 36.071
90; 90; 90
5518.1Rivadehi, Shadi; Reid, Ellen F.; Hogan, Conor F.; Bhosale, Sheshanath V.; Langford, Steven J.
Fluoride-selective optical sensor based on the dipyrrolyl-tetrathiafulvalene chromophore.
Organic & biomolecular chemistry, 2012, 10, 705-709
7152142 CIFC42 H36 O3P -113.215; 14.889; 17.81
89.02; 85.32; 65.87
3186.9Yu, Jin-Tao; Huang, Zhi-Tang; Zheng, Qi-Yu
Synthesis, structure, fullerene-binding and resolution of C(3)-symmetric cavitands with rigid and deep cavities.
Organic & biomolecular chemistry, 2012, 10, 1359-1364
7152143 CIFC15 H9 N O2P 1 21/c 112.237; 7.6556; 12.237
90; 108.92; 90
1084.4Xia, Ziming; Wang, Kuo; Zheng, Jiening; Ma, Zheyong; Jiang, Zhanguo; Wang, Xiaoxia; Lv, Xin
Copper-catalyzed domino intramolecular cyclization: a facile and efficient approach to polycyclic indole derivatives.
Organic & biomolecular chemistry, 2012, 10, 1602-1611
7152144 CIFC20 H22 O2P 1 21/c 118.554; 6.256; 13.851
90; 100.778; 90
1579.4Subba Reddy, B. V.; Borkar, Prashant; Yadav, J. S.; Purushotham Reddy, P.; Kunwar, A. C.; Sridhar, B.; Grée, René
Oxidative Prins and Prins/Friedel-Crafts cyclizations for the stereoselective synthesis of dioxabicycles and hexahydro-1H-benzo[f]isochromenes via the benzylic C-H activation.
Organic & biomolecular chemistry, 2012, 10, 1349-1358
7152145 CIFC18 H13 N3 O2P 21 21 216.1634; 11.2748; 19.9532
90; 90; 90
1386.6Iaroshenko, Viktor O.; Mkrtchyan, Satenik; Gevorgyan, Ashot; Miliutina, Mariia; Villinger, Alexander; Volochnyuk, Dmytro; Sosnovskikh, Vyacheslav Ya; Langer, Peter
2,3-unsubstituted chromones and their enaminone precursors as versatile reagents for the synthesis of fused pyridines.
Organic & biomolecular chemistry, 2012, 10, 890-894
7152146 CIFC18 H12 Cl N3 O2P 1 21/c 113.5897; 11.4742; 10.2062
90; 110.969; 90
1486.07Iaroshenko, Viktor O.; Mkrtchyan, Satenik; Gevorgyan, Ashot; Miliutina, Mariia; Villinger, Alexander; Volochnyuk, Dmytro; Sosnovskikh, Vyacheslav Ya; Langer, Peter
2,3-unsubstituted chromones and their enaminone precursors as versatile reagents for the synthesis of fused pyridines.
Organic & biomolecular chemistry, 2012, 10, 890-894
7152147 CIFC19 H15 N3 O2P 1 21/c 113.5332; 11.4883; 10.268
90; 111.013; 90
1490.24Iaroshenko, Viktor O.; Mkrtchyan, Satenik; Gevorgyan, Ashot; Miliutina, Mariia; Villinger, Alexander; Volochnyuk, Dmytro; Sosnovskikh, Vyacheslav Ya; Langer, Peter
2,3-unsubstituted chromones and their enaminone precursors as versatile reagents for the synthesis of fused pyridines.
Organic & biomolecular chemistry, 2012, 10, 890-894
7152148 CIFC20 H17 N3 OP 1 21/c 112.7467; 16.7588; 7.5184
90; 105.053; 90
1550.97Iaroshenko, Viktor O.; Mkrtchyan, Satenik; Gevorgyan, Ashot; Miliutina, Mariia; Villinger, Alexander; Volochnyuk, Dmytro; Sosnovskikh, Vyacheslav Ya; Langer, Peter
2,3-unsubstituted chromones and their enaminone precursors as versatile reagents for the synthesis of fused pyridines.
Organic & biomolecular chemistry, 2012, 10, 890-894
7152149 CIFC17 H16 Cl N3 O SP 1 21/n 17.0888; 24.91; 8.8454
90; 101.728; 90
1529.33Iaroshenko, Viktor O.; Mkrtchyan, Satenik; Gevorgyan, Ashot; Miliutina, Mariia; Villinger, Alexander; Volochnyuk, Dmytro; Sosnovskikh, Vyacheslav Ya; Langer, Peter
2,3-unsubstituted chromones and their enaminone precursors as versatile reagents for the synthesis of fused pyridines.
Organic & biomolecular chemistry, 2012, 10, 890-894
7152150 CIFC18 H19 N3 O SP 21 21 216.3395; 7.8493; 31.3577
90; 90; 90
1560.38Iaroshenko, Viktor O.; Mkrtchyan, Satenik; Gevorgyan, Ashot; Miliutina, Mariia; Villinger, Alexander; Volochnyuk, Dmytro; Sosnovskikh, Vyacheslav Ya; Langer, Peter
2,3-unsubstituted chromones and their enaminone precursors as versatile reagents for the synthesis of fused pyridines.
Organic & biomolecular chemistry, 2012, 10, 890-894
7152151 CIFC29 H25 N O7 S2P 1 21 19.934; 9.0722; 14.812
90; 104.519; 90
1292.3Du, Zhiyun; Zhou, Chenggang; Gao, Yaojun; Ren, Qiao; Zhang, Kun; Cheng, Hansong; Wang, Wei; Wang, Jian
Expeditious diastereoselective construction of a thiochroman skeleton via a cinchona alkaloid-derived catalyst.
Organic & biomolecular chemistry, 2012, 10, 36-39

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