Crystallography Open Database

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7157080 CIFC50 H52 N4 O4P -112.8963; 13.1501; 17.101
92.305; 111.817; 103.594
2590.69Xu, Yuanshuang; Zhang, Linghua; Liu, Mengyang; Zhang, Xiaopeng; Zhang, Xinying; Fan, Xuesen
Synthesis of benzoazepine derivatives via Rh(iii)-catalyzed inert C(sp<sup>2</sup>)-H functionalization and [4 + 3] annulation.
Organic & biomolecular chemistry, 2019, 17, 8706-8710
7157081 CIFC21 H17 F N2 O2P 21 21 218.7924; 10.9272; 18.098
90; 90; 90
1738.79Xu, Yuanshuang; Zhang, Linghua; Liu, Mengyang; Zhang, Xiaopeng; Zhang, Xinying; Fan, Xuesen
Synthesis of benzoazepine derivatives via Rh(iii)-catalyzed inert C(sp<sup>2</sup>)-H functionalization and [4 + 3] annulation.
Organic & biomolecular chemistry, 2019, 17, 8706-8710
7157082 CIFC21 H16 N2 OP b c a11.2543; 11.6498; 23.6897
90; 90; 90
3105.96Xu, Yuanshuang; Zhang, Linghua; Liu, Mengyang; Zhang, Xiaopeng; Zhang, Xinying; Fan, Xuesen
Synthesis of benzoazepine derivatives via Rh(iii)-catalyzed inert C(sp<sup>2</sup>)-H functionalization and [4 + 3] annulation.
Organic & biomolecular chemistry, 2019, 17, 8706-8710
7157083 CIFC23 H23 Br N2 O3 SP 1 21/c 18.7087; 24.853; 10.406
90; 110.876; 90
2104.4Xu, Yuanshuang; Zhang, Linghua; Liu, Mengyang; Zhang, Xiaopeng; Zhang, Xinying; Fan, Xuesen
Synthesis of benzoazepine derivatives via Rh(iii)-catalyzed inert C(sp<sup>2</sup>)-H functionalization and [4 + 3] annulation.
Organic & biomolecular chemistry, 2019, 17, 8706-8710
7157084 CIFC23 H26 N2 O2P 1 21/n 111.5219; 11.4926; 15.5242
90; 92.72; 90
2053.3Amiri, Kamran; Khosravi, Hormoz; Balalaie, Saeed; Golmohammadi, Farhad; Anwar, Muhammad U.; Al-Harrasi, Ahmed
Regio- and chemo-selective cyclization of allenic-Ugi products for the synthesis of 3-pyrroline skeletons.
Organic & biomolecular chemistry, 2019, 17, 8858-8870
7157085 CIFC25 H26 Cl2 N2 O2P 1 21/n 116.0878; 7.3312; 19.996
90; 101.831; 90
2308.3Amiri, Kamran; Khosravi, Hormoz; Balalaie, Saeed; Golmohammadi, Farhad; Anwar, Muhammad U.; Al-Harrasi, Ahmed
Regio- and chemo-selective cyclization of allenic-Ugi products for the synthesis of 3-pyrroline skeletons.
Organic & biomolecular chemistry, 2019, 17, 8858-8870
7157086 CIFC31 H27 N O4 SP 1 21/c 115.6522; 13.6042; 12.4636
90; 107.449; 90
2531.8Gharpure, Santosh J.; Nanda, Santosh K.; Fartade, Dipak J.
Expeditious diastereoselective synthesis of medium ring heterocycle-fused chromenes via tandem 8/9-endo-dig and 8-exo-dig hydroalkoxylation-formal-[4 + 2] cycloaddition.
Organic & biomolecular chemistry, 2019, 17, 8806-8810
7157087 CIFC56 H58 N2 O10 S2P -110.605; 16.0358; 16.1366
69.467; 72.006; 89.666
2427.91Gharpure, Santosh J.; Nanda, Santosh K.; Fartade, Dipak J.
Expeditious diastereoselective synthesis of medium ring heterocycle-fused chromenes via tandem 8/9-endo-dig and 8-exo-dig hydroalkoxylation-formal-[4 + 2] cycloaddition.
Organic & biomolecular chemistry, 2019, 17, 8806-8810
7157088 CIFC33 H31 N O4 SP 1 21/c 19.2545; 9.0908; 32.563
90; 96.115; 90
2724Gharpure, Santosh J.; Nanda, Santosh K.; Fartade, Dipak J.
Expeditious diastereoselective synthesis of medium ring heterocycle-fused chromenes via tandem 8/9-endo-dig and 8-exo-dig hydroalkoxylation-formal-[4 + 2] cycloaddition.
Organic & biomolecular chemistry, 2019, 17, 8806-8810
7157089 CIFC32 H29 N O4 SP 1 21 19.2331; 9.4073; 15.2033
90; 91.611; 90
1320.01Gharpure, Santosh J.; Nanda, Santosh K.; Fartade, Dipak J.
Expeditious diastereoselective synthesis of medium ring heterocycle-fused chromenes via tandem 8/9-endo-dig and 8-exo-dig hydroalkoxylation-formal-[4 + 2] cycloaddition.
Organic & biomolecular chemistry, 2019, 17, 8806-8810
7157090 CIFC33 H31 N O5 SP 1 21 19.1034; 9.5264; 15.9591
90; 91.547; 90
1383.51Gharpure, Santosh J.; Nanda, Santosh K.; Fartade, Dipak J.
Expeditious diastereoselective synthesis of medium ring heterocycle-fused chromenes via tandem 8/9-endo-dig and 8-exo-dig hydroalkoxylation-formal-[4 + 2] cycloaddition.
Organic & biomolecular chemistry, 2019, 17, 8806-8810
7157091 CIFC52 H50 N2 O8 S2P 1 21/c 18.3119; 24.2166; 11.0613
90; 93.864; 90
2221.4Gharpure, Santosh J.; Nanda, Santosh K.; Fartade, Dipak J.
Expeditious diastereoselective synthesis of medium ring heterocycle-fused chromenes via tandem 8/9-endo-dig and 8-exo-dig hydroalkoxylation-formal-[4 + 2] cycloaddition.
Organic & biomolecular chemistry, 2019, 17, 8806-8810
7157092 CIFC27 H23 N O5P -16.0337; 12.7989; 15.3967
83.2254; 79.7254; 82.5173
1154.49Kurian, Jais; M, Muraleedharan Kannoth
Synthesis of new cyclazines and 4,5-diaryl-1H-pyrrol-3(2H)-one units in discoipyrroles from indolizinone-DMAD cycloadducts.
Organic & biomolecular chemistry, 2019, 17, 8832-8848
7157093 CIFC36 H34 N2 O4P -111.6409; 11.8981; 12.5461
67.133; 76.352; 89.759
1548.5Kurian, Jais; M, Muraleedharan Kannoth
Synthesis of new cyclazines and 4,5-diaryl-1H-pyrrol-3(2H)-one units in discoipyrroles from indolizinone-DMAD cycloadducts.
Organic & biomolecular chemistry, 2019, 17, 8832-8848
7157094 CIFC24 H29 N O6P 1 21/n 19.932; 12.9438; 18.2127
90; 92.2716; 90
2339.55Kurian, Jais; M, Muraleedharan Kannoth
Synthesis of new cyclazines and 4,5-diaryl-1H-pyrrol-3(2H)-one units in discoipyrroles from indolizinone-DMAD cycloadducts.
Organic & biomolecular chemistry, 2019, 17, 8832-8848
7157095 CIFC35 H22 Cl N O4P -110.0137; 11.9245; 12.3604
80.619; 82.259; 67.699
1343Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157096 CIFC28 H15 Br O3P 1 21/c 116.1126; 14.9541; 8.7949
90; 104.805; 90
2048.8Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157097 CIFC34 H19 Cl O3P -17.6023; 14.1593; 14.3949
112.791; 94.3666; 96.6561
1406.45Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157098 CIFC37 H27 Br N2 O3P -111.5199; 11.9192; 12.6746
109.822; 108.543; 99.91
1473.8Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157099 CIFC34 H19 Br O3P -112.672; 14.322; 15.13
80.53; 89.793; 68.279
2511.3Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157100 CIFC38 H30 N2 O3P -111.465; 11.89; 12.656
110.391; 108.863; 98.617
1461.8Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157101 CIFC32 H18 Br N O2P 1 21/c 112.5801; 29.118; 7.2563
90; 98.229; 90
2630.7Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157102 CIFC35 H22 Br N O4P -19.9903; 12.0129; 12.3878
80.372; 82.962; 68.265
1358.56Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157103 CIFC73 H52 Cl2 N2 O8P -111.4707; 17.0265; 17.1384
68.014; 87.526; 70.835
2919.6Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157104 CIFC34 H18 Cl4 O3P 1 21/n 16.8857; 16.5875; 24.9506
90; 93.9567; 90
2842.98Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157105 CIFC34 H19 Br O3P -114.3618; 16.8874; 19.6152
77.2599; 71.5053; 73.2936
4277.2Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157106 CIFC35 H22 O3P -17.4625; 14.4575; 14.4842
111.262; 99.696; 94.536
1418.71Cao, Jun; Sun, Jing; Yan, Chao-Guo
Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Organic & biomolecular chemistry, 2019, 17, 9008-9013
7157107 CIFC26 H46 B2 O4 Se2 Si2P n a 2144.64; 6.5823; 11.7225
90; 90; 90
3444.5Hasegawa, Masashi; Kobayakawa, Kosuke; Nojima, Yuki; Mazaki, Yasuhiro
Synthesis and chiroptical properties of stereogenic cyclic dimers based on 2,2'-biselenophene and [2.2]paracyclophane.
Organic & biomolecular chemistry, 2019, 17, 8822-8826
7157108 CIFC49 H37 Cl3 Se4P 1 21 19.6143; 16.0071; 13.8424
90; 94.363; 90
2124.1Hasegawa, Masashi; Kobayakawa, Kosuke; Nojima, Yuki; Mazaki, Yasuhiro
Synthesis and chiroptical properties of stereogenic cyclic dimers based on 2,2'-biselenophene and [2.2]paracyclophane.
Organic & biomolecular chemistry, 2019, 17, 8822-8826
7157109 CIFC30 H36 Se2 Si2P 21 21 219.4081; 14.8474; 20.854
90; 90; 90
2913Hasegawa, Masashi; Kobayakawa, Kosuke; Nojima, Yuki; Mazaki, Yasuhiro
Synthesis and chiroptical properties of stereogenic cyclic dimers based on 2,2'-biselenophene and [2.2]paracyclophane.
Organic & biomolecular chemistry, 2019, 17, 8822-8826
7157110 CIFC19 H17 N3 O3P 1 21/c 115.3447; 10.116; 10.7205
90; 109.892; 90
1564.82Su, Yiting; Huang, Gaofeng; Ye, Fu; Qiao, Panpan; Ye, Jinxiang; Gao, Yu; Chen, Haijun
Facile access to evodiakine enabled by aerobic copper-catalyzed oxidative rearrangement.
Organic & biomolecular chemistry, 2019, 17, 8811-8815
7157111 CIFC19 H17 N3 O3P 1 21/c 116.6547; 13.5081; 16.2182
90; 117.968; 90
3222.5Su, Yiting; Huang, Gaofeng; Ye, Fu; Qiao, Panpan; Ye, Jinxiang; Gao, Yu; Chen, Haijun
Facile access to evodiakine enabled by aerobic copper-catalyzed oxidative rearrangement.
Organic & biomolecular chemistry, 2019, 17, 8811-8815
7157112 CIFC35 H36 F2 N4 O4 SP 1 21 111.896; 10.6048; 13.5243
90; 109.984; 90
1603.42Zhou, Yuxuan; Ma, Fanghui; Lu, Ping; Wang, Yanguang
Preparation of spiro[imidazolidine-4,3'-indolin]-2'-imines via copper(i)-catalyzed formal [2 + 2 + 1] cycloaddition of 3-diazoindolin-2-imines and triazines.
Organic & biomolecular chemistry, 2019, 17, 8849-8852
7157113 CIFC10 H8 Br N OP -15.6468; 12.0159; 14.1013
81.991; 89.552; 82.145
938.51Xu, Kang; Yang, Ruiqi; Yang, Shuang; Jiang, Cheng; Ding, Zhenhua
Hypervalent iodane mediated reactions of N-acetyl enamines for the synthesis of oxazoles and imidazoles.
Organic & biomolecular chemistry, 2019, 17, 8977-8981
7157114 CIFC12 H11 Br N2 O2P b c a9.93; 9.524; 24.977
90; 90; 90
2362.2Xu, Kang; Yang, Ruiqi; Yang, Shuang; Jiang, Cheng; Ding, Zhenhua
Hypervalent iodane mediated reactions of N-acetyl enamines for the synthesis of oxazoles and imidazoles.
Organic & biomolecular chemistry, 2019, 17, 8977-8981
7157115 CIFC20 H24 N2 O6 S2P 1 21/c 111.026; 15.703; 12.684
90; 98.83; 90
2170.1Xu, Zhong-Qi; Wang, Wen-Bo; Zheng, Lin-Chuang; Li, Lin; Duan, Lili; Li, Yue-Ming
Iodine-mediated aminosulfonylation of alkenyl sulfonamides with sulfonyl hydrazides: synthesis of sulfonylmethyl piperidines, pyrrolidines and pyrazolines.
Organic & biomolecular chemistry, 2019, 17, 9026-9038
7157116 CIFC24 H23 Cl N2 O4 S2P -110.622; 10.722; 11.698
78.63; 78.84; 67.46
1196.1Xu, Zhong-Qi; Wang, Wen-Bo; Zheng, Lin-Chuang; Li, Lin; Duan, Lili; Li, Yue-Ming
Iodine-mediated aminosulfonylation of alkenyl sulfonamides with sulfonyl hydrazides: synthesis of sulfonylmethyl piperidines, pyrrolidines and pyrazolines.
Organic & biomolecular chemistry, 2019, 17, 9026-9038
7157117 CIFC38 H64 N4 O7P 110.0311; 13.762; 14.965
92.146; 95.34; 97.624
2036.1Veeresh, Kuruva; Singh, Manjeet; Gopi, Hosahudya N.
Impact of substituent effects on the design of β-sheet mimetics and β-double helices from (E)-vinylogous γ-amino acid oligomers.
Organic & biomolecular chemistry, 2019, 17, 9226-9231
7157118 CIFC43 H66 N4 O7P -115.784; 15.892; 21.646
72.44; 76.389; 61.814
4534.9Veeresh, Kuruva; Singh, Manjeet; Gopi, Hosahudya N.
Impact of substituent effects on the design of β-sheet mimetics and β-double helices from (E)-vinylogous γ-amino acid oligomers.
Organic & biomolecular chemistry, 2019, 17, 9226-9231
7157119 CIFC43 H54 N2 O7P 1 21 16.2833; 33.99155; 8.90762
90; 107.114; 90
1818.25Kiełczewska, Urszula; Morzycki, Jacek W.; Rárová, Lucie; Wojtkielewicz, Agnieszka
The synthesis of solasodine F-homo-analogues.
Organic & biomolecular chemistry, 2019, 17, 9050-9058
7157120 CIFC36 H49 N O6 SP 1 21 16.41147; 9.65864; 26.39665
90; 91.6151; 90
1633.99Kiełczewska, Urszula; Morzycki, Jacek W.; Rárová, Lucie; Wojtkielewicz, Agnieszka
The synthesis of solasodine F-homo-analogues.
Organic & biomolecular chemistry, 2019, 17, 9050-9058
7157121 CIFC18 H15 N O3 SP -18.5498; 9.8965; 10.498
86.67; 77.284; 65.193
785.94Ansari, Monish Arbaz; Yadav, Dhananjay; Soni, Sonam; Singh, Maya Shankar
Phosphonium ylide catalysis: a divergent diastereoselective approach to synthesize cyclic ketene acetals [thia(zolidines/zinanes)] from β-ketothioamides and dihaloalkanes.
Organic & biomolecular chemistry, 2019, 17, 9151-9162
7157122 CIFC19 H15 F3 N O SP b c a11.2395; 9.4816; 32.652
90; 90; 90
3479.7Ansari, Monish Arbaz; Yadav, Dhananjay; Soni, Sonam; Singh, Maya Shankar
Phosphonium ylide catalysis: a divergent diastereoselective approach to synthesize cyclic ketene acetals [thia(zolidines/zinanes)] from β-ketothioamides and dihaloalkanes.
Organic & biomolecular chemistry, 2019, 17, 9151-9162
7157123 CIFC28 H21 Cl N4 OP 21 21 217.5705; 11.9923; 27.772
90; 90; 90
2521.4Ji, Yan-Ling; Li, He-Ping; Ai, Yue-Yan; Li, Guo; He, Xiang-Hong; Huang, Wei; Huang, Rui-Zhen; Han, Bo
Enantio- and diastereoselective synthesis of spiropyrazolones via an organocatalytic [1 + 2 + 3] multicomponent reaction.
Organic & biomolecular chemistry, 2019, 17, 9217-9225
7157124 CIFC28 H21 Cl N4 OP 21 21 217.6734; 11.9044; 27.0141
90; 90; 90
2467.7Ji, Yan-Ling; Li, He-Ping; Ai, Yue-Yan; Li, Guo; He, Xiang-Hong; Huang, Wei; Huang, Rui-Zhen; Han, Bo
Enantio- and diastereoselective synthesis of spiropyrazolones via an organocatalytic [1 + 2 + 3] multicomponent reaction.
Organic & biomolecular chemistry, 2019, 17, 9217-9225
7157125 CIFC10 H9 F2 N3 OI 1 2/a 115.8495; 10.2381; 13.1866
90; 104.544; 90
2071.2You, Yi; Chen, Yueji; You, Chenhui; Wang, Junwen; Weng, Zhiqiang
Synthesis of 3-(tri/difluoromethyl)-1H-1,2,4-triazol-5(4H)-ones via the cyclization of hydrazinecarboxamides with tri/difluoroacetic anhydride.
Organic & biomolecular chemistry, 2019, 17, 9343-9347
7157126 CIFC30 H24 F9 N9 O3P -18.042; 10.654; 20.098
84.402; 81.612; 85.682
1692.2You, Yi; Chen, Yueji; You, Chenhui; Wang, Junwen; Weng, Zhiqiang
Synthesis of 3-(tri/difluoromethyl)-1H-1,2,4-triazol-5(4H)-ones via the cyclization of hydrazinecarboxamides with tri/difluoroacetic anhydride.
Organic & biomolecular chemistry, 2019, 17, 9343-9347
7157127 CIFC16 H20 B F Fe O2P 1 21/n 113.17; 7.7111; 15.613
90; 105.44; 90
1528.4Tazi, Mehdi; Erb, William; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence; Low, Paul J.
From ferrocene to fluorine-containing penta-substituted derivatives and all points in-between; or, how to increase the available chemical space.
Organic & biomolecular chemistry, 2019, 17, 9352-9359
7157128 CIFC13 H16 Br F Fe SiP 1 21/c 119.502; 11.7498; 13.23
90; 107.235; 90
2895.5Tazi, Mehdi; Erb, William; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence; Low, Paul J.
From ferrocene to fluorine-containing penta-substituted derivatives and all points in-between; or, how to increase the available chemical space.
Organic & biomolecular chemistry, 2019, 17, 9352-9359
7157129 CIFC22 H21 B F Fe PP b c a12.4583; 14.7599; 20.49
90; 90; 90
3767.8Tazi, Mehdi; Erb, William; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence; Low, Paul J.
From ferrocene to fluorine-containing penta-substituted derivatives and all points in-between; or, how to increase the available chemical space.
Organic & biomolecular chemistry, 2019, 17, 9352-9359

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