Crystallography Open Database
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Searching journal of publication like 'Organic Chemistry Frontiers' volume of publication is 6
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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1554403 | CIF | C14 H18 N2 O S | P -1 | 5.5091; 7.2665; 16.992 80.823; 83.934; 78.863 | 656.9 | Dutta, Soumya; Mondal, Manas; Ghosh, Tubai; Saha, Amit Unprecedented thiocarbamidation of nitroarenes: a facile one-pot route to unsymmetrical thioureas Organic Chemistry Frontiers, 2019, 6, 70 |
1554419 | CIF | C20 H18 | P n a 21 | 15.853; 12.375; 7.3639 90; 90; 90 | 1444.7 | Muthuramalingam, Somasundaram; Garg, Jai Anand; Karthick, R.; Fox, Thomas; Blacque, Olivier; Venkatesan, Koushik; Ramanathan, Saiganesh; Kabilan, Senthamaraikannan; Balasubramanian, K. K. Nickel catalyzed synthesis of 4,4′-bichromenes/4,4′-bithiochromenes and their Atropisomerism Organic Chemistry Frontiers, 2019, 6, 134 |
1554420 | CIF | C20 H14 O4 | P 1 21/c 1 | 8.0844; 19.8817; 10.2123 90; 109.061; 90 | 1551.44 | Muthuramalingam, Somasundaram; Garg, Jai Anand; Karthick, R.; Fox, Thomas; Blacque, Olivier; Venkatesan, Koushik; Ramanathan, Saiganesh; Kabilan, Senthamaraikannan; Balasubramanian, K. K. Nickel catalyzed synthesis of 4,4′-bichromenes/4,4′-bithiochromenes and their Atropisomerism Organic Chemistry Frontiers, 2019, 6, 134 |
1554437 | CIF | C13 H13 N O4 S | P 1 21/c 1 | 9.1009; 17.5658; 8.1862 90; 103.294; 90 | 1273.61 | Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones Organic Chemistry Frontiers, 2019, 6, 183 |
1554438 | CIF | C13 H15 N O5 S | P -1 | 7.2268; 9.0737; 10.4696 80.813; 84.674; 88.958 | 674.8 | Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones Organic Chemistry Frontiers, 2019, 6, 183 |
1554439 | CIF | C13 H19 N O8 S | P -1 | 7.2412; 9.7236; 11.4552 85.64; 87.406; 77.183 | 783.86 | Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones Organic Chemistry Frontiers, 2019, 6, 183 |
1554440 | CIF | C16 H13 N O5 S | P 1 21/n 1 | 6.6266; 18.2993; 11.8645 90; 99.67; 90 | 1418.3 | Kang, On-Yu; Park, Seong Jun; Ahn, Hyojung; Jeong, Kyung Chae; Lim, Hwan Jung Structural assignment of the enol‒keto tautomers of one-pot synthesized 4-hydroxyquinolines/4-quinolones Organic Chemistry Frontiers, 2019, 6, 183 |
1554446 | CIF | C31 H44 N3 P2 Rh | P 1 21/n 1 | 10.9778; 16.148; 17.5888 90; 106.231; 90 | 2993.7 | Zhou, Chunhui; Hu, Jinsong; Wang, Yuan; Yao, Changguang; Chakraborty, Priyanka; Li, Huaifeng; Guan, Chao; Huang, Mei-Hui; Huang, Kuo-Wei Selective carbonylation of benzene to benzaldehyde using a phosphorus‒nitrogen PN3P‒rhodium(i) complex Organic Chemistry Frontiers, 2019, 6, 721 |
1554447 | CIF | C92 H120 N6 O3 P4 Rh2 | C 1 2/c 1 | 29.2408; 13.8295; 25.4214 90; 120.925; 90 | 8818.6 | Zhou, Chunhui; Hu, Jinsong; Wang, Yuan; Yao, Changguang; Chakraborty, Priyanka; Li, Huaifeng; Guan, Chao; Huang, Mei-Hui; Huang, Kuo-Wei Selective carbonylation of benzene to benzaldehyde using a phosphorus‒nitrogen PN3P‒rhodium(i) complex Organic Chemistry Frontiers, 2019, 6, 721 |
1554449 | CIF | C30 H37 I N2 Ru | P -1 | 12.2395; 14.363; 18.399 89.442; 89.312; 88.419 | 3232.9 | Wu, Xuan-Jun; Wang, Hua-Jing; Yang, Zhao-Qi; Tang, Xiao-Sheng; Yuan, Ye; Su, Wei; Chen, Cheng; Verpoort, Francis Efficient and phosphine-free bidentate N-heterocyclic carbene/ruthenium catalytic systems for the dehydrogenative amidation of alcohols and amines Organic Chemistry Frontiers, 2019, 6, 563 |
1554450 | CIF | C27 H31 I N2 Ru | P 1 21/n 1 | 15.329; 7.7727; 21.254 90; 95.269; 90 | 2521.7 | Wu, Xuan-Jun; Wang, Hua-Jing; Yang, Zhao-Qi; Tang, Xiao-Sheng; Yuan, Ye; Su, Wei; Chen, Cheng; Verpoort, Francis Efficient and phosphine-free bidentate N-heterocyclic carbene/ruthenium catalytic systems for the dehydrogenative amidation of alcohols and amines Organic Chemistry Frontiers, 2019, 6, 563 |
1554463 | CIF | C27 H25 N O3 S | P -1 | 8.892; 9.668; 13.91 86.33; 86.29; 67.91 | 1105 | Beltran, Frédéric; Andna, Lucile; Miesch, Laurence Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts Organic Chemistry Frontiers, 2019, 6, 373 |
1554464 | CIF | C22 H25 N O3 S | P -1 | 7.6023; 7.8229; 16.7412 85.307; 84.129; 85.07 | 984.06 | Beltran, Frédéric; Andna, Lucile; Miesch, Laurence Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts Organic Chemistry Frontiers, 2019, 6, 373 |
1554465 | CIF | C28 H27 N O3 S | P 1 21/c 1 | 10.5059; 11.5524; 19.3292 90; 99.812; 90 | 2311.6 | Beltran, Frédéric; Andna, Lucile; Miesch, Laurence Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts Organic Chemistry Frontiers, 2019, 6, 373 |
1554466 | CIF | C25 H29 N O3 S | P 1 21/n 1 | 8.6751; 21.9074; 12.355 90; 107.893; 90 | 2234.5 | Beltran, Frédéric; Andna, Lucile; Miesch, Laurence Spirocyclization of keto-ynesulfonamides promoted by quaternary ammonium salts Organic Chemistry Frontiers, 2019, 6, 373 |
1554485 | CIF | C20 H24 O5 | P 21 21 21 | 6.1036; 12.5506; 21.976 90; 90; 90 | 1683.45 | Yang, Qian; Hu, Kun; Yan, Bing-Chao; Liu, Miao; Li, Xiao-Nian; Sun, Han-Dong; Puno, Pema-Tenzin Maoeriocalysins A‒D, four novel ent-kaurane diterpenoids from Isodon eriocalyx and their structure determination utilizing quantum chemical calculation in conjunction with quantitative interproton distance analysis Organic Chemistry Frontiers, 2019, 6, 45 |
1554489 | CIF | C10 H8 F N3 | P b c a | 7.4865; 11.7277; 20.913 90; 90; 90 | 1836.1 | Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives Organic Chemistry Frontiers, 2019, 6, 426 |
1554490 | CIF | C16 H12 F N5 O2 | P 1 21/c 1 | 8.4745; 13.483; 12.5515 90; 96.566; 90 | 1424.7 | Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives Organic Chemistry Frontiers, 2019, 6, 426 |
1554491 | CIF | C10 H8 F N3 | P 1 21/n 1 | 6.185; 7.487; 18.728 90; 96.138; 90 | 862.3 | Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives Organic Chemistry Frontiers, 2019, 6, 426 |
1554492 | CIF | C70 H56 Ag5 Cl2 N6 P4 | A e a 2 | 27.38; 26.9; 24.03 90; 90; 90 | 17699 | Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives Organic Chemistry Frontiers, 2019, 6, 426 |
1554493 | CIF | C20 H14 N2 | P -1 | 3.9188; 12.5127; 15.3057 101.08; 96.416; 92.665 | 730.13 | Chang, Yu-Che; Prakash, Sekar; Cheng, Chien-Hong ReI-Catalyzed highly regio- and stereoselective C‒H addition to terminal and internal alkynes Organic Chemistry Frontiers, 2019, 6, 432 |
1554494 | CIF | C22 H19 N3 | P 1 21/c 1 | 10.5762; 7.8869; 19.9879 90; 91.535; 90 | 1666.7 | Chang, Yu-Che; Prakash, Sekar; Cheng, Chien-Hong ReI-Catalyzed highly regio- and stereoselective C‒H addition to terminal and internal alkynes Organic Chemistry Frontiers, 2019, 6, 432 |
1554495 | CIF | C25 H20 N4 O2 | P -1 | 9.1577; 10.7173; 13.3021 106.893; 91.497; 91.349 | 1248.12 | Chang, Yu-Che; Prakash, Sekar; Cheng, Chien-Hong ReI-Catalyzed highly regio- and stereoselective C‒H addition to terminal and internal alkynes Organic Chemistry Frontiers, 2019, 6, 432 |
1554496 | CIF | C30 H25 N O3 | P 1 21 1 | 8.5256; 16.9053; 8.9274 90; 112.31; 90 | 1190.37 | Xu, Jianfeng; Peng, Jingyi; He, Chonglong; Ren, Hongjun N-Heterocyclic carbene catalyzed chemo- and enantioselective cross-benzoin reaction of aldehydes with isatins Organic Chemistry Frontiers, 2019, 6, 172 |
1554497 | CIF | C18 H12 Cl3 O P S3 | C 1 2/c 1 | 12.268; 8.6753; 37.965 90; 92.878; 90 | 4035.5 | Lu, Guozhang; Chen, Jun; Huangfu, Xinlei; Li, Xueyan; Fang, Meijuan; Tang, Guo; Zhao, Yufen Visible-light-mediated direct synthesis of phosphorotrithioates as potent anti-inflammatory agents from white phosphorus Organic Chemistry Frontiers, 2019, 6, 190 |
1554498 | CIF | C38 H42 Cl2 O7 | C 1 2 1 | 25.2058; 7.2704; 19.2306 90; 105.306; 90 | 3399.1 | Fan, Jian-Hong; Hu, Ya-Jian; Guo, Qiang; Li, Shaoping; Zhao, Jing; Li, Chuang-Chuang Asymmetric synthesis of the tetracyclic core of bufogargarizin C by an intramolecular [5 + 2] cycloaddition Organic Chemistry Frontiers, 2019, 6, 22 |
1554499 | CIF | C27 H22 N O2 P | P 1 21 1 | 7.8836; 12.2399; 11.1988 90; 90.174; 90 | 1080.62 | Zhang, Dong-Liang; Li, Cheng-Kun; Zeng, Run-Sheng; Shoberu, Adedamola; Zou, Jian-Ping Manganese(iii)-mediated selective phosphorylation of enamides: direct synthesis of β-phosphoryl enamides Organic Chemistry Frontiers, 2019, 6, 236 |
1554500 | CIF | C27 H22 N O2 P | P 1 | 6.0253; 9.0011; 10.3679 75.005; 76.437; 89.09 | 527.4 | Zhang, Dong-Liang; Li, Cheng-Kun; Zeng, Run-Sheng; Shoberu, Adedamola; Zou, Jian-Ping Manganese(iii)-mediated selective phosphorylation of enamides: direct synthesis of β-phosphoryl enamides Organic Chemistry Frontiers, 2019, 6, 236 |
1554501 | CIF | C19 H15 F3 O4 | C 1 2/c 1 | 23.47; 9.9387; 17.2934 90; 123.484; 90 | 3364.4 | Chen, Yueji; You, Yi; Weng, Zhiqiang Syntheses of 2-(2,2,2-trifluoroethylidene)/(2,2-difluoroethyl)-1,3-dicarbonyl compounds and their fungicidal activities Organic Chemistry Frontiers, 2019, 6, 213 |
1554502 | CIF | C17 H12 Br2 F2 O2 | P 1 21/c 1 | 13.7491; 5.8303; 21.42 90; 105.814; 90 | 1652.1 | Chen, Yueji; You, Yi; Weng, Zhiqiang Syntheses of 2-(2,2,2-trifluoroethylidene)/(2,2-difluoroethyl)-1,3-dicarbonyl compounds and their fungicidal activities Organic Chemistry Frontiers, 2019, 6, 213 |
1554503 | CIF | C22 H21 N O5 | P 21 21 2 | 21.2879; 7.5138; 11.5723 90; 90; 90 | 1851.02 | Shoji, Taku; Araki, Takanori; Iida, Nanami; Miura, Kota; Ohta, Akira; Sekiguchi, Ryuta; Ito, Shunji; Okujima, Tetsuo Synthesis of azulenophthalimides by phosphine-mediated annulation of 1,2-diformylazulenes with maleimides Organic Chemistry Frontiers, 2019, 6, 195 |
1554504 | CIF | C68 H68 Cl6 N4 O10 P2 | R -3 :H | 25.2081; 25.2081; 30.11 90; 90; 120 | 16570 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554505 | CIF | C66 H66 I N2 O4 P2 | C 1 2/c 1 | 19.7346; 19.9943; 14.9829 90; 110.36; 90 | 5542.6 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554506 | CIF | C34 H34 Br Cl3 N O2 P | P 1 21/c 1 | 10.967; 15.8648; 20.3172 90; 105.084; 90 | 3413.2 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554507 | CIF | C66 H66 F6 N2 O4 P3 | C 1 2/c 1 | 19.664; 19.9512; 15.5025 90; 111.125; 90 | 5673.2 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554508 | CIF | C66 H66 Cl N2 O7.33 P2 | R -3 :H | 24.8062; 24.8062; 30.0418 90; 90; 120 | 16009.5 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554509 | CIF | C74 H86 F12 N2 O6 P4 | P b c a | 15.5817; 20.6208; 22.0566 90; 90; 90 | 7086.9 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554510 | CIF | C66 H66 N2 O4 P2 | P 1 21/c 1 | 14.2234; 15.5567; 12.5242 90; 108.744; 90 | 2624.2 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554511 | CIF | C66 H66 Br N2 O4 P2 | R -3 :H | 24.7543; 24.7543; 30.0212 90; 90; 120 | 15931.6 | Ng, Chee Koon; Tam, Teck Lip Dexter; Wei, Fengxia; Lu, Xuefeng; Wu, Jishan Anion‒π and anion‒π-radical interactions in bis(triphenylphosphonium)-naphthalene diimide salts Organic Chemistry Frontiers, 2019, 6, 110 |
1554512 | CIF | C12 H17 N S | P 1 21/c 1 | 6.3585; 10.945; 17.5672 90; 92.051; 90 | 1221.78 | Lai, Miao; Wu, Zhiyong; Wang, Yizhi; Zheng, Ying; Zhao, Mingqin Selective synthesis of aryl thioamides and aryl-α-ketoamides from α-oxocarboxylic acids and tetraalkylthiuram disulfides: an unexpected chemoselectivity from aryl sulfonyl chlorides Organic Chemistry Frontiers, 2019, 6, 506 |
1554513 | CIF | C21 H19 Br O3 | P 21 21 21 | 10.687; 12.035; 14.902 90; 90; 90 | 1917 | Huang, Huicai; Lu, Xue; Mao, Yukang; Ye, Jinxing Asymmetric synthesis of highly functionalized furanones via direct Michael reactions mediated by a bulky primary amine Organic Chemistry Frontiers, 2019, 6, 1080 |
1554514 | CIF | C17 H20 O3 | P 21 21 21 | 10.4344; 11.4942; 11.5277 90; 90; 90 | 1382.58 | Xu, Weici; Li, Yuanzhen; Liu, Rui; Yang, Shuang; Liu, Jian; Fang, Xinqiang Kinetic resolution of 2,2-disubstituted-1,3-diketones via carbene catalysis Organic Chemistry Frontiers, 2019, 6, 290 |
1554515 | CIF | C20 H20 O3 | P -1 | 8.431; 8.6965; 11.7742 80.603; 87.055; 65.92 | 777.47 | Xu, Weici; Li, Yuanzhen; Liu, Rui; Yang, Shuang; Liu, Jian; Fang, Xinqiang Kinetic resolution of 2,2-disubstituted-1,3-diketones via carbene catalysis Organic Chemistry Frontiers, 2019, 6, 290 |
1554516 | CIF | C25 H21 F O3 | P 1 21/c 1 | 9.8733; 10.3877; 37.781 90; 96.893; 90 | 3846.8 | Xu, Weici; Li, Yuanzhen; Liu, Rui; Yang, Shuang; Liu, Jian; Fang, Xinqiang Kinetic resolution of 2,2-disubstituted-1,3-diketones via carbene catalysis Organic Chemistry Frontiers, 2019, 6, 290 |
1554517 | CIF | C19 H16 O2 | F d d 2 | 23.63; 42.848; 5.8546 90; 90; 90 | 5927.8 | Fan, Jian; Wang, Shengke; Chen, Jiahui; Wu, Manyi; Zhang, Jitan; Xie, Meihua Synthesis of 2-acetyl trisubstituted furans via copper-mediated deacylation cleavage of unstrained C(sp3)‒C(sp2) bonds Organic Chemistry Frontiers, 2019, 6, 437 |
1554518 | CIF | C20 H18 O3 | P 1 21/c 1 | 10.476; 15.249; 11.317 90; 116.28; 90 | 1621 | Fan, Jian; Wang, Shengke; Chen, Jiahui; Wu, Manyi; Zhang, Jitan; Xie, Meihua Synthesis of 2-acetyl trisubstituted furans via copper-mediated deacylation cleavage of unstrained C(sp3)‒C(sp2) bonds Organic Chemistry Frontiers, 2019, 6, 437 |
1554519 | CIF | C23 H21 N O3 S | I 1 a 1 | 8.3257; 15.1988; 16.3404 90; 95.005; 90 | 2059.8 | Zhu, Tong-Hao; Zhang, Xiao-Chen; Zhao, Kai; Loh, Teck-Peng Cu(OTf)2-mediated C(sp2)‒H arylsulfonylation of enamides via the insertion of sulfur dioxide Organic Chemistry Frontiers, 2019, 6, 94 |
1554520 | CIF | C23 H25 N3 O3 | P 21 21 21 | 11.8106; 12.5767; 26.9924 90; 90; 90 | 4009.4 | Luo, Xiaowei; Chen, Chunmei; Tao, Huaming; Lin, Xiuping; Yang, Bin; Zhou, Xuefeng; Liu, Yonghong Structurally diverse diketopiperazine alkaloids from the marine-derived fungus Aspergillus versicolor SCSIO 41016 Organic Chemistry Frontiers, 2019, 6, 736 |
1554521 | CIF | C20 H23 N2 O3 P | P -1 | 9.115; 9.448; 11.944 101.46; 91.031; 106.62 | 962.9 | Yang, Qiaolan; Wu, Chenglin; Zhou, Jianhui; He, Guoxue; Liu, Hong; Zhou, Yu Highly selective C‒H bond activation of N-arylbenzimidamide and divergent couplings with diazophosphonate compounds: a catalyst-controlled selective synthetic strategy for 3-phosphorylindoles and 4-phosphorylisoquinolines Organic Chemistry Frontiers, 2019, 6, 393 |
1554522 | CIF | C18 H20 N O3 P | P 1 c 1 | 7.6453; 11.642; 9.808 90; 102.969; 90 | 850.7 | Yang, Qiaolan; Wu, Chenglin; Zhou, Jianhui; He, Guoxue; Liu, Hong; Zhou, Yu Highly selective C‒H bond activation of N-arylbenzimidamide and divergent couplings with diazophosphonate compounds: a catalyst-controlled selective synthetic strategy for 3-phosphorylindoles and 4-phosphorylisoquinolines Organic Chemistry Frontiers, 2019, 6, 393 |
1554523 | CIF | C30 H40 N6 O12 | C 1 2/c 1 | 27.337; 6.1593; 20.343 90; 106.22; 90 | 3288.9 | Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water Organic Chemistry Frontiers, 2019, 6, 75 |
1554524 | CIF | C30 H36 N6 O10 | P 1 21/n 1 | 6.8698; 14.4541; 14.7842 90; 95.204; 90 | 1461.97 | Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water Organic Chemistry Frontiers, 2019, 6, 75 |
1554525 | CIF | C26 H38 N6 O9 S2 | P n a 21 | 15.1627; 6.4915; 29.4057 90; 90; 90 | 2894.4 | Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water Organic Chemistry Frontiers, 2019, 6, 75 |
1554526 | CIF | C21 H28 N2 O8 | P 1 21 1 | 11.4833; 7.3773; 13.116 90; 96.533; 90 | 1103.92 | Ma, Qiaoning; Yang, Xiaodi; Lei, Xinsheng; Lin, Guo-Qiang A highly enantioselective synthetic method towards the α2c-adrenoceptor antagonist ORM-10921 Organic Chemistry Frontiers, 2019, 6, 773 |
1554527 | CIF | C32 H34 Br0 Cl N O4 | P 21 21 21 | 6.1903; 13.744; 32.103 90; 90; 90 | 2731.3 | Ma, Qiaoning; Yang, Xiaodi; Lei, Xinsheng; Lin, Guo-Qiang A highly enantioselective synthetic method towards the α2c-adrenoceptor antagonist ORM-10921 Organic Chemistry Frontiers, 2019, 6, 773 |
1554528 | CIF | C5 H4 F N5 O6 | P -1 | 7.976; 8.218; 15.344 94.059; 104.85; 97.364 | 958.5 | Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B. N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design Organic Chemistry Frontiers, 2019, 6, 249 |
1554529 | CIF | C5 H4 F N5 O6 | P 1 21 1 | 5.4659; 10.477; 8.1322 90; 94.857; 90 | 464.03 | Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B. N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design Organic Chemistry Frontiers, 2019, 6, 249 |
1554530 | CIF | C3 H3 F N6 O4 | P n a 21 | 11.4331; 5.7212; 11.2434 90; 90; 90 | 735.44 | Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B. N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design Organic Chemistry Frontiers, 2019, 6, 249 |
1554531 | CIF | C5 H4 F N5 O6 | P b c a | 6.6055; 11.5186; 23.4809 90; 90; 90 | 1786.57 | Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B. N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design Organic Chemistry Frontiers, 2019, 6, 249 |
1554532 | CIF | C19 H15 N O3 | P c a 21 | 14.3845; 4.3448; 23.199 90; 90; 90 | 1449.9 | Wagh, Sachin Bhausaheb; Sharma, Pankaj; Patil, Manoj D.; Liu, Rai-Shung Gold-catalyzed oxidative cycloalkenations of alkynes with quinoline N-oxides Organic Chemistry Frontiers, 2019, 6, 226 |
1554533 | CIF | C19 H15 N O2 | P 1 c 1 | 21.0827; 8.2829; 8.2169 90; 95.222; 90 | 1428.93 | Wagh, Sachin Bhausaheb; Sharma, Pankaj; Patil, Manoj D.; Liu, Rai-Shung Gold-catalyzed oxidative cycloalkenations of alkynes with quinoline N-oxides Organic Chemistry Frontiers, 2019, 6, 226 |
1554534 | CIF | C28 H33 Au Cl O2 P | P -1 | 9.2179; 10.4777; 14.2247 100.062; 92.031; 103.287 | 1312.41 | Wagh, Sachin Bhausaheb; Sharma, Pankaj; Patil, Manoj D.; Liu, Rai-Shung Gold-catalyzed oxidative cycloalkenations of alkynes with quinoline N-oxides Organic Chemistry Frontiers, 2019, 6, 226 |
1554535 | CIF | C33 H32 Cl N O9 | P 21 21 21 | 11.0158; 12.13; 23.587 90; 90; 90 | 3151.7 | Cao, Jian; Liu, Jin-Yu; Zhang, Yi-Ming; Wang, Zhu-Yin; Xu, Peng-Fei Synergistic promotion by intramolecular hydrogen bonding: a bi-functionally catalyzed cascade reaction for the synthesis of enantiopure chromenopyrrolidines Organic Chemistry Frontiers, 2019, 6, 674 |
1554536 | CIF | C20 H15 Br2 N O2 | P c a 21 | 7.0667; 23.0878; 21.9663 90; 90; 90 | 3583.9 | Liu, Zhenhua; Zhu, Guangyu; Gao, Wen; Yang, Lin; Ji, Huimin; Tong, Lili; Tang, Bo Copper-catalyzed regioselective cyclization of vinyl azides by gem-difluoromethylene for trisubstituted pyridines Organic Chemistry Frontiers, 2019, 6, 468 |
1554537 | CIF | C17 H17 Br N4 O | P -1 | 5.2572; 12.458; 13.205 69.94; 83.57; 89.74 | 806.7 | Lemport, Pavel S.; Smolyar, Ivan V.; Khrustalev, Victor N.; Roznyatovsky, Vitaly A.; Popov, Alexander V.; Kobelevskaya, Valentina A.; Rozentsveig, Igor B.; Nenajdenko, Valentine G. 3,3-Diazidoenones ‒ new types of highly reactive bis-azides. Preparation and synthetic transformations Organic Chemistry Frontiers, 2019, 6, 335 |
1554538 | CIF | C27 H21 N2 O P | P 1 21/c 1 | 12.429; 10.415; 37.841 90; 90.13; 90 | 4898.4 | Lemport, Pavel S.; Smolyar, Ivan V.; Khrustalev, Victor N.; Roznyatovsky, Vitaly A.; Popov, Alexander V.; Kobelevskaya, Valentina A.; Rozentsveig, Igor B.; Nenajdenko, Valentine G. 3,3-Diazidoenones ‒ new types of highly reactive bis-azides. Preparation and synthetic transformations Organic Chemistry Frontiers, 2019, 6, 335 |
1554539 | CIF | C34 H44 N2 O Si | P -1 | 8.8134; 10.3559; 18.035 100.993; 95.022; 92.933 | 1605.78 | Chen, Cui-Hong; Chai, Yun; Zhou, Zheng-Xin; Rao, Wei-Hao; Liu, Bin; Liu, Li; Xu, Ran; Liu, Yue-Jin; Zeng, Ming-Hua Room-temperature Pd(ii)-catalyzed direct C‒H TIPS-ethynylation of phenylacetic amides with terminal alkynes Organic Chemistry Frontiers, 2019, 6, 442 |
1554540 | CIF | C35 H30 | P m n 21 | 44.902; 11.1591; 10.6337 90; 90; 90 | 5328.2 | Liu, Peiren; Li, Qi; Zeng, Hong; Shi, Bingbing; Liu, Jiyong; Huang, Feihe [15]Paracyclophane and [16]paracyclophane: facile syntheses, crystal structures and selective complexation with cesium cations in the gas phase Organic Chemistry Frontiers, 2019, 6, 309 |
1554541 | CIF | C42 H36 | P -1 | 11.372; 13.1796; 24.509 105.144; 93.375; 90.36 | 3538.8 | Liu, Peiren; Li, Qi; Zeng, Hong; Shi, Bingbing; Liu, Jiyong; Huang, Feihe [15]Paracyclophane and [16]paracyclophane: facile syntheses, crystal structures and selective complexation with cesium cations in the gas phase Organic Chemistry Frontiers, 2019, 6, 309 |
1554542 | CIF | C42 H54 O6 S2 Se | P -1 | 14.2625; 18.0213; 31.3062 86.466; 83.674; 83.298 | 7933.2 | Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity Organic Chemistry Frontiers, 2019, 6, 263 |
1554543 | CIF | C42 H54 O8 S2 Se | P 1 21/n 1 | 17.4194; 8.2052; 28.3968 90; 90.166; 90 | 4058.73 | Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity Organic Chemistry Frontiers, 2019, 6, 263 |
1554544 | CIF | C42 H54 O6 Se Te2 | P -1 | 12.1441; 16.8305; 20.8669 98.844; 91.448; 102.981 | 4098.7 | Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity Organic Chemistry Frontiers, 2019, 6, 263 |
1554545 | CIF | C42 H54 O6 S Se2 | P -1 | 14.2879; 18.0394; 31.4094 86.414; 83.365; 83.373 | 7977.7 | Wang, Shitao; Shang, Jihai; Yan, Chaoxian; Wang, Wenbo; Yuan, Chengshan; Zhang, Hao-Li; Shao, Xiangfeng Trichalcogenasumanenes containing various chalcogen atoms: synthesis, structure, properties, and chemical reactivity Organic Chemistry Frontiers, 2019, 6, 263 |
1554546 | CIF | C24 H19 Br N2 O | P 1 21/c 1 | 13.0718; 15.5471; 10.5005 90; 113.181; 90 | 1961.7 | Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles Organic Chemistry Frontiers, 2019, 6, 256 |
1554547 | CIF | C24 H19 Cl N2 O | P 1 21/c 1 | 12.9966; 15.5319; 10.522 90; 113.397; 90 | 1949.3 | Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles Organic Chemistry Frontiers, 2019, 6, 256 |
1554548 | CIF | C16 H14 Cl N O2 | P 21 21 21 | 9.5976; 10.3316; 13.9249 90; 90; 90 | 1380.8 | Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles Organic Chemistry Frontiers, 2019, 6, 256 |
1554549 | CIF | C19 H16 N2 O | P -1 | 8.802; 9.9463; 10.213 116.522; 100.853; 103.243 | 734.13 | Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles Organic Chemistry Frontiers, 2019, 6, 256 |
1554550 | CIF | C19 H19 Cl2 N O4 | C 1 2/c 1 | 33.58; 13.96; 8.0737 90; 100.506; 90 | 3721.3 | Liu, Xiong-Li; Yue, Jing; Chen, Shuang; Liu, Huan-Huan; Yang, Kai-Mo; Feng, Ting-Ting; Zhou, Ying Thermal-mediated catalyst-free heterolytic cleavage of 3-halooxindoles: rapid access to 3-functionalized-2-oxindoles Organic Chemistry Frontiers, 2019, 6, 256 |
1554551 | CIF | C13 H22 O2 | P b c a | 11.8513; 8.0917; 24.6768 90; 90; 90 | 2366.4 | He, Min; Yi, Jiuzhou; Zhao, Gaoyuan; Chen, Peiqi; Long, Dan; Hu, Xiaojun; Li, Huilin; Xie, Xingang; Wang, Xiaolei; She, Xuegong A concise approach to the tricyclic framework of longipinane- and ent-longipinane-type sesquiterpenoids Organic Chemistry Frontiers, 2019, 6, 383 |
1554552 | CIF | C25 H24 O5 S | P 1 21 1 | 9.1789; 10.574; 11.4116 90; 91.684; 90 | 1107.11 | Zhang, Nan; He, Tingting; Liu, Yidong; Li, Shan; Tan, Yu; Peng, Lei; Li, Dongmei; Shan, Chunhui; Yan, Hailong Organocatalytic atropo- and E/Z-selective Michael addition reaction of ynones with α-amido sulfones as sulfone-type nucleophile Organic Chemistry Frontiers, 2019, 6, 451 |
1554553 | CIF | C12 H10 F3 N O6 Se | P -1 | 9.809; 9.877; 9.925 66.084; 65.463; 64.347 | 758.1 | Ge, Hangming; Shen, Qilong Trifluoromethyl-substituted selenium ylide: a broadly applicable electrophilic trifluoromethylating reagent Organic Chemistry Frontiers, 2019, 6, 2205 |
1554554 | CIF | C20 H29 N O S | P 1 21 1 | 10.5315; 7.0899; 12.4878 90; 105.29; 90 | 899.43 | Qin, Shuanglin; Liu, Tongtong; Luo, Yunhao; Jiang, Shende; Yang, Guang Diastereoselective Rh-catalyzed decarboxylative allylation to form quaternary stereocenters using sulfinimine as the directing group Organic Chemistry Frontiers, 2019, 6, 732 |
1554555 | CIF | C26 H31 N3 Si | C 1 2/c 1 | 41.982; 8.4505; 16.3226 90; 123.085; 90 | 4851.8 | Wu, Wanqing; Fang, Songjia; Jiang, Guangbin; Li, Meng; Jiang, Huanfeng Palladium-catalyzed regioselective C‒H alkynylation of indoles with bromoalkynes in water Organic Chemistry Frontiers, 2019, 6, 2200 |
1554556 | CIF | C30 H25 N O2 | P 1 21/c 1 | 5.7768; 26.401; 15.2336 90; 95.248; 90 | 2313.6 | Ji, Cheng-Long; Pan, Yao; Geng, Fang-Zhou; Hao, Wen-Juan; Tu, Shu-Jiang; Jiang, Bo Synergistic silver/scandium catalytic spiroketalization of β-alkynyl ketones for the atom economical synthesis of skeletally diverse spirocyclic isochromenes Organic Chemistry Frontiers, 2019, 6, 474 |
1554557 | CIF | C21 H21 N O2 S | C 1 2/c 1 | 31.1655; 8.4946; 13.3472 90; 98.752; 90 | 3492.37 | Wu, Feng; Chen, Lianfen; Wang, Yongdong; Zhu, Shifa Gold-catalyzed generation of azafulvenium from an enyne sulfonamide: rapid access to fully substituted pyrroles Organic Chemistry Frontiers, 2019, 6, 480 |
1554558 | CIF | C21 H18 Br N O3 S | P 1 21/n 1 | 8.6549; 18.21; 11.9124 90; 94.769; 90 | 1870.96 | Wu, Feng; Chen, Lianfen; Wang, Yongdong; Zhu, Shifa Gold-catalyzed generation of azafulvenium from an enyne sulfonamide: rapid access to fully substituted pyrroles Organic Chemistry Frontiers, 2019, 6, 480 |
1554559 | CIF | C28 H36 N2 O2 Si | P -1 | 9.7904; 10.7882; 12.3517 83.891; 69.723; 84.499 | 1214.36 | Kong, De-Shen; Wang, Yi-Fan; Tan, Yun-Xuan; Zhang, Jun-Li; Zhang, Jian-Ge; Tian, Ping; Lin, Guo-Qiang Trisannulation of benzamides and cyclohexadienone-tethered 1,1-disubstituted allenes initiated by Cp*Rh(iii)-catalyzed C‒H activation Organic Chemistry Frontiers, 2019, 6, 699 |
1554560 | CIF | C27 H31 N O4 Si | P -1 | 9.9601; 10.6766; 11.8691 74.393; 85.571; 88.958 | 1211.99 | Kong, De-Shen; Wang, Yi-Fan; Tan, Yun-Xuan; Zhang, Jun-Li; Zhang, Jian-Ge; Tian, Ping; Lin, Guo-Qiang Trisannulation of benzamides and cyclohexadienone-tethered 1,1-disubstituted allenes initiated by Cp*Rh(iii)-catalyzed C‒H activation Organic Chemistry Frontiers, 2019, 6, 699 |
1554561 | CIF | C31 H26 Cl2 N4 O4 S2 | P 1 21/c 1 | 8.24; 10.3859; 17.7438 90; 95.373; 90 | 1511.84 | Han, Shuaijun; Gao, Xianying; Wu, Qingsong; Li, Jingya; Zou, Dapeng; Wu, Yusheng; Wu, Yangjie Nickel-promoted C(2)‒H amidation of quinoline N-oxides with N-fluorobenzenesulfonimide Organic Chemistry Frontiers, 2019, 6, 830 |
1554562 | CIF | C25.5 H28 Cl N4 O2.5 Pd | P n a 21 | 25.795; 9.144; 21.256 90; 90; 90 | 5013.6 | Sun, Wen-Wu; Liu, Ji-Kai; Wu, Bin Practical synthesis of polysubstituted unsymmetric 1,10-phenanthrolines by palladium catalyzed intramolecular oxidative cross coupling of C(sp2)–H and C(sp3)–H bonds of carboxamides Organic Chemistry Frontiers, 2019, 6, 544 |
1554563 | CIF | C18 H11 Br N2 | C 1 2/c 1 | 26.203; 10.644; 30.852 90; 106.633; 90 | 8245 | Sun, Wen-Wu; Liu, Ji-Kai; Wu, Bin Practical synthesis of polysubstituted unsymmetric 1,10-phenanthrolines by palladium catalyzed intramolecular oxidative cross coupling of C(sp2)‒H and C(sp3)‒H bonds of carboxamides Organic Chemistry Frontiers, 2019, 6, 544 |
1554564 | CIF | C16 H18 O2 S | P 1 21 1 | 5.712; 15.28; 8.28 90; 104.192; 90 | 700.6 | Sun, Yongjie; Jiang, Jun; Guo, Xiaochong; Wen, Jialin; Zhang, Xumu Asymmetric hydrogenation of α,β-unsaturated sulfones by a rhodium/thiourea‒bisphosphine complex Organic Chemistry Frontiers, 2019, 6, 1438 |
1554565 | CIF | C32 H27 N O4 S | P 43 21 2 | 13.6813; 13.6813; 29.053 90; 90; 90 | 5438.1 | Chen, Kun-Quan; Gao, Zhong-Hua; Ye, Song Bifunctional N-heterocyclic carbene catalyzed [3 + 4] annulation of enals with azadienes: enantioselective synthesis of benzofuroazepinones Organic Chemistry Frontiers, 2019, 6, 405 |
1554566 | CIF | C33 H29 N O4 S | P 21 21 21 | 11.043; 14.753; 17.258 90; 90; 90 | 2811.6 | Chen, Kun-Quan; Gao, Zhong-Hua; Ye, Song Bifunctional N-heterocyclic carbene catalyzed [3 + 4] annulation of enals with azadienes: enantioselective synthesis of benzofuroazepinones Organic Chemistry Frontiers, 2019, 6, 405 |
1554567 | CIF | C22 H24 O7 | P -1 | 9.1375; 13.1527; 16.354 95.187; 95.294; 103.04 | 1894.04 | Liu, Hongxin; Tan, Haibo; Wang, Wenxuan; Zhang, Wenge; Chen, Yuchan; Li, Saini; Liu, Zhaoming; Li, Haohua; Zhang, Weimin Cytorhizophins A and B, benzophenone-hemiterpene adducts from the endophytic fungus Cytospora rhizophorae Organic Chemistry Frontiers, 2019, 6, 591 |
1554568 | CIF | C18 H17 Cl3 O5 | P 1 2 1 | 13.8718; 9.6965; 13.8978 90; 92.204; 90 | 1867.98 | Liu, Hongxin; Tan, Haibo; Wang, Wenxuan; Zhang, Wenge; Chen, Yuchan; Li, Saini; Liu, Zhaoming; Li, Haohua; Zhang, Weimin Cytorhizophins A and B, benzophenone-hemiterpene adducts from the endophytic fungus Cytospora rhizophorae Organic Chemistry Frontiers, 2019, 6, 591 |
1554569 | CIF | C172 H203 N13 O10 P2 | C 1 2/c 1 | 21.469; 29.096; 28.543 90; 95.17; 90 | 17757 | Lee, Chaeeun; Lee, Hyemi; Lee, Seungwon; Jeon, Hae-Geun; Jeong, Kyu-Sung Encapsulation of dihydrogenphosphate ions as a cyclic dimer to the cavities of site-specifically modified indolocarbazole-pyridine foldamers Organic Chemistry Frontiers, 2019, 6, 299 |
1554570 | CIF | C173 H203 N13 O10 P2 | C 1 2/c 1 | 21.505; 29.114; 28.751 90; 94.83; 90 | 17937 | Lee, Chaeeun; Lee, Hyemi; Lee, Seungwon; Jeon, Hae-Geun; Jeong, Kyu-Sung Encapsulation of dihydrogenphosphate ions as a cyclic dimer to the cavities of site-specifically modified indolocarbazole-pyridine foldamers Organic Chemistry Frontiers, 2019, 6, 299 |
1554571 | CIF | C12 H12 N2 O2 S | P 1 21/c 1 | 8.968; 9.084; 14.804 90; 105.357; 90 | 1163 | Zu, Weisai; Liu, Shuai; Jia, Xin; Xu, Liang Chemoselective N-arylation of aminobenzene sulfonamides via copper catalysed Chan‒Evans‒Lam reactions Organic Chemistry Frontiers, 2019, 6, 1356 |
1554572 | CIF | C19 H15 N O2 S | P 1 21 1 | 8.0275; 8.0254; 12.699 90; 101.787; 90 | 800.9 | Zhao, Zi-Biao; Shi, Lei; Meng, Fan-Jie; Li, Yaming; Zhou, Yong-Gui Synthesis of chiral seven-membered cyclic sulfonamides through palladium-catalyzed arylation of cyclic imines Organic Chemistry Frontiers, 2019, 6, 1572 |
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