Crystallography Open Database

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Searching journal of publication like 'The Journal of organic chemistry' volume of publication is 81

COD ID: 4031762
CIF file Formula: - C31 H27 N3 O3 -
Comments: Dai, Wei; Jiang, Xiao-Li; Tao, Ji-Yu; Shi, Feng Application of 3-Methyl-2-vinylindoles in Catalytic Asymmetric Povarov Reaction: Diastereo- and Enantioselective Synthesis of Indole-Derived Tetrahydroquinolines. The Journal of organic chemistry 81(1) (2016) 185-192
Space group: P 1 21 1
Cell volume: 1220.93
Cell parameters: 6.5466; 9.2228; 20.4337; 90; 98.265; 90;  

COD ID: 4031763
CIF file Formula: - C33 H30 Br N O4 S -
Comments: Tanimoto, Hiroki; Yokoyama, Keiichi; Mizutani, Yusuke; Shitaoka, Takashi; Morimoto, Tsumoru; Nishiyama, Yasuhiro; Kakiuchi, Kiyomi Synthesis of α-Substituted Enoximes with Nucleophiles via Nitrosoallenes. The Journal of organic chemistry 81(2) (2016) 559-574
Space group: P -1
Cell volume: 1438.41
Cell parameters: 7.65835; 7.90588; 24.3938; 88.9061; 82.0333; 79.5504;  

COD ID: 4031764
CIF file Formula: - C27 H29 N O3 S -
Comments: Tanimoto, Hiroki; Yokoyama, Keiichi; Mizutani, Yusuke; Shitaoka, Takashi; Morimoto, Tsumoru; Nishiyama, Yasuhiro; Kakiuchi, Kiyomi Synthesis of α-Substituted Enoximes with Nucleophiles via Nitrosoallenes. The Journal of organic chemistry 81(2) (2016) 559-574
Space group: C 1 2/c 1
Cell volume: 4767.52
Cell parameters: 19.0086; 8.50881; 30.3715; 90; 103.946; 90;  

COD ID: 4031765
CIF file Formula: - C19 H20 N2 O -
Comments: Tanimoto, Hiroki; Yokoyama, Keiichi; Mizutani, Yusuke; Shitaoka, Takashi; Morimoto, Tsumoru; Nishiyama, Yasuhiro; Kakiuchi, Kiyomi Synthesis of α-Substituted Enoximes with Nucleophiles via Nitrosoallenes. The Journal of organic chemistry 81(2) (2016) 559-574
Space group: P 1 21 1
Cell volume: 1626.42
Cell parameters: 12.2761; 7.87636; 16.8396; 90; 92.7067; 90;  

COD ID: 4031766
CIF file Formula: - C19 H20 N2 O3 -
Comments: Tanimoto, Hiroki; Yokoyama, Keiichi; Mizutani, Yusuke; Shitaoka, Takashi; Morimoto, Tsumoru; Nishiyama, Yasuhiro; Kakiuchi, Kiyomi Synthesis of α-Substituted Enoximes with Nucleophiles via Nitrosoallenes. The Journal of organic chemistry 81(2) (2016) 559-574
Space group: P -1
Cell volume: 856.1
Cell parameters: 8.6333; 8.8406; 12.4265; 96.9079; 105.026; 106.985;  

COD ID: 4031767
CIF file Formula: - C26 H27 N O3 S -
Comments: Tanimoto, Hiroki; Yokoyama, Keiichi; Mizutani, Yusuke; Shitaoka, Takashi; Morimoto, Tsumoru; Nishiyama, Yasuhiro; Kakiuchi, Kiyomi Synthesis of α-Substituted Enoximes with Nucleophiles via Nitrosoallenes. The Journal of organic chemistry 81(2) (2016) 559-574
Space group: P 1 21/n 1
Cell volume: 2171.01
Cell parameters: 12.393; 11.2794; 15.7786; 90; 100.164; 90;  

COD ID: 4031768
CIF file Formula: - C74 H50 B F20 N2 O4 -
Comments: Kurata, Ryohei; Tanaka, Kazuyoshi; Ito, Akihiro Isolation and Characterization of Persistent Radical Cation and Dication of 2,7-Bis(dianisylamino)pyrene. The Journal of organic chemistry 81(1) (2016) 137-145
Space group: P -1
Cell volume: 3691.9
Cell parameters: 14.7965; 15.5327; 16.1201; 92.062; 93.177; 92.837;  

COD ID: 4031769
CIF file Formula: - C44 H36 N2 O4 -
Comments: Kurata, Ryohei; Tanaka, Kazuyoshi; Ito, Akihiro Isolation and Characterization of Persistent Radical Cation and Dication of 2,7-Bis(dianisylamino)pyrene. The Journal of organic chemistry 81(1) (2016) 137-145
Space group: P 1 21/c 1
Cell volume: 1647.19
Cell parameters: 10.5157; 10.6941; 15.312; 90; 106.942; 90;  

COD ID: 4031770
CIF file Formula: - C101 H57 B2 F40 N2 O4 -
Comments: Kurata, Ryohei; Tanaka, Kazuyoshi; Ito, Akihiro Isolation and Characterization of Persistent Radical Cation and Dication of 2,7-Bis(dianisylamino)pyrene. The Journal of organic chemistry 81(1) (2016) 137-145
Space group: P b c a
Cell volume: 18305
Cell parameters: 22.6937; 25.4639; 31.677; 90; 90; 90;  

COD ID: 4031771
CIF file Formula: - C19 H16 Br2 N2 O3 S -
Comments: Cheng, Yi An; Yu, Wesley Zongrong; Yeung, Ying-Yeung An unexpected Bromolactamization of Olefinic Amides Using a Three-Component Co-catalyst System. The Journal of organic chemistry 81(2) (2016) 545-552
Space group: P 1 21 1
Cell volume: 943.88
Cell parameters: 8.912; 5.8904; 18.4113; 90; 102.422; 90;  

COD ID: 4031772
CIF file Formula: - C17 H16 Br N O3 S -
Comments: Cheng, Yi An; Yu, Wesley Zongrong; Yeung, Ying-Yeung An unexpected Bromolactamization of Olefinic Amides Using a Three-Component Co-catalyst System. The Journal of organic chemistry 81(2) (2016) 545-552
Space group: P 1 21/n 1
Cell volume: 1689.8
Cell parameters: 16.66; 6.124; 17.274; 90; 106.504; 90;  

COD ID: 4031809
CIF file Formula: - C16 H16 N2 O5 -
Comments: Das, Debapratim; Biswas, Aniruddha; Karmakar, Ujjwal; Chand, Santanu; Samanta, Rajarshi C6-Selective Direct Alkylation of Pyridones with Diazo Compounds under Rh(III)-Catalyzed Mild Conditions. The Journal of organic chemistry 81(3) (2016) 842-848
Space group: P -1
Cell volume: 756.4
Cell parameters: 8.008; 9.026; 10.852; 94.666; 99.028; 100.641;  

COD ID: 4031810
CIF file Formula: - C21 H18 N2 O4 -
Comments: Das, Debapratim; Biswas, Aniruddha; Karmakar, Ujjwal; Chand, Santanu; Samanta, Rajarshi C6-Selective Direct Alkylation of Pyridones with Diazo Compounds under Rh(III)-Catalyzed Mild Conditions. The Journal of organic chemistry 81(3) (2016) 842-848
Space group: P 1 21/n 1
Cell volume: 1745.9
Cell parameters: 10.977; 9.936; 16.271; 90; 100.318; 90;  

COD ID: 4031811
CIF file Formula: - C19 H17 N O3 -
Comments: Xia, Xiao-Feng; Zhu, Su-Li; Chen, Chao; Wang, Haijun; Liang, Yong-Min Silver-Catalyzed Decarboxylative Addition/Cyclization of Activated Alkenes with Aliphatic Carboxylic Acids. The Journal of organic chemistry 81(3) (2016) 1277-1284
Space group: P 1 21/c 1
Cell volume: 1593
Cell parameters: 12.8653; 9.0875; 15.0355; 90; 115.014; 90;  

COD ID: 4031812
CIF file Formula: - C25 H34 O4 Si -
Comments: Shi, Hang; Tan, Ceheng; Zhang, Weibin; Zhang, Zichun; Long, Rong; Gong, Jianxian; Luo, Tuoping; Yang, Zhen Gold-Catalyzed Enantio- and Diastereoselective Syntheses of Left Fragments of Azadirachtin/Meliacarpin-Type Limonoids. The Journal of organic chemistry 81(3) (2016) 751-771
Space group: P 1 21 1
Cell volume: 1187.04
Cell parameters: 11.2623; 8.9195; 12.9754; 90; 114.397; 90;  

COD ID: 4031813
CIF file Formula: - C30 H50 O4 Si2 -
Comments: Shi, Hang; Tan, Ceheng; Zhang, Weibin; Zhang, Zichun; Long, Rong; Gong, Jianxian; Luo, Tuoping; Yang, Zhen Gold-Catalyzed Enantio- and Diastereoselective Syntheses of Left Fragments of Azadirachtin/Meliacarpin-Type Limonoids. The Journal of organic chemistry 81(3) (2016) 751-771
Space group: P 1 21/n 1
Cell volume: 3123
Cell parameters: 7.7056; 31.3414; 12.9403; 90; 92.142; 90;  

COD ID: 4031814
CIF file Formula: - C28 H44 O4 Si2 -
Comments: Shi, Hang; Tan, Ceheng; Zhang, Weibin; Zhang, Zichun; Long, Rong; Gong, Jianxian; Luo, Tuoping; Yang, Zhen Gold-Catalyzed Enantio- and Diastereoselective Syntheses of Left Fragments of Azadirachtin/Meliacarpin-Type Limonoids. The Journal of organic chemistry 81(3) (2016) 751-771
Space group: P 21 21 21
Cell volume: 2781.4
Cell parameters: 7.702; 13.1321; 27.4999; 90; 90; 90;  

COD ID: 4031815
CIF file Formula: - C25 H34 O5 -
Comments: Shi, Hang; Tan, Ceheng; Zhang, Weibin; Zhang, Zichun; Long, Rong; Gong, Jianxian; Luo, Tuoping; Yang, Zhen Gold-Catalyzed Enantio- and Diastereoselective Syntheses of Left Fragments of Azadirachtin/Meliacarpin-Type Limonoids. The Journal of organic chemistry 81(3) (2016) 751-771
Space group: P -1
Cell volume: 1101.97
Cell parameters: 9.3611; 10.4294; 12.5882; 91.067; 109.523; 106.48;  

COD ID: 4031816
CIF file Formula: - C23 H36 O4 Si -
Comments: Shi, Hang; Tan, Ceheng; Zhang, Weibin; Zhang, Zichun; Long, Rong; Gong, Jianxian; Luo, Tuoping; Yang, Zhen Gold-Catalyzed Enantio- and Diastereoselective Syntheses of Left Fragments of Azadirachtin/Meliacarpin-Type Limonoids. The Journal of organic chemistry 81(3) (2016) 751-771
Space group: P 21 21 21
Cell volume: 2421
Cell parameters: 7.7133; 12.5483; 25.0132; 90; 90; 90;  

COD ID: 4031817
CIF file Formula: - C40 H46 Cl4 N4 O0.5 Si2 -
Comments: Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 81(3) (2016) 1198-1205
Space group: P -1
Cell volume: 2097.7
Cell parameters: 10.07; 12.3582; 17.963; 96.914; 102.292; 102.701;  

COD ID: 4031818
CIF file Formula: - C40 H46 Br4 N4 O0.5 Si2 -
Comments: Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 81(3) (2016) 1198-1205
Space group: P -1
Cell volume: 2168.4
Cell parameters: 10.281; 12.582; 17.968; 96.233; 103.75; 102.897;  

COD ID: 4031819
CIF file Formula: - C40 H48.46 Cl4 N4 O0.23 Si2 -
Comments: Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 81(3) (2016) 1198-1205
Space group: P -1
Cell volume: 2112.5
Cell parameters: 10.1041; 12.3922; 17.938; 97.224; 102.464; 101.81;  

COD ID: 4031820
CIF file Formula: - C40 H48 Br4 N4 Si2 -
Comments: Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 81(3) (2016) 1198-1205
Space group: P -1
Cell volume: 1082.1
Cell parameters: 7.2; 8.974; 17.429; 81.59; 82.046; 77.789;  

COD ID: 4031821
CIF file Formula: - C41 H49 Cl7 N4 Si2 -
Comments: Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 81(3) (2016) 1198-1205
Space group: P -1
Cell volume: 2253.1
Cell parameters: 8.777; 8.817; 29.942; 88.066; 87.812; 76.754;  

COD ID: 4031822
CIF file Formula: - C40 H46 Cl4 N4 Si2 -
Comments: Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 81(3) (2016) 1198-1205
Space group: P -1
Cell volume: 2034
Cell parameters: 8.6568; 14.0971; 17.111; 77.906; 85.32; 87.277;  

COD ID: 4031823
CIF file Formula: - C26 H22 O5 -
Comments: Yuan, Xiao; Lin, Lili; Chen, Weiliang; Wu, Wangbin; Liu, Xiaohua; Feng, Xiaoming Synthesis of Chiral Tetrahydrofurans via Catalytic Asymmetric [3 + 2] Cycloaddition of Heterosubstituted Alkenes with Oxiranes. The Journal of organic chemistry 81(3) (2016) 1237-1243
Space group: P 32
Cell volume: 1610.97
Cell parameters: 10.2142; 10.2142; 17.8299; 90; 90; 120;  

COD ID: 4031824
CIF file Formula: - C91 H104 N34 O11 -
Comments: Helzy, Fatima; Maris, Thierry; Wuest, James D. Engineering Hydrogen-Bonded Hexagonal Networks Built from Flexible 1,3,5-Trisubstituted Derivatives of Benzene. The Journal of organic chemistry 81(8) (2016) 3076-3086
Space group: P -1
Cell volume: 4525.2
Cell parameters: 12.6738; 19.3375; 20.0114; 88.963; 72.912; 75.267;  

COD ID: 4031825
CIF file Formula: - C39 H39 N15 O3 -
Comments: Helzy, Fatima; Maris, Thierry; Wuest, James D. Engineering Hydrogen-Bonded Hexagonal Networks Built from Flexible 1,3,5-Trisubstituted Derivatives of Benzene. The Journal of organic chemistry 81(8) (2016) 3076-3086
Space group: P c a 21
Cell volume: 11760.4
Cell parameters: 28.7618; 11.6367; 35.138; 90; 90; 90;  

COD ID: 4031826
CIF file Formula: - C42 H45 N15 O3 -
Comments: Helzy, Fatima; Maris, Thierry; Wuest, James D. Engineering Hydrogen-Bonded Hexagonal Networks Built from Flexible 1,3,5-Trisubstituted Derivatives of Benzene. The Journal of organic chemistry 81(8) (2016) 3076-3086
Space group: P -1
Cell volume: 3283.4
Cell parameters: 12.4986; 14.7043; 20.3073; 70.131; 74.396; 72.114;  

COD ID: 4031827
CIF file Formula: - C42 H45 N15 O3 -
Comments: Helzy, Fatima; Maris, Thierry; Wuest, James D. Engineering Hydrogen-Bonded Hexagonal Networks Built from Flexible 1,3,5-Trisubstituted Derivatives of Benzene. The Journal of organic chemistry 81(8) (2016) 3076-3086
Space group: P 1 21/n 1
Cell volume: 8394
Cell parameters: 29.665; 9.049; 31.666; 90; 99.09; 90;  

COD ID: 4031828
CIF file Formula: - C38 H30 Br N3 O S2 -
Comments: Bodedla, Govardhana Babu; Justin Thomas, K. R.; Fan, Miao-Syuan; Ho, Kuo-Chuan Benzimidazole-Branched Isomeric Dyes: Effect of Molecular Constitution on Photophysical, Electrochemical, and Photovoltaic Properties. The Journal of organic chemistry 81(2) (2016) 640-653
Space group: P -1
Cell volume: 1665.77
Cell parameters: 10.0416; 12.3341; 14.3639; 99.687; 97.512; 104.946;  

COD ID: 4031829
CIF file Formula: - C22 H22 N4 S3 Si2 -
Comments: Zhang, Junxiang; Parker, Timothy C.; Chen, Wayne; Williams, LaRita; Khrustalev, Victor N.; Jucov, Evgheni V.; Barlow, Stephen; Timofeeva, Tatiana V.; Marder, Seth R. C-H-Activated Direct Arylation of Strong Benzothiadiazole and Quinoxaline-Based Electron Acceptors. The Journal of organic chemistry 81(2) (2016) 360-370
Space group: P -1
Cell volume: 1203.9
Cell parameters: 7.123; 10.302; 17.193; 88.54; 79.136; 76.363;  

COD ID: 4031830
CIF file Formula: - C18 H10 N4 S3 -
Comments: Zhang, Junxiang; Parker, Timothy C.; Chen, Wayne; Williams, LaRita; Khrustalev, Victor N.; Jucov, Evgheni V.; Barlow, Stephen; Timofeeva, Tatiana V.; Marder, Seth R. C-H-Activated Direct Arylation of Strong Benzothiadiazole and Quinoxaline-Based Electron Acceptors. The Journal of organic chemistry 81(2) (2016) 360-370
Space group: P m n 21
Cell volume: 1654.9
Cell parameters: 20.099; 11.717; 7.027; 90; 90; 90;  

COD ID: 4031831
CIF file Formula: - C33 H29 Br F I N2 O4 -
Comments: Limanto, John; Yoshikawa, Naoki; Reamer, Robert A.; Tan, Lushi; Brunskill, Andrew; Reibarkh, Mikhail Promotion of a Ti-Mediated Mannich Reaction by a Proton Source. The Journal of organic chemistry 81(2) (2016) 723-728
Space group: P 1 21 1
Cell volume: 6006.2
Cell parameters: 30.3461; 5.8463; 34.0783; 90; 96.57; 90;  

COD ID: 4031832
CIF file Formula: - C39 H46 F I N2 O5 Si2 -
Comments: Limanto, John; Yoshikawa, Naoki; Reamer, Robert A.; Tan, Lushi; Brunskill, Andrew; Reibarkh, Mikhail Promotion of a Ti-Mediated Mannich Reaction by a Proton Source. The Journal of organic chemistry 81(2) (2016) 723-728
Space group: P 1
Cell volume: 1986.56
Cell parameters: 5.7152; 15.4683; 22.7213; 81.5151; 89.504; 89.5445;  

COD ID: 4031833
CIF file Formula: - C34 H28 O9 -
Comments: Lu, Tai-Ni; Chang, Che-Chien Synthesis of 3-Deoxy-l-ketohexoses through Group Transfer. The Journal of organic chemistry 81(2) (2016) 469-475
Space group: P 1 21 1
Cell volume: 2849.4
Cell parameters: 5.4629; 48.1; 10.9336; 90; 97.337; 90;  

COD ID: 4031834
CIF file Formula: - C13 H11 N3 O2 -
Comments: Han, Su Jin; Kim, Hyun Tae; Joo, Jung Min Direct C-H Alkenylation of Functionalized Pyrazoles. The Journal of organic chemistry 81(2) (2016) 689-698
Space group: P 1 21/n 1
Cell volume: 1138.98
Cell parameters: 6.5358; 15.1093; 11.5347; 90; 90.698; 90;  

COD ID: 4031835
CIF file Formula: - C14 H13 N3 O2 -
Comments: Han, Su Jin; Kim, Hyun Tae; Joo, Jung Min Direct C-H Alkenylation of Functionalized Pyrazoles. The Journal of organic chemistry 81(2) (2016) 689-698
Space group: P -1
Cell volume: 1238.61
Cell parameters: 6.8771; 12.2722; 15.4408; 73.338; 84.595; 83.906;  

COD ID: 4031836
CIF file Formula: - C48 H51 O10 -
Comments: Li, Xia; Han, Jianguang; Jones, Alexander X.; Lei, Xiaoguang Chiral Boron Complex-Promoted Asymmetric Diels-Alder Cycloaddition and Its Application in Natural Product Synthesis. The Journal of organic chemistry 81(2) (2016) 458-468
Space group: C 1 2/c 1
Cell volume: 8998.3
Cell parameters: 31.426; 13.9013; 21.3552; 90; 105.307; 90;  

COD ID: 4031837
CIF file Formula: - C24 F16 S8 -
Comments: Skowron, Pierre-Thomas; Dumartin, Melissa; Jeamet, Emeric; Perret, Florent; Gourlaouen, Christophe; Baudouin, Anne; Fenet, Bernard; Naubron, Jean-Valère; Fotiadu, Frédéric; Vial, Laurent; Leclaire, Julien On-Demand Cyclophanes: Substituent-Directed Self-Assembling, Folding, and Binding. The Journal of organic chemistry 81(2) (2016) 654-661
Space group: P -4 21 c
Cell volume: 2903.4
Cell parameters: 13.2491; 13.2491; 16.54; 90; 90; 90;  

COD ID: 4031838
CIF file Formula: - C68 H93 B5 Cl4 O10 -
Comments: Ikemoto, Koki; Yoshii, Asami; Izumi, Tomoo; Taka, Hideo; Kita, Hiroshi; Xue, Jing Yang; Kobayashi, Ryo; Sato, Sota; Isobe, Hiroyuki Modular Synthesis of Aromatic Hydrocarbon Macrocycles for Simplified, Single-Layer Organic Light-Emitting Devices. The Journal of organic chemistry 81(2) (2016) 662-666
Space group: P 1 21/n 1
Cell volume: 7461
Cell parameters: 15.219; 26.621; 18.6197; 90; 98.516; 90;  

COD ID: 4031839
CIF file Formula: - C65 H50 -
Comments: Ikemoto, Koki; Yoshii, Asami; Izumi, Tomoo; Taka, Hideo; Kita, Hiroshi; Xue, Jing Yang; Kobayashi, Ryo; Sato, Sota; Isobe, Hiroyuki Modular Synthesis of Aromatic Hydrocarbon Macrocycles for Simplified, Single-Layer Organic Light-Emitting Devices. The Journal of organic chemistry 81(2) (2016) 662-666
Space group: P 1 21/n 1
Cell volume: 4555
Cell parameters: 16.328; 17.144; 18.08; 90; 115.848; 90;  

COD ID: 4031840
CIF file Formula: - C141.75 H124.5 Cl2.5 O0.5 -
Comments: Ikemoto, Koki; Yoshii, Asami; Izumi, Tomoo; Taka, Hideo; Kita, Hiroshi; Xue, Jing Yang; Kobayashi, Ryo; Sato, Sota; Isobe, Hiroyuki Modular Synthesis of Aromatic Hydrocarbon Macrocycles for Simplified, Single-Layer Organic Light-Emitting Devices. The Journal of organic chemistry 81(2) (2016) 662-666
Space group: P c c n
Cell volume: 21618
Cell parameters: 48.644; 13.8778; 32.023; 90; 90; 90;  

COD ID: 4031841
CIF file Formula: - C79.41 H61.41 Cl4.22 -
Comments: Ikemoto, Koki; Yoshii, Asami; Izumi, Tomoo; Taka, Hideo; Kita, Hiroshi; Xue, Jing Yang; Kobayashi, Ryo; Sato, Sota; Isobe, Hiroyuki Modular Synthesis of Aromatic Hydrocarbon Macrocycles for Simplified, Single-Layer Organic Light-Emitting Devices. The Journal of organic chemistry 81(2) (2016) 662-666
Space group: P -1
Cell volume: 3101.4
Cell parameters: 14.1754; 14.9606; 16.7799; 82.903; 68.783; 69.216;  

COD ID: 4031842
CIF file Formula: - C86.5 H74.5 Cl7.5 -
Comments: Ikemoto, Koki; Yoshii, Asami; Izumi, Tomoo; Taka, Hideo; Kita, Hiroshi; Xue, Jing Yang; Kobayashi, Ryo; Sato, Sota; Isobe, Hiroyuki Modular Synthesis of Aromatic Hydrocarbon Macrocycles for Simplified, Single-Layer Organic Light-Emitting Devices. The Journal of organic chemistry 81(2) (2016) 662-666
Space group: C 1 2/c 1
Cell volume: 14614
Cell parameters: 64.223; 7.8923; 32.435; 90; 117.265; 90;  

COD ID: 4031843
CIF file Formula: - C50 H42 N2 O4 -
Comments: Schmidt, Hauke C.; Spulber, Mariana; Neuburger, Markus; Palivan, Cornelia G.; Meuwly, Markus; Wenger, Oliver S. Charge Transfer Pathways in Three Isomers of Naphthalene-Bridged Organic Mixed Valence Compounds. The Journal of organic chemistry 81(2) (2016) 595-602
Space group: F d d 2
Cell volume: 7556.6
Cell parameters: 15.6972; 37.1771; 12.9487; 90; 90; 90;  

COD ID: 4031844
CIF file Formula: - C23 H12 F3 N O2 S2 -
Comments: Nishida, Jun-Ichi; Ohura, Hokuto; Kita, Yasuyuki; Hasegawa, Hiroyuki; Kawase, Takeshi; Takada, Noriyuki; Sato, Hiroyasu; Sei, Yoshihisa; Yamashita, Yoshiro Phthalimide Compounds Containing a Trifluoromethylphenyl Group and Electron-Donating Aryl Groups: Color-Tuning and Enhancement of Triboluminescence. The Journal of organic chemistry 81(2) (2016) 433-441
Space group: P 1 n 1
Cell volume: 1901.43
Cell parameters: 5.7685; 7.7643; 42.4758; 90; 91.849; 90;  

COD ID: 4031845
CIF file Formula: - C25 H14 F3 N O2 -
Comments: Nishida, Jun-Ichi; Ohura, Hokuto; Kita, Yasuyuki; Hasegawa, Hiroyuki; Kawase, Takeshi; Takada, Noriyuki; Sato, Hiroyasu; Sei, Yoshihisa; Yamashita, Yoshiro Phthalimide Compounds Containing a Trifluoromethylphenyl Group and Electron-Donating Aryl Groups: Color-Tuning and Enhancement of Triboluminescence. The Journal of organic chemistry 81(2) (2016) 433-441
Space group: P 1 c 1
Cell volume: 1816.78
Cell parameters: 5.90211; 7.66146; 40.2458; 90; 93.335; 90;  

COD ID: 4031846
CIF file Formula: - C8 H12 Cl N3 S3 -
Comments: Koyioni, Maria; Manoli, Maria; Koutentis, Panayiotis A. The Reaction of DABCO with 4-Chloro-5H-1,2,3-dithiazoles: Synthesis and Chemistry of 4-[N-(2-Chloroethyl)piperazin-1-yl]-5H-1,2,3-dithiazoles. The Journal of organic chemistry 81(2) (2016) 615-631
Space group: P 1 21/n 1
Cell volume: 1166.52
Cell parameters: 11.0496; 7.8673; 13.8104; 90; 103.673; 90;  

COD ID: 4031847
CIF file Formula: - C33 H31 Br I N3 O8 -
Comments: Sokolovs, Igors; Suna, Edgars Para-Selective Cu-Catalyzed C-H Aryloxylation of Electron-Rich Arenes and Heteroarenes. The Journal of organic chemistry 81(2) (2016) 371-379
Space group: P -1
Cell volume: 1640.49
Cell parameters: 8.7052; 12.2035; 16.0777; 75.2788; 88.3395; 83.2541;  

COD ID: 4031848
CIF file Formula: - C18 H14 N4 O2 S -
Comments: Xie, Wucheng; Li, Bin; Wang, Baiquan Rh(III)-Catalyzed C7-Thiolation and Selenation of Indolines. The Journal of organic chemistry 81(2) (2016) 396-403
Space group: P -1
Cell volume: 804.5
Cell parameters: 7.6059; 8.2702; 13.411; 92.066; 102.639; 101.285;  

COD ID: 4031849
CIF file Formula: - C21 H19 N O2 -
Comments: Wang, Xing; Chen, Rui-Xi; Wei, Zeng-Feng; Zhang, Chen-Yang; Tu, Hai-Yang; Zhang, Ai-Dong Chemoselective Transformation of Diarylethanones to Arylmethanoic Acids and Diarylmethanones and Mechanistic Insights. The Journal of organic chemistry 81(1) (2016) 238-249
Space group: P 1 21/c 1
Cell volume: 1672.8
Cell parameters: 13.406; 11.18; 11.221; 90; 95.914; 90;  

COD ID: 4031850
CIF file Formula: - C21 H14 N2 S -
Comments: Sun, Zuo-Bang; Guo, Man; Zhao, Cui-Hua Synthesis and Properties of Benzothieno[b]-Fused BODIPY Dyes. The Journal of organic chemistry 81(1) (2016) 229-237
Space group: P -1
Cell volume: 799
Cell parameters: 6.315; 11.949; 12.068; 63.09; 87.201; 79.911;  

COD ID: 4031851
CIF file Formula: - C28 H19 B F2 N2 O S2 -
Comments: Sun, Zuo-Bang; Guo, Man; Zhao, Cui-Hua Synthesis and Properties of Benzothieno[b]-Fused BODIPY Dyes. The Journal of organic chemistry 81(1) (2016) 229-237
Space group: P 1 21/n 1
Cell volume: 2352
Cell parameters: 11.103; 11.545; 18.556; 90; 98.521; 90;  

COD ID: 4031852
CIF file Formula: - C28 H21 N2 O S2 -
Comments: Sun, Zuo-Bang; Guo, Man; Zhao, Cui-Hua Synthesis and Properties of Benzothieno[b]-Fused BODIPY Dyes. The Journal of organic chemistry 81(1) (2016) 229-237
Space group: P 1 21/c 1
Cell volume: 2317
Cell parameters: 11.015; 19.543; 11.98; 90; 116.043; 90;  

COD ID: 4031853
CIF file Formula: - C21 H13 B F2 N2 S -
Comments: Sun, Zuo-Bang; Guo, Man; Zhao, Cui-Hua Synthesis and Properties of Benzothieno[b]-Fused BODIPY Dyes. The Journal of organic chemistry 81(1) (2016) 229-237
Space group: P -1
Cell volume: 850.9
Cell parameters: 8.043; 10.839; 11.074; 110.676; 107.928; 90.914;  

COD ID: 4031854
CIF file Formula: - C26 H28 O6 S -
Comments: Zheng, Lan; Zhou, Zhao-Zhao; He, Yu-Tao; Li, Lian-Hua; Ma, Jun-Wei; Qiu, Yi-Feng; Zhou, Ping-Xin; Liu, Xue-Yuan; Xu, Peng-Fei; Liang, Yong-Min Iodine-Promoted Radical Cyclization in Water: A Selective Reaction of 1,6-Enynes with Sulfonyl Hydrazides. The Journal of organic chemistry 81(1) (2016) 66-76
Space group: P 1 21/n 1
Cell volume: 2349.8
Cell parameters: 10.2181; 6.8051; 33.7995; 90; 91.074; 90;  

COD ID: 4031855
CIF file Formula: - C27 H27 Cl I N O4 S2 -
Comments: Zheng, Lan; Zhou, Zhao-Zhao; He, Yu-Tao; Li, Lian-Hua; Ma, Jun-Wei; Qiu, Yi-Feng; Zhou, Ping-Xin; Liu, Xue-Yuan; Xu, Peng-Fei; Liang, Yong-Min Iodine-Promoted Radical Cyclization in Water: A Selective Reaction of 1,6-Enynes with Sulfonyl Hydrazides. The Journal of organic chemistry 81(1) (2016) 66-76
Space group: P 1 21/n 1
Cell volume: 2778.31
Cell parameters: 15.9991; 9.4815; 18.3873; 90; 95.082; 90;  

COD ID: 4031856
CIF file Formula: - C17 H17 N3 O2 S -
Comments: Doherty, William; Evans, Paul Aminooxylation Horner-Wadsworth-Emmons Sequence for the Synthesis of Enantioenriched γ-Functionalized Vinyl Sulfones. The Journal of organic chemistry 81(4) (2016) 1416-1424
Space group: P 1 21 1
Cell volume: 839.84
Cell parameters: 9.9158; 7.8871; 11.6418; 90; 112.716; 90;  

COD ID: 4031857
CIF file Formula: - C26 H23 Cl N2 O6 -
Comments: Xu, Gong; Lüthy, Monique; Habegger, Jacqueline; Renaud, Philippe Homologation Strategy for the Generation of 1-Chloroalkyl Radicals from Organoboranes. The Journal of organic chemistry 81(4) (2016) 1506-1519
Space group: P 1 21/n 1
Cell volume: 4759.48
Cell parameters: 14.7728; 14.5583; 22.2237; 90; 95.257; 90;  

COD ID: 4031858
CIF file Formula: - C13 H13 Cl O2 -
Comments: Xu, Gong; Lüthy, Monique; Habegger, Jacqueline; Renaud, Philippe Homologation Strategy for the Generation of 1-Chloroalkyl Radicals from Organoboranes. The Journal of organic chemistry 81(4) (2016) 1506-1519
Space group: P 21 21 21
Cell volume: 1167.54
Cell parameters: 8.14393; 8.45999; 16.946; 90; 90; 90;  

COD ID: 4031859
CIF file Formula: - C14.06 H16 Cl0.12 O3 -
Comments: Xu, Gong; Lüthy, Monique; Habegger, Jacqueline; Renaud, Philippe Homologation Strategy for the Generation of 1-Chloroalkyl Radicals from Organoboranes. The Journal of organic chemistry 81(4) (2016) 1506-1519
Space group: P 1 21/c 1
Cell volume: 1280.7
Cell parameters: 13.2938; 8.6528; 11.2228; 90; 97.224; 90;  

COD ID: 4031860
CIF file Formula: - C15 H14 N2 O2 -
Comments: Motiwala, Hashim F.; Charaschanya, Manwika; Day, Victor W.; Aubé, Jeffrey Remodeling and Enhancing Schmidt Reaction Pathways in Hexafluoroisopropanol. The Journal of organic chemistry 81(4) (2016) 1593-1609
Space group: P 1 21/c 1
Cell volume: 1292.43
Cell parameters: 12.8994; 10.6296; 9.552; 90; 99.323; 90;  

COD ID: 4031861
CIF file Formula: - C12 H15 N5 -
Comments: Motiwala, Hashim F.; Charaschanya, Manwika; Day, Victor W.; Aubé, Jeffrey Remodeling and Enhancing Schmidt Reaction Pathways in Hexafluoroisopropanol. The Journal of organic chemistry 81(4) (2016) 1593-1609
Space group: P 1 21/c 1
Cell volume: 1149.6
Cell parameters: 5.991; 28.946; 7.1474; 90; 111.95; 90;  

COD ID: 4031862
CIF file Formula: - C16 H23 N O4 -
Comments: Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry 81(4) (2016) 1391-1400
Space group: P 21 21 21
Cell volume: 1556
Cell parameters: 8.7921; 11.303; 15.658; 90; 90; 90;  

COD ID: 4031863
CIF file Formula: - C16 H19 N O4 -
Comments: Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry 81(4) (2016) 1391-1400
Space group: P 1 21/c 1
Cell volume: 3038.1
Cell parameters: 10.49; 14.202; 20.974; 90; 103.52; 90;  

COD ID: 4031864
CIF file Formula: - C11 H10 O2 S2 -
Comments: Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry 81(4) (2016) 1391-1400
Space group: P 21 21 21
Cell volume: 1095
Cell parameters: 7.0792; 10.326; 14.979; 90; 90; 90;  

COD ID: 4031865
CIF file Formula: - C11 H14 O2 S2 -
Comments: Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry 81(4) (2016) 1391-1400
Space group: P b c a
Cell volume: 2217.1
Cell parameters: 11.059; 11.569; 17.329; 90; 90; 90;  

COD ID: 4031867
CIF file Formula: - C28 H34 N6 O4 -
Comments: Ramachary, Dhevalapally B.; Shruthi, Kodambahalli S. A Brønsted Acid-Amino Acid as a Synergistic Catalyst for Asymmetric List-Lerner-Barbas Aldol Reactions. The Journal of organic chemistry 81(6) (2016) 2405-2419
Space group: C 1 2 1
Cell volume: 1410.6
Cell parameters: 26.355; 5.4089; 14.346; 90; 136.39; 90;  

COD ID: 4031868
CIF file Formula: - C13 H14 Cl N3 O2 -
Comments: Ramachary, Dhevalapally B.; Shruthi, Kodambahalli S. A Brønsted Acid-Amino Acid as a Synergistic Catalyst for Asymmetric List-Lerner-Barbas Aldol Reactions. The Journal of organic chemistry 81(6) (2016) 2405-2419
Space group: P 1 21 1
Cell volume: 688.09
Cell parameters: 4.9375; 13.7996; 10.2372; 90; 99.431; 90;  

COD ID: 4031869
CIF file Formula: - C16 H13 N O2 -
Comments: Pan, Shanfei; Wu, Feifei; Yu, Ruicheng; Chen, Wanzhi Palladium-Catalyzed Sequential Acylation/Cyanation of Aryl Iodides: A Regiospecific Synthesis of 2-Cyanoaryl Ketones. The Journal of organic chemistry 81(4) (2016) 1558-1564
Space group: P -1
Cell volume: 647.76
Cell parameters: 7.9139; 8.2369; 11.5044; 76.314; 85.795; 62.838;  

COD ID: 4031870
CIF file Formula: - C30.67 H21.33 N2.67 O5.33 -
Comments: Devi, Rajkumari Vijilata; Garande, Ashok M.; Maity, Dilip K.; Bhate, Prakash M. A Serendipitous Synthesis of 11a-Hydroxy-11,11a-dihydrobenzo[e]indeno[2,1-b][1,4]diazepine-10,12-dione Derivatives by Condensation of 2-Aminobenzamides with Ninhydrin in Water. The Journal of organic chemistry 81(4) (2016) 1689-1695
Space group: P 21 21 21
Cell volume: 1886.3
Cell parameters: 8.2207; 13.3837; 17.1443; 90; 90; 90;  

COD ID: 4031871
CIF file Formula: - C16 H10 N2 O3 -
Comments: Devi, Rajkumari Vijilata; Garande, Ashok M.; Maity, Dilip K.; Bhate, Prakash M. A Serendipitous Synthesis of 11a-Hydroxy-11,11a-dihydrobenzo[e]indeno[2,1-b][1,4]diazepine-10,12-dione Derivatives by Condensation of 2-Aminobenzamides with Ninhydrin in Water. The Journal of organic chemistry 81(4) (2016) 1689-1695
Space group: P 1 21/c 1
Cell volume: 1226.7
Cell parameters: 5.0458; 19.062; 12.879; 90; 98.003; 90;  

COD ID: 4031872
CIF file Formula: - C22 H17 N O -
Comments: Zhang, Mingliang; Ruan, Wenqing; Zhang, Hui-Jun; Li, Weiwei; Wen, Ting-Bin Synthesis of α-Aminonaphthalenes via Copper-Catalyzed Aminobenzannulation of (o-Alkynyl)arylketones with Amines. The Journal of organic chemistry 81(4) (2016) 1696-1703
Space group: P 1 21 1
Cell volume: 1575.1
Cell parameters: 8.2006; 16.758; 11.927; 90; 106.06; 90;  

COD ID: 4031873
CIF file Formula: - C22 H16 Cl N -
Comments: Zhang, Mingliang; Ruan, Wenqing; Zhang, Hui-Jun; Li, Weiwei; Wen, Ting-Bin Synthesis of α-Aminonaphthalenes via Copper-Catalyzed Aminobenzannulation of (o-Alkynyl)arylketones with Amines. The Journal of organic chemistry 81(4) (2016) 1696-1703
Space group: P -1
Cell volume: 1645.4
Cell parameters: 4.961; 16.81; 21.337; 108.34; 96.71; 98.43;  

COD ID: 4031874
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21 1
Cell volume: 858.66
Cell parameters: 9.223; 10.8655; 9.4767; 90; 115.29; 90;  

COD ID: 4031875
CIF file Formula: - C24 H27 N3 O6 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/n 1
Cell volume: 6573.2
Cell parameters: 10.1654; 23.4039; 27.844; 90; 97.126; 90;  

COD ID: 4031876
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/n 1
Cell volume: 5241.05
Cell parameters: 25.4459; 7.8587; 26.2588; 90; 93.53; 90;  

COD ID: 4031877
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/a 1
Cell volume: 1744.22
Cell parameters: 8.1469; 21.0989; 10.1495; 90; 91.2076; 90;  

COD ID: 4031878
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21 1
Cell volume: 899.27
Cell parameters: 8.7713; 8.2519; 12.8289; 90; 104.428; 90;  

COD ID: 4031879
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/n 1
Cell volume: 1735.74
Cell parameters: 6.5131; 15.578; 17.347; 90; 99.532; 90;  

COD ID: 4031880
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/a 1
Cell volume: 1670.77
Cell parameters: 8.1146; 15.1903; 14.0567; 90; 105.362; 90;  

COD ID: 4031881
CIF file Formula: - C19 H22 N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/c 1
Cell volume: 1653.26
Cell parameters: 6.8438; 9.8978; 24.5997; 90; 97.1851; 90;  

COD ID: 4031882
CIF file Formula: - C19.5 H23 Cl N2 O4 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/a 1
Cell volume: 1920.48
Cell parameters: 8.6793; 22.8503; 9.6857; 90; 91.2144; 90;  

COD ID: 4031883
CIF file Formula: - C25 H29 Cl2 N3 O6 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 1 21/a 1
Cell volume: 5025.67
Cell parameters: 12.8137; 20.3565; 19.3212; 90; 94.288; 90;  

COD ID: 4031884
CIF file Formula: - C24 H29 N3 O7 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: P 21 21 21
Cell volume: 2296.06
Cell parameters: 7.6862; 10.4995; 28.4514; 90; 90; 90;  

COD ID: 4031885
CIF file Formula: - C25 H28 Cl3 N3 O6 -
Comments: Saglam, Mehmet F.; Alborzi, Ali R.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S. Synthesis and Diels-Alder Reactivity of Substituted [4]Dendralenes. The Journal of organic chemistry 81(4) (2016) 1461-1475
Space group: C 1 c 1
Cell volume: 2612.24
Cell parameters: 13.2299; 13.607; 14.5131; 90; 91.0006; 90;  

COD ID: 4031886
CIF file Formula: - C24 H20 O2 -
Comments: Talipov, Marat R.; Abdelwahed, Sameh H.; Thakur, Khushabu; Reid, Scott A.; Rathore, Rajendra From Wires to Cables: Attempted Synthesis of 1,3,5-Trifluorenylcyclohexane as a Platform for Molecular Cables. The Journal of organic chemistry 81(4) (2016) 1627-1634
Space group: P 1 21/c 1
Cell volume: 1714.69
Cell parameters: 15.2613; 6.8729; 17.2658; 90; 108.77; 90;  

COD ID: 4031887
CIF file Formula: - C30 H24 -
Comments: Talipov, Marat R.; Abdelwahed, Sameh H.; Thakur, Khushabu; Reid, Scott A.; Rathore, Rajendra From Wires to Cables: Attempted Synthesis of 1,3,5-Trifluorenylcyclohexane as a Platform for Molecular Cables. The Journal of organic chemistry 81(4) (2016) 1627-1634
Space group: P 1 21/c 1
Cell volume: 4076.11
Cell parameters: 17.3559; 23.0476; 10.60473; 90; 106.077; 90;  

COD ID: 4031888
CIF file Formula: - C42 H30 -
Comments: Talipov, Marat R.; Abdelwahed, Sameh H.; Thakur, Khushabu; Reid, Scott A.; Rathore, Rajendra From Wires to Cables: Attempted Synthesis of 1,3,5-Trifluorenylcyclohexane as a Platform for Molecular Cables. The Journal of organic chemistry 81(4) (2016) 1627-1634
Space group: P 21 21 21
Cell volume: 2889.38
Cell parameters: 10.5272; 15.2695; 17.9749; 90; 90; 90;  

COD ID: 4031889
CIF file Formula: - C30 H24 -
Comments: Talipov, Marat R.; Abdelwahed, Sameh H.; Thakur, Khushabu; Reid, Scott A.; Rathore, Rajendra From Wires to Cables: Attempted Synthesis of 1,3,5-Trifluorenylcyclohexane as a Platform for Molecular Cables. The Journal of organic chemistry 81(4) (2016) 1627-1634
Space group: C 1 2/c 1
Cell volume: 2048.39
Cell parameters: 17.2175; 6.92; 17.2064; 90; 92.311; 90;  

COD ID: 4031890
CIF file Formula: - C16 H16 N O4 -
Comments: Yang, Wei; Wang, Jingyi; Wei, Zhonglin; Zhang, Qian; Xu, Xianxiu Kinetic Control of Rh(III)-Catalyzed Annulation of C-H Bonds with Quinones: Chemoselective Synthesis of Hydrophenanthridinones and Phenanthridinones. The Journal of organic chemistry 81(4) (2016) 1675-1680
Space group: P -1
Cell volume: 713.47
Cell parameters: 7.6471; 10.1457; 10.4036; 108.059; 102.095; 102.883;  

COD ID: 4031891
CIF file Formula: - C30 H23 N3 O -
Comments: Siva Kumari, A. Leela; Kumara Swamy, K. C. Gold-Catalyzed Concomitant [3 + 3] Cycloaddition/Cascade Heterocyclization of Enynones/Enynals with Azides Leading to Furanotriazines. The Journal of organic chemistry 81(4) (2016) 1425-1433
Space group: P 1 21/n 1
Cell volume: 2363.1
Cell parameters: 10.3959; 20.556; 11.7549; 90; 109.824; 90;  

COD ID: 4031892
CIF file Formula: - C31 H25 N3 O2 -
Comments: Siva Kumari, A. Leela; Kumara Swamy, K. C. Gold-Catalyzed Concomitant [3 + 3] Cycloaddition/Cascade Heterocyclization of Enynones/Enynals with Azides Leading to Furanotriazines. The Journal of organic chemistry 81(4) (2016) 1425-1433
Space group: P 1 21/n 1
Cell volume: 2610.9
Cell parameters: 7.5985; 10.1256; 34.045; 90; 94.613; 90;  

COD ID: 4031893
CIF file Formula: - C22 H23 Cl N2 O4 -
Comments: Wangweerawong, Apiwat; Hummel, Joshua R.; Bergman, Robert G.; Ellman, Jonathan A. Preparation of Enantiomerically Pure Perfluorobutanesulfinamide and Its Application to the Asymmetric Synthesis of α-Amino Acids. The Journal of organic chemistry 81(4) (2016) 1547-1557
Space group: P 1
Cell volume: 1176.83
Cell parameters: 8.5086; 10.4268; 13.873; 103.623; 99.874; 90.545;  

COD ID: 4031894
CIF file Formula: - C15 H18 N4 O11 S -
Comments: Wangweerawong, Apiwat; Hummel, Joshua R.; Bergman, Robert G.; Ellman, Jonathan A. Preparation of Enantiomerically Pure Perfluorobutanesulfinamide and Its Application to the Asymmetric Synthesis of α-Amino Acids. The Journal of organic chemistry 81(4) (2016) 1547-1557
Space group: P 1 21 1
Cell volume: 1953.3
Cell parameters: 10.2071; 16.4858; 12.6284; 90; 113.189; 90;  

COD ID: 4031895
CIF file Formula: - C15 H13 Cl O5 -
Comments: Ram, Ram N.; Gupta, Dharmendra Kumar; Soni, Vineet Kumar Copper(I)/Ligand-Catalyzed 5-endo Radical Cyclization-Aromatization of 2,2,2-Trichloroethyl Vinyl Ethers: Synthesis of 2,3-Difunctionalized 4-Chlorofurans. The Journal of organic chemistry 81(4) (2016) 1665-1674
Space group: P -1
Cell volume: 724.4
Cell parameters: 7.17; 9.128; 11.218; 98.826; 90.908; 92.801;  

COD ID: 4031896
CIF file Formula: - C23 H34 O3 P2 -
Comments: Jaklińska, Magdalena; Cordier, Marie; Stankevič, Marek Stereoselectivity of Michael Addition of P(X)-H-Type Nucleophiles to Cyclohexen-1-ylphosphine Oxide: The Case of Base-Selective Transformation. The Journal of organic chemistry 81(4) (2016) 1378-1390
Space group: P 21 21 21
Cell volume: 2251.23
Cell parameters: 10.2313; 14.6185; 15.0517; 90; 90; 90;  

COD ID: 4031897
CIF file Formula: - C25 H23 N O3 -
Comments: Zhang, Yu-Chen; Zhu, Qiu-Ning; Yang, Xue; Zhou, Lu-Jia; Shi, Feng Merging Chiral Brønsted Acid/Base Catalysis: An Enantioselective [4 + 2] Cycloaddition of o-Hydroxystyrenes with Azlactones. The Journal of organic chemistry 81(4) (2016) 1681-1688
Space group: P 1 21 1
Cell volume: 2005.31
Cell parameters: 6.4902; 16.0682; 19.2321; 90; 91.03; 90;  

COD ID: 4031898
CIF file Formula: - C10 H8 N4 O0 -
Comments: Sun, Kai; Zhu, Zhonghong; Sun, Jingjing; Liu, Lulu; Wang, Xin Copper-Catalyzed N-Arylation of Azoles and Mannich-Type Coupling of Ketones and Azoles under Metal-Free Conditions. The Journal of organic chemistry 81(4) (2016) 1476-1483
Space group: P n a 21
Cell volume: 919.7
Cell parameters: 9.1089; 9.794; 10.309; 90; 90; 90;  

COD ID: 4031899
CIF file Formula: - C16 H14 N2 O -
Comments: Sun, Kai; Zhu, Zhonghong; Sun, Jingjing; Liu, Lulu; Wang, Xin Copper-Catalyzed N-Arylation of Azoles and Mannich-Type Coupling of Ketones and Azoles under Metal-Free Conditions. The Journal of organic chemistry 81(4) (2016) 1476-1483
Space group: C 1 2/c 1
Cell volume: 2569.8
Cell parameters: 21.104; 5.9925; 20.403; 90; 95.16; 90;  

COD ID: 4031900
CIF file Formula: - C17 H14 N2 O2 -
Comments: Singh, Bijaya Kumar; Jana, Ranjan Ligand-Enabled, Copper-Promoted Regio- and Chemoselective Hydroxylation of Arenes, Aryl Halides, and Aryl Methyl Ethers. The Journal of organic chemistry 81(3) (2016) 831-841
Space group: P 1 21/c 1
Cell volume: 1387.5
Cell parameters: 7.1498; 12.4223; 15.922; 90; 101.145; 90;  

COD ID: 4031901
CIF file Formula: - C23 H20 O5 -
Comments: Mal, Kanchan; Das, Indrajit Base Induced Chiral Substituted Furans and Imidazoles from Carbohydrate-Derived 2-Haloenones. The Journal of organic chemistry 81(3) (2016) 932-945
Space group: P -1
Cell volume: 957.1
Cell parameters: 9.0301; 9.6899; 11.5773; 89.237; 88.378; 70.942;  

COD ID: 4031902
CIF file Formula: - C16 H16 I2 O4 -
Comments: Bentley, Keith W.; Joyce, Leo A.; Sherer, Edward C.; Sheng, Huaming; Wolf, Christian; Welch, Christopher J. Antenna Biphenols: Development of Extended Wavelength Chiroptical Reporters. The Journal of organic chemistry 81(3) (2016) 1185-1191
Space group: P -1
Cell volume: 5121.2
Cell parameters: 15.0063; 18.8148; 19.7847; 81.121; 75.859; 71.583;  

COD ID: 4031903
CIF file Formula: - C16 H14 Br4 O4 -
Comments: Bentley, Keith W.; Joyce, Leo A.; Sherer, Edward C.; Sheng, Huaming; Wolf, Christian; Welch, Christopher J. Antenna Biphenols: Development of Extended Wavelength Chiroptical Reporters. The Journal of organic chemistry 81(3) (2016) 1185-1191
Space group: P -1
Cell volume: 915.95
Cell parameters: 8.523; 10.0979; 12.3744; 67.425; 86.163; 69.144;  

COD ID: 4031904
CIF file Formula: - C32 H26 O4 -
Comments: Bentley, Keith W.; Joyce, Leo A.; Sherer, Edward C.; Sheng, Huaming; Wolf, Christian; Welch, Christopher J. Antenna Biphenols: Development of Extended Wavelength Chiroptical Reporters. The Journal of organic chemistry 81(3) (2016) 1185-1191
Space group: P 1 21/c 1
Cell volume: 2492.51
Cell parameters: 13.0893; 11.2066; 17.8513; 90; 107.849; 90;  

COD ID: 4031905
CIF file Formula: - C22 H14 O -
Comments: Paul, Kartick; Jalal, Swapnadeep; Kundal, Sandip; Jana, Umasish Synthesis of Fused Dibenzofuran Derivatives via Palladium-Catalyzed Domino C-C Bond Formation and Iron-Catalyzed Cycloisomerization/Aromatization. The Journal of organic chemistry 81(3) (2016) 1164-1174
Space group: P -1
Cell volume: 764.64
Cell parameters: 9.1784; 10.2343; 10.5109; 98.755; 113.273; 114.44;  

COD ID: 4031906
CIF file Formula: - C23 H33 O5 P -
Comments: Markley, Jana L.; Maitra, Soma; Hanson, Paul R. Phosphate Tether-Mediated Ring-Closing Metathesis for the Generation of P-Stereogenic, Z-Configured Bicyclo[7.3.1]- and Bicyclo[8.3.1]phosphates. The Journal of organic chemistry 81(3) (2016) 899-911
Space group: P 1 21 1
Cell volume: 1116.16
Cell parameters: 6.0855; 20.704; 9.2928; 90; 107.58; 90;  

COD ID: 4031907
CIF file Formula: - C14 H23 O4 P -
Comments: Markley, Jana L.; Maitra, Soma; Hanson, Paul R. Phosphate Tether-Mediated Ring-Closing Metathesis for the Generation of P-Stereogenic, Z-Configured Bicyclo[7.3.1]- and Bicyclo[8.3.1]phosphates. The Journal of organic chemistry 81(3) (2016) 899-911
Space group: P 1 21 1
Cell volume: 739.61
Cell parameters: 7.9652; 9.6983; 9.7159; 90; 99.7908; 90;  

COD ID: 4031908
CIF file Formula: - C17 H16 Br N O5 S -
Comments: Wei, Pei-Shun; Wang, Meng-Xue; Xu, Dong-Cheng; Xie, Jian-Wu Synthesis of 2,3-Dihydrothieno(2,3-b)quinolines and Thieno(2,3-b)- quinolines via an Unexpected Domino Aza-MBH/Alkylation/Aldol Reaction. The Journal of organic chemistry 81(3) (2016) 1216-1222
Space group: P -1
Cell volume: 903.35
Cell parameters: 9.0005; 9.8533; 10.2837; 86.35; 84.591; 85.213;  

COD ID: 4031909
CIF file Formula: - C18 H19 N O5 S -
Comments: Wei, Pei-Shun; Wang, Meng-Xue; Xu, Dong-Cheng; Xie, Jian-Wu Synthesis of 2,3-Dihydrothieno(2,3-b)quinolines and Thieno(2,3-b)- quinolines via an Unexpected Domino Aza-MBH/Alkylation/Aldol Reaction. The Journal of organic chemistry 81(3) (2016) 1216-1222
Space group: P 1 21/c 1
Cell volume: 1723.58
Cell parameters: 16.5377; 7.9752; 13.0814; 90; 92.575; 90;  

COD ID: 4031910
CIF file Formula: - C18 H16 N2 O3 S -
Comments: Wei, Jun; Jiang, Jingxing; Xiao, Xinsheng; Lin, Dongen; Deng, Yuanfu; Ke, Zhuofeng; Jiang, Huanfeng; Zeng, Wei Copper-Catalyzed Regioselective C-H Sulfonylation of 8-Aminoquinolines. The Journal of organic chemistry 81(3) (2016) 946-955
Space group: P n a 21
Cell volume: 1596.7
Cell parameters: 7.5963; 18.1171; 11.602; 90; 90; 90;  

COD ID: 4031911
CIF file Formula: - C21 H17 Cl2 N O -
Comments: Patel, Darshan C.; Breitbach, Zachary S.; Woods, Ross M.; Lim, Yeeun; Wang, Andy; Jr, Frank W Foss; Armstrong, Daniel W. Gram Scale Conversion of R-BINAM to R-NOBIN. The Journal of organic chemistry 81(3) (2016) 1295-1299
Space group: P 21 21 21
Cell volume: 1823.15
Cell parameters: 9.0085; 11.9601; 16.9214; 90; 90; 90;  

COD ID: 4031912
CIF file Formula: - C27 H28 O6 -
Comments: Akbar, Sikkandarkani; Srinivasan, Kannupal Iron-Catalyzed Tandem Conia-Ene/Friedel-Crafts Reactions of o-Alkynyldihydrochalcones: Access to Benzo[b]fluorenes. The Journal of organic chemistry 81(3) (2016) 1229-1236
Space group: P -1
Cell volume: 1173.25
Cell parameters: 8.9759; 9.7135; 14.17; 98.454; 105.814; 91.27;  

COD ID: 4031913
CIF file Formula: - C17 H28 S4 -
Comments: Wessig, P.; Gerngroß, M; Freyse, D.; Bruhns, P.; Przezdziak, M.; Schilde, U.; Kelling, A. Molecular Rods Based on Oligo-spiro-thioketals. The Journal of organic chemistry 81(3) (2016) 1125-1136
Space group: P b c n
Cell volume: 1799.02
Cell parameters: 5.9887; 10.5588; 28.4505; 90; 90; 90;  

COD ID: 4031914
CIF file Formula: - C37 H23 B F2 N2 -
Comments: Yamazawa, Sho; Nakashima, Mika; Suda, Yukie; Nishiyabu, Ryuhei; Kubo, Yuji 2,3-Naphtho-Fused BODIPYs as Near-Infrared Absorbing Dyes. The Journal of organic chemistry 81(3) (2016) 1310-1315
Space group: P 1 21/n 1
Cell volume: 2585.5
Cell parameters: 12.119; 7.848; 27.185; 90; 90.261; 90;  

COD ID: 4031915
CIF file Formula: - C14.25 H21 N8 O4.25 -
Comments: Stancl, Marek; Gargulakova, Zuzana; Sindelar, Vladimir Correction to "Glycoluril Dimer Isomerization under Aqueous Acidic Conditions Related to Cucurbituril Formation". The Journal of organic chemistry 81(3) (2016) 1316
Space group: P 1 21/n 1
Cell volume: 3307.2
Cell parameters: 11.8598; 19.9474; 13.9976; 90; 92.895; 90;  

COD ID: 4031916
CIF file Formula: - C18 H14 N2 O -
Comments: Zhang, Shi-Jin; Sun, Wen-Wu; Cao, Pei; Dong, Xiao-Ping; Liu, Ji-Kai; Wu, Bin Stereoselective Synthesis of Diazabicyclic β-Lactams through Intramolecular Amination of Unactivated C(sp(3))-H Bonds of Carboxamides by Palladium Catalysis. The Journal of organic chemistry 81(3) (2016) 956-968
Space group: P 1 21/c 1
Cell volume: 1376.5
Cell parameters: 12.2122; 9.7378; 11.5756; 90; 90.414; 90;  

COD ID: 4031917
CIF file Formula: - C10 H10 N2 O -
Comments: Zhang, Shi-Jin; Sun, Wen-Wu; Cao, Pei; Dong, Xiao-Ping; Liu, Ji-Kai; Wu, Bin Stereoselective Synthesis of Diazabicyclic β-Lactams through Intramolecular Amination of Unactivated C(sp(3))-H Bonds of Carboxamides by Palladium Catalysis. The Journal of organic chemistry 81(3) (2016) 956-968
Space group: P 21 21 21
Cell volume: 849.02
Cell parameters: 6.6165; 8.5077; 15.0826; 90; 90; 90;  

COD ID: 4031918
CIF file Formula: - C19 H16 N2 O2 -
Comments: Zhang, Shi-Jin; Sun, Wen-Wu; Cao, Pei; Dong, Xiao-Ping; Liu, Ji-Kai; Wu, Bin Stereoselective Synthesis of Diazabicyclic β-Lactams through Intramolecular Amination of Unactivated C(sp(3))-H Bonds of Carboxamides by Palladium Catalysis. The Journal of organic chemistry 81(3) (2016) 956-968
Space group: P 1 21/c 1
Cell volume: 1523.8
Cell parameters: 13.6518; 9.812; 12.3174; 90; 112.549; 90;  

COD ID: 4031919
CIF file Formula: - C18 H13 F N2 O -
Comments: Zhang, Shi-Jin; Sun, Wen-Wu; Cao, Pei; Dong, Xiao-Ping; Liu, Ji-Kai; Wu, Bin Stereoselective Synthesis of Diazabicyclic β-Lactams through Intramolecular Amination of Unactivated C(sp(3))-H Bonds of Carboxamides by Palladium Catalysis. The Journal of organic chemistry 81(3) (2016) 956-968
Space group: P 1 21/c 1
Cell volume: 1391.2
Cell parameters: 7.8685; 16.8026; 10.9944; 90; 106.843; 90;  

COD ID: 4031920
CIF file Formula: - C14 H17 Cl N2 O4 -
Comments: Durel, Vianney; Lalli, Claudia; Roisnel, Thierry; Weghe, Pierre van de Synergistic Effect of the TiCl4/p-TsOH Promoter System on the Aza-Prins Cyclization. The Journal of organic chemistry 81(3) (2016) 849-859
Space group: P -1
Cell volume: 723.16
Cell parameters: 7.6988; 10.1399; 10.4688; 98.485; 110.24; 103.21;  

COD ID: 4031921
CIF file Formula: - C11 H13 Br Cl N -
Comments: Durel, Vianney; Lalli, Claudia; Roisnel, Thierry; Weghe, Pierre van de Synergistic Effect of the TiCl4/p-TsOH Promoter System on the Aza-Prins Cyclization. The Journal of organic chemistry 81(3) (2016) 849-859
Space group: P c a n
Cell volume: 2271.5
Cell parameters: 5.4944; 17.8095; 23.213; 90; 90; 90;  

COD ID: 4031922
CIF file Formula: - C22 H15 N O -
Comments: Aradi, Klára; Bombicz, Petra; Novák, Zoltán Modular Copper-Catalyzed Synthesis of Chromeno[4,3-b]quinolines with the Utilization of Diaryliodonium Salts. The Journal of organic chemistry 81(3) (2016) 920-931
Space group: P -1
Cell volume: 778.95
Cell parameters: 5.7757; 11.9628; 11.9927; 70.251; 89.805; 87.3;  

COD ID: 4031923
CIF file Formula: - C22 H15 Cl O -
Comments: Ouyang, Lu; Qi, Chaorong; He, Haitao; Peng, Youbin; Xiong, Wenfang; Ren, Yanwei; Jiang, Huanfeng Base-Promoted Formal [4 + 3] Annulation between 2-Fluorophenylacetylenes and Ketones: A Route to Benzoxepines. The Journal of organic chemistry 81(3) (2016) 912-919
Space group: P b c a
Cell volume: 3304.3
Cell parameters: 17.355; 9.4432; 20.162; 90; 90; 90;  

COD ID: 4031924
CIF file Formula: - C18 H14 O -
Comments: Ouyang, Lu; Qi, Chaorong; He, Haitao; Peng, Youbin; Xiong, Wenfang; Ren, Yanwei; Jiang, Huanfeng Base-Promoted Formal [4 + 3] Annulation between 2-Fluorophenylacetylenes and Ketones: A Route to Benzoxepines. The Journal of organic chemistry 81(3) (2016) 912-919
Space group: P 21 21 21
Cell volume: 1297.9
Cell parameters: 6.4783; 8.4999; 23.571; 90; 90; 90;  

COD ID: 4031925
CIF file Formula: - C55 H47 Cl3 Cu N4 O2 -
Comments: Gehrold, Andreas C.; Bruhn, Torsten; Bringmann, Gerhard Axial, Helical, and Planar Chirality in Directly Linked Basket-Handle Porphyrin Arrays. The Journal of organic chemistry 81(3) (2016) 1075-1088
Space group: P 1 21/c 1
Cell volume: 4602.4
Cell parameters: 17.844; 16.028; 16.127; 90; 93.772; 90;  

COD ID: 4031926
CIF file Formula: - C27 H43 Br2 N4 O2.5 -
Comments: Abdulwahaab, Bassim H.; Burke, Benjamin P.; Domarkas, Juozas; Silversides, Jon D.; Prior, Timothy J.; Archibald, Stephen J. Mono- and Bis-Alkylation of Glyoxal-Bridged Tetraazamacrocycles Using Mechanochemistry. The Journal of organic chemistry 81(3) (2016) 890-898
Space group: P 1 21/n 1
Cell volume: 2795.8
Cell parameters: 9.718; 22.6793; 13.0099; 90; 102.826; 90;  

COD ID: 4031927
CIF file Formula: - C26 H38 Br2 N4 O -
Comments: Abdulwahaab, Bassim H.; Burke, Benjamin P.; Domarkas, Juozas; Silversides, Jon D.; Prior, Timothy J.; Archibald, Stephen J. Mono- and Bis-Alkylation of Glyoxal-Bridged Tetraazamacrocycles Using Mechanochemistry. The Journal of organic chemistry 81(3) (2016) 890-898
Space group: P 1 21/n 1
Cell volume: 2617.5
Cell parameters: 14.54; 10.1743; 18.1427; 90; 102.778; 90;  

COD ID: 4031928
CIF file Formula: - C28 H42 Br2 N4 O -
Comments: Abdulwahaab, Bassim H.; Burke, Benjamin P.; Domarkas, Juozas; Silversides, Jon D.; Prior, Timothy J.; Archibald, Stephen J. Mono- and Bis-Alkylation of Glyoxal-Bridged Tetraazamacrocycles Using Mechanochemistry. The Journal of organic chemistry 81(3) (2016) 890-898
Space group: C 2 2 21
Cell volume: 2826.7
Cell parameters: 10.7048; 13.9924; 18.8717; 90; 90; 90;  

COD ID: 4031929
CIF file Formula: - C24 H17 Cl2 I N4 O3 S -
Comments: Wang, Ai-Fang; Zhu, Yi-Long; Wang, Shu-Liang; Hao, Wen-Juan; Li, Guigen; Tu, Shu-Jiang; Jiang, Bo Metal-Free Radical Haloazidation of Benzene-Tethered 1,7-Enynes Leading to Polyfunctionalized 3,4-Dihydroquinolin-2(1H)-ones. The Journal of organic chemistry 81(3) (2016) 1099-1105
Space group: P -1
Cell volume: 1262
Cell parameters: 8.087; 9.6789; 16.5891; 90.513; 103.315; 92.59;  

COD ID: 4031931
CIF file Formula: - C27 H46 Cl2 N4 O6 -
Comments: Wang, Zhuo; Islam, Md Jahirul; Vukotic, V. Nicholas; Revington, Matthew J. Conformational Study of N,N'-Diacyl Bispidines and Dioxo Bis-bispidines: Planar Chirality and Molecular Switching. The Journal of organic chemistry 81(7) (2016) 2981-2986
Space group: P -1
Cell volume: 1524
Cell parameters: 8.4658; 12.7598; 14.619; 75.041; 89.508; 87.31;  

COD ID: 4031932
CIF file Formula: - C15 H24 Cl2 N2 O4 -
Comments: Wang, Zhuo; Islam, Md Jahirul; Vukotic, V. Nicholas; Revington, Matthew J. Conformational Study of N,N'-Diacyl Bispidines and Dioxo Bis-bispidines: Planar Chirality and Molecular Switching. The Journal of organic chemistry 81(7) (2016) 2981-2986
Space group: P -1
Cell volume: 865.9
Cell parameters: 8.2504; 9.6655; 11.6169; 100.467; 91.12; 107.542;  

COD ID: 4031933
CIF file Formula: - C19 H17 Br O2 -
Comments: Ubukata, Shino; Ito, Jun-Ichi; Oguri, Ryota; Nishiyama, Hisao Asymmetric Three-Component Coupling Reaction of Alkyne, Enone, and Aldehyde Catalyzed by Chiral Phebox Ruthenium Catalysts. The Journal of organic chemistry 81(8) (2016) 3347-3355
Space group: P 1 21 1
Cell volume: 1663.14
Cell parameters: 16.3112; 5.7559; 17.7642; 90; 94.2846; 90;  

COD ID: 4031934
CIF file Formula: - C9 H14 O3 -
Comments: Li, Yuanzhen; Yang, Shuang; Wen, Genfa; Lin, Qiqiao; Zhang, Guoxiang; Qiu, Lin; Zhang, Xiaoyan; Du, Guangfen; Fang, Xinqiang Asymmetric Desymmetrization of 1,3-Diketones via Intramolecular Benzoin Reaction. The Journal of organic chemistry 81(7) (2016) 2763-2769
Space group: P -1
Cell volume: 439.99
Cell parameters: 6.1436; 6.8104; 10.8156; 87.661; 78.156; 83.52;  

COD ID: 4031935
CIF file Formula: - C14 H15 F O3 -
Comments: Li, Yuanzhen; Yang, Shuang; Wen, Genfa; Lin, Qiqiao; Zhang, Guoxiang; Qiu, Lin; Zhang, Xiaoyan; Du, Guangfen; Fang, Xinqiang Asymmetric Desymmetrization of 1,3-Diketones via Intramolecular Benzoin Reaction. The Journal of organic chemistry 81(7) (2016) 2763-2769
Space group: P 1 21 1
Cell volume: 603.19
Cell parameters: 7.083; 7.1796; 11.8698; 90; 92.156; 90;  

COD ID: 4031936
CIF file Formula: - C19 H16 N4 O -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: C 1 2/c 1
Cell volume: 3246.84
Cell parameters: 21.975; 7.9493; 19.2418; 90; 104.993; 90;  

COD ID: 4031937
CIF file Formula: - C27 H29 N3 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P -1
Cell volume: 1099.35
Cell parameters: 9.392; 9.6342; 13.7713; 77.113; 81.781; 65.015;  

COD ID: 4031938
CIF file Formula: - C20 H23 N3 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P 1 21/n 1
Cell volume: 1732.4
Cell parameters: 11.7471; 13.291; 11.5874; 90; 106.749; 90;  

COD ID: 4031939
CIF file Formula: - C17.5 H19 N4 O0.5 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: C 1 c 1
Cell volume: 3252.6
Cell parameters: 22.1401; 10.4147; 14.3555; 90; 100.699; 90;  

COD ID: 4031940
CIF file Formula: - C17 H23 N3 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P -1
Cell volume: 730.37
Cell parameters: 9.0878; 9.202; 9.5148; 95.924; 110.639; 96.782;  

COD ID: 4031941
CIF file Formula: - C19 H15 N3 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P 1 21/c 1
Cell volume: 1464.42
Cell parameters: 5.3908; 12.7036; 21.4042; 90; 92.502; 90;  

COD ID: 4031942
CIF file Formula: - C17 H12 N4 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P 1 21/c 1
Cell volume: 1292.04
Cell parameters: 14.5287; 5.131; 18.0984; 90; 106.735; 90;  

COD ID: 4031943
CIF file Formula: - C18 H13 N3 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P 1 21/n 1
Cell volume: 1313.11
Cell parameters: 12.3812; 5.6553; 18.7769; 90; 92.864; 90;  

COD ID: 4031944
CIF file Formula: - C21 H24 N4 O -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: P 1 21/c 1
Cell volume: 1910.63
Cell parameters: 13.174; 9.647; 16.383; 90; 113.416; 90;  

COD ID: 4031945
CIF file Formula: - C15 H22 N4 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: C 1 2/c 1
Cell volume: 2980.6
Cell parameters: 17.2832; 10.5241; 16.7531; 90; 102; 90;  

COD ID: 4031946
CIF file Formula: - C14 H8 N2 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: C 1 2/c 1
Cell volume: 1044.8
Cell parameters: 15.8339; 3.9749; 16.9483; 90; 101.628; 90;  

COD ID: 4031947
CIF file Formula: - C20 H22 N4 -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: C 1 2/c 1
Cell volume: 3396.22
Cell parameters: 16.8777; 9.1711; 21.9473; 90; 91.346; 90;  

COD ID: 4031948
CIF file Formula: - C13 H14 N2 O -
Comments: Wrobel, Agnes Johanna; Lucchesi, Ralph; Wibbeling, Birgit; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Würthwein, Ernst-Ulrich 1,3,5-Triazapentadienes by Nucleophilic Addition to 1,3- and 1,4-Dinitriles-Sterically Constrained Examples by Incorporation into Cyclic Peripheries: Synthesis, Aggregation, and Photophysical Properties. The Journal of organic chemistry 81(7) (2016) 2849-2863
Space group: C 1 2/c 1
Cell volume: 2182.65
Cell parameters: 15.602; 12.952; 11.0992; 90; 103.31; 90;  

COD ID: 4031949
CIF file Formula: - C12 H7 N5 S2 -
Comments: Mota, Alberto A. R.; Corrêa, José R; Carvalho, Pedro H. P. R.; de Sousa, Núbia M P; de Oliveira, Heibbe C. B.; Gatto, Claudia C.; da Silva Filho, Demétrio A; de Oliveira, Aline L.; Neto, Brenno A. D. Synthesis, Structure, Properties, and Bioimaging of a Fluorescent Nitrogen-Linked Bisbenzothiadiazole. The Journal of organic chemistry 81(7) (2016) 2958-2965
Space group: P 1 21/c 1
Cell volume: 1166.33
Cell parameters: 11.6415; 14.699; 6.9416; 90; 100.918; 90;  

COD ID: 4031950
CIF file Formula: - C25 H18 O -
Comments: Hu, Pan; Lee, Sangsu; Park, Kyu Hyung; Das, Soumyajit; Herng, Tun Seng; Gonçalves, Théo P; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Octazethrene and Its Isomer with Different Diradical Characters and Chemical Reactivity: The Role of the Bridge Structure. The Journal of organic chemistry 81(7) (2016) 2911-2919
Space group: P 1 21/n 1
Cell volume: 1697.88
Cell parameters: 11.2442; 12.6155; 11.9818; 90; 92.599; 90;  

COD ID: 4031951
CIF file Formula: - C31 H31 O -
Comments: Hu, Pan; Lee, Sangsu; Park, Kyu Hyung; Das, Soumyajit; Herng, Tun Seng; Gonçalves, Théo P; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Octazethrene and Its Isomer with Different Diradical Characters and Chemical Reactivity: The Role of the Bridge Structure. The Journal of organic chemistry 81(7) (2016) 2911-2919
Space group: P 1 21/c 1
Cell volume: 2289.57
Cell parameters: 8.3105; 9.6129; 28.8543; 90; 96.657; 90;  

COD ID: 4031952
CIF file Formula: - C63 H48 F10 O2 -
Comments: Hu, Pan; Lee, Sangsu; Park, Kyu Hyung; Das, Soumyajit; Herng, Tun Seng; Gonçalves, Théo P; Huang, Kuo-Wei; Ding, Jun; Kim, Dongho; Wu, Jishan Octazethrene and Its Isomer with Different Diradical Characters and Chemical Reactivity: The Role of the Bridge Structure. The Journal of organic chemistry 81(7) (2016) 2911-2919
Space group: P -1
Cell volume: 1222.66
Cell parameters: 9.2006; 10.9573; 13.7554; 95.316; 99.204; 114.807;  

COD ID: 4031953
CIF file Formula: - C16 H15 N5 O -
Comments: Åkerbladh, Linda; Odell, Luke R. Synthesis of 2-Aminoquinazolinones via Carbonylative Coupling of ortho-Iodoanilines and Cyanamide. The Journal of organic chemistry 81(7) (2016) 2966-2973
Space group: P 1 21/c 1
Cell volume: 1422.82
Cell parameters: 13.9053; 6.1919; 16.7754; 90; 99.909; 90;  

COD ID: 4031954
CIF file Formula: - C12 H9 Br O3 -
Comments: Li, Yanan; Hu, Yanbin; Zhang, Sheng; Sun, Jianan; Li, Lijun; Zha, Zhenggen; Wang, Zhiyong Copper-Catalyzed Enantioselective Hetero-Diels-Alder Reaction of Danishefsky's Diene with Glyoxals. The Journal of organic chemistry 81(7) (2016) 2993-2999
Space group: P 1 21 1
Cell volume: 548.77
Cell parameters: 5.304; 6.0907; 16.9947; 90; 91.708; 90;  

COD ID: 4031955
CIF file Formula: - C21 H28 N2 O2 -
Comments: Tang, Fei; Banwell, Martin G.; Willis, Anthony C. Palladium-Catalyzed Ullmann Cross-Coupling/Tandem Reductive Cyclization Route to Key Members of the Uleine Alkaloid Family. The Journal of organic chemistry 81(7) (2016) 2950-2957
Space group: P 1 21/n 1
Cell volume: 1834.84
Cell parameters: 10.1738; 10.6826; 17.3464; 90; 103.28; 90;  

COD ID: 4031956
CIF file Formula: - C16 H16 N2 O3 -
Comments: Tang, Fei; Banwell, Martin G.; Willis, Anthony C. Palladium-Catalyzed Ullmann Cross-Coupling/Tandem Reductive Cyclization Route to Key Members of the Uleine Alkaloid Family. The Journal of organic chemistry 81(7) (2016) 2950-2957
Space group: P 21 21 21
Cell volume: 1458.19
Cell parameters: 8.56836; 12.02612; 14.15115; 90; 90; 90;  

COD ID: 4031957
CIF file Formula: - C17 H16 N2 -
Comments: Quinodoz, Pierre; Drouillat, Bruno; Wright, Karen; Marrot, Jérôme; Couty, François N-Arylazetidines: Preparation through Anionic Ring Closure. The Journal of organic chemistry 81(7) (2016) 2899-2910
Space group: P 21 21 21
Cell volume: 1395.24
Cell parameters: 8.0726; 10.504; 16.4544; 90; 90; 90;  

COD ID: 4031958
CIF file Formula: - C16 H14 N2 -
Comments: Quinodoz, Pierre; Drouillat, Bruno; Wright, Karen; Marrot, Jérôme; Couty, François N-Arylazetidines: Preparation through Anionic Ring Closure. The Journal of organic chemistry 81(7) (2016) 2899-2910
Space group: P 43
Cell volume: 1313.17
Cell parameters: 9.6634; 9.6634; 14.0625; 90; 90; 90;  

COD ID: 4031959
CIF file Formula: - C20 H19 N3 O -
Comments: Vidyacharan, Shinde; Murugan, Arumugavel; Sharada, Duddu S. C(sp(2))-H Functionalization of 2H-Indazoles at C3-Position via Palladium(II)-Catalyzed Isocyanide Insertion Strategy Leading to Diverse Heterocycles. The Journal of organic chemistry 81(7) (2016) 2837-2848
Space group: P 1 21/c 1
Cell volume: 1640.6
Cell parameters: 18.3402; 5.2971; 17.7876; 90; 108.308; 90;  

COD ID: 4031960
CIF file Formula: - C21 H23 N O -
Comments: Chen, Fei; Yang, Xiu-Long; Wu, Zhi-Wei; Han, Bing Synthesis of Isoxazoline/Cyclic Nitrone-Featured Methylenes Using Unsaturated Ketoximes: A Dual Role of TEMPO. The Journal of organic chemistry 81(7) (2016) 3042-3050
Space group: P -1
Cell volume: 901.1
Cell parameters: 9.6457; 10.255; 10.4809; 114.778; 103.217; 93.707;  

COD ID: 4031961
CIF file Formula: - C15 H19 N O -
Comments: Chen, Fei; Yang, Xiu-Long; Wu, Zhi-Wei; Han, Bing Synthesis of Isoxazoline/Cyclic Nitrone-Featured Methylenes Using Unsaturated Ketoximes: A Dual Role of TEMPO. The Journal of organic chemistry 81(7) (2016) 3042-3050
Space group: P 1 21/c 1
Cell volume: 1323.4
Cell parameters: 9.9162; 12.1827; 11.4435; 90; 106.801; 90;  

COD ID: 4031962
CIF file Formula: - C17 H16 N2 O6 -
Comments: Gayakhe, Vijay; Ardhapure, Ajaykumar; Kapdi, Anant R.; Sanghvi, Yogesh S.; Serrano, Jose Luis; García, Luis; Pérez, Jose; García, Joaquím; Sánchez, Gregorio; Fischer, Christian; Schulzke, Carola Water-Soluble Pd-Imidate Complexes: Broadly Applicable Catalysts for the Synthesis of Chemically Modified Nucleosides via Pd-Catalyzed Cross-Coupling. The Journal of organic chemistry 81(7) (2016) 2713-2729
Space group: P 1 21 1
Cell volume: 752.1
Cell parameters: 10.59; 6.6123; 10.786; 90; 95.25; 90;  

COD ID: 4031963
CIF file Formula: - C21 H24 N2 O7 -
Comments: Gayakhe, Vijay; Ardhapure, Ajaykumar; Kapdi, Anant R.; Sanghvi, Yogesh S.; Serrano, Jose Luis; García, Luis; Pérez, Jose; García, Joaquím; Sánchez, Gregorio; Fischer, Christian; Schulzke, Carola Water-Soluble Pd-Imidate Complexes: Broadly Applicable Catalysts for the Synthesis of Chemically Modified Nucleosides via Pd-Catalyzed Cross-Coupling. The Journal of organic chemistry 81(7) (2016) 2713-2729
Space group: C 2 2 21
Cell volume: 3927.6
Cell parameters: 8.503; 19.136; 24.138; 90; 90; 90;  

COD ID: 4031964
CIF file Formula: - C25 H24 N5 O2 P Pd -
Comments: Gayakhe, Vijay; Ardhapure, Ajaykumar; Kapdi, Anant R.; Sanghvi, Yogesh S.; Serrano, Jose Luis; García, Luis; Pérez, Jose; García, Joaquím; Sánchez, Gregorio; Fischer, Christian; Schulzke, Carola Water-Soluble Pd-Imidate Complexes: Broadly Applicable Catalysts for the Synthesis of Chemically Modified Nucleosides via Pd-Catalyzed Cross-Coupling. The Journal of organic chemistry 81(7) (2016) 2713-2729
Space group: P 1 21/a 1
Cell volume: 2254.43
Cell parameters: 14.8466; 9.9164; 15.3707; 90; 94.973; 90;  

COD ID: 4031965
CIF file Formula: - C26 H24 N5 O3 P Pd -
Comments: Gayakhe, Vijay; Ardhapure, Ajaykumar; Kapdi, Anant R.; Sanghvi, Yogesh S.; Serrano, Jose Luis; García, Luis; Pérez, Jose; García, Joaquím; Sánchez, Gregorio; Fischer, Christian; Schulzke, Carola Water-Soluble Pd-Imidate Complexes: Broadly Applicable Catalysts for the Synthesis of Chemically Modified Nucleosides via Pd-Catalyzed Cross-Coupling. The Journal of organic chemistry 81(7) (2016) 2713-2729
Space group: P 21 c a
Cell volume: 2442.7
Cell parameters: 9.3167; 12.8999; 20.3246; 90; 90; 90;  

COD ID: 4031966
CIF file Formula: - C16 H16 N2 O7 -
Comments: Gayakhe, Vijay; Ardhapure, Ajaykumar; Kapdi, Anant R.; Sanghvi, Yogesh S.; Serrano, Jose Luis; García, Luis; Pérez, Jose; García, Joaquím; Sánchez, Gregorio; Fischer, Christian; Schulzke, Carola Water-Soluble Pd-Imidate Complexes: Broadly Applicable Catalysts for the Synthesis of Chemically Modified Nucleosides via Pd-Catalyzed Cross-Coupling. The Journal of organic chemistry 81(7) (2016) 2713-2729
Space group: P 21 21 21
Cell volume: 1527
Cell parameters: 6.3928; 14.653; 16.301; 90; 90; 90;  

COD ID: 4031967
CIF file Formula: - C14 H25 N O4 S -
Comments: Dowling, Matthew S.; Fernando, Dilinie P.; Hou, Jie; Liu, Bo; Smith, Aaron C. Two Scalable Syntheses of (S)-2-Methylazetidine. The Journal of organic chemistry 81(7) (2016) 3031-3036
Space group: P 42
Cell volume: 1606.08
Cell parameters: 14.795; 14.795; 7.3373; 90; 90; 90;  

COD ID: 4031968
CIF file Formula: - C14 H9 Br N2 -
Comments: Xu, Cheng; Jia, Feng-Cheng; Zhou, Zhi-Wen; Zheng, Si-Jie; Li, Han; Wu, An-Xin Copper-Catalyzed Multicomponent Domino Reaction of 2-Bromoaldehydes, Benzylamines, and Sodium Azide for the Assembly of Quinazoline Derivatives. The Journal of organic chemistry 81(7) (2016) 3000-3006
Space group: P -1
Cell volume: 1157.8
Cell parameters: 6.0845; 7.566; 25.221; 88.323; 89.896; 86.032;  

COD ID: 4031969
CIF file Formula: - C44 H32 N4 O15 -
Comments: Ling, Fei; Wan, Yanjun; Wang, Dongxu; Ma, Cheng Coupling and Decoupling Approach Enables Palladium-Catalyzed Aerobic Bimolecular Carbocyclizations of Enediynes to 2,6-Diacylnaphthalenes. The Journal of organic chemistry 81(7) (2016) 2770-2781
Space group: P 1 21/c 1
Cell volume: 2310.2
Cell parameters: 11.3311; 19.2315; 10.608; 90; 92.046; 90;  

COD ID: 4031970
CIF file Formula: - C24 H24 Br N O5 -
Comments: Weng, Jian-Quan; Fan, Ren-Jie; Deng, Qiao-Man; Liu, Ren-Rong; Gao, Jian-Rong; Jia, Yi-Xia Enantioselective Friedel-Crafts Alkylation Reactions of 3-Substituted Indoles with Electron-Deficient Alkenes. The Journal of organic chemistry 81(7) (2016) 3023-3030
Space group: P -1
Cell volume: 1138.79
Cell parameters: 10.929; 11.0375; 11.7658; 106.803; 99.982; 116.422;  

COD ID: 4031971
CIF file Formula: - C17 H15 Br N2 O2 -
Comments: Weng, Jian-Quan; Fan, Ren-Jie; Deng, Qiao-Man; Liu, Ren-Rong; Gao, Jian-Rong; Jia, Yi-Xia Enantioselective Friedel-Crafts Alkylation Reactions of 3-Substituted Indoles with Electron-Deficient Alkenes. The Journal of organic chemistry 81(7) (2016) 3023-3030
Space group: P 43 21 2
Cell volume: 3206.43
Cell parameters: 9.6284; 9.6284; 34.587; 90; 90; 90;  

COD ID: 4031972
CIF file Formula: - C24 H25 Cl N2 O4 -
Comments: Liu, Hua-Chao; Tao, Hai-Yan; Cong, Hengjiang; Wang, Chun-Jiang Silver(I)-Catalyzed Atroposelective Desymmetrization of N-Arylmaleimide via 1,3-Dipolar Cycloaddition of Azomethine Ylides: Access to Octahydropyrrolo[3,4-c]pyrrole Derivatives. The Journal of organic chemistry 81(9) (2016) 3752-3760
Space group: C 1 2 1
Cell volume: 2249.1
Cell parameters: 21.203; 5.8478; 20.613; 90; 118.361; 90;  

COD ID: 4031987
CIF file Formula: - C18 H22 O6 -
Comments: Qin, Zifeng; Liu, Wei; Wang, Danyang; He, Zhengjie Phosphine-Catalyzed (4 + 1) Annulation of o-Hydroxyphenyl and o-Aminophenyl Ketones with Allylic Carbonates: Syntheses and Transformations of 3-Hydroxy-2,3-Disubstituted Dihydrobenzofurans and Indolines. The Journal of organic chemistry 81(11) (2016) 4690-4700
Space group: P 1 21 1
Cell volume: 843
Cell parameters: 11.722; 6.0787; 12.996; 90; 114.44; 90;  

COD ID: 4031988
CIF file Formula: - C21 H26 F N O6 -
Comments: Qin, Zifeng; Liu, Wei; Wang, Danyang; He, Zhengjie Phosphine-Catalyzed (4 + 1) Annulation of o-Hydroxyphenyl and o-Aminophenyl Ketones with Allylic Carbonates: Syntheses and Transformations of 3-Hydroxy-2,3-Disubstituted Dihydrobenzofurans and Indolines. The Journal of organic chemistry 81(11) (2016) 4690-4700
Space group: P 1 21/c 1
Cell volume: 2191.7
Cell parameters: 10.881; 19.835; 11.526; 90; 118.23; 90;  

COD ID: 4031989
CIF file Formula: - C56 H57 F6 O P3 Ru -
Comments: Ma, Hao-Wei; Chen, Pei-Min; Lo, Ji-Xian; Lin, Ying-Chih; Huang, Shou-Ling; Chen, Chi-Ren; Chia, Pi-Yeh Domino Cyclization of 1,n-Enynes (n = 7, 8, 9) Giving Derivatives of Pyrane, Chromene, Fluorene, Phenanthrene and Dibenzo[7]annulene by Ruthenium Complexes. The Journal of organic chemistry 81(11) (2016) 4494-4505
Space group: P 21 21 21
Cell volume: 4897.8
Cell parameters: 14.2112; 17.5594; 19.6273; 90; 90; 90;  

COD ID: 4031993
CIF file Formula: - C30 H21 N O2 -
Comments: Pusch, Stefan; Kowalczyk, Danuta; Opatz, Till A Photoinduced Cobalt-Catalyzed Synthesis of Pyrroles through in Situ-Generated Acylazirines. The Journal of organic chemistry 81(10) (2016) 4170-4178
Space group: C 1 2/c 1
Cell volume: 4418.4
Cell parameters: 29.279; 9.9611; 15.2419; 90; 96.311; 90;  

COD ID: 4031994
CIF file Formula: - C16 H27 F2 N O7 S -
Comments: Liang, Xiaofei; Gopalaswamy, Ramesh; Navas, 3rd, Frank; Toone, Eric J.; Zhou, Pei A Scalable Synthesis of the Difluoromethyl-allo-threonyl Hydroxamate-Based LpxC Inhibitor LPC-058. The Journal of organic chemistry 81(10) (2016) 4393-4398
Space group: P 21 21 21
Cell volume: 1852.78
Cell parameters: 6.3347; 12.7819; 22.8824; 90; 90; 90;  

COD ID: 4031995
CIF file Formula: - C19 H17 N3 O3 -
Comments: Zheng, Yin; Cui, Lei; Wang, Youming; Zhou, Zhenghong Stereocontrolled Construction of Tetrahydropyrano[2,3-c]pyrazole Scaffold via an Organocatalyzed Formal [3 + 3] Annulation. The Journal of organic chemistry 81(10) (2016) 4340-4346
Space group: P 21 21 21
Cell volume: 1629.6
Cell parameters: 8.308; 12.155; 16.137; 90; 90; 90;  

COD ID: 4031996
CIF file Formula: - C23 H23 N O4 -
Comments: Majee, Debashis; Biswas, Soumen; Mobin, Shaikh M.; Samanta, Sampak Access to 4,6-Diarylpicolinates via a Domino Reaction of Cyclic Sulfamidate Imines with Morita-Baylis-Hillman Acetates of Nitroolefins/Nitrodienes. The Journal of organic chemistry 81(10) (2016) 4378-4385
Space group: P 1 21/c 1
Cell volume: 1975.8
Cell parameters: 20.1569; 7.495; 13.1446; 90; 95.77; 90;  

COD ID: 4031997
CIF file Formula: - C28 H40 N2 O5 -
Comments: Oliveira Udry, Guillermo A.; Repetto, Evangelina; Vega, Daniel R.; Varela, Oscar Synthesis of Enantiomeric Polyhydroxyalkylpyrrolidines from 1,3-Dipolar Cycloadducts. Evaluation as Inhibitors of a β-Galactofuranosidase. The Journal of organic chemistry 81(10) (2016) 4179-4189
Space group: C 1 2 1
Cell volume: 2703
Cell parameters: 33.3; 5.412; 15; 90; 91.1; 90;  

COD ID: 4031998
CIF file Formula: - C26 H37 N O5 -
Comments: Oliveira Udry, Guillermo A.; Repetto, Evangelina; Vega, Daniel R.; Varela, Oscar Synthesis of Enantiomeric Polyhydroxyalkylpyrrolidines from 1,3-Dipolar Cycloadducts. Evaluation as Inhibitors of a β-Galactofuranosidase. The Journal of organic chemistry 81(10) (2016) 4179-4189
Space group: P 1
Cell volume: 1208.9
Cell parameters: 5.5207; 12.938; 17.1775; 94.761; 93.119; 97.721;  

COD ID: 4031999
CIF file Formula: - C23 H26 F2 N2 O2 -
Comments: Wang, Chao; Chen, Qiao; Guo, Quanping; Liu, Hong; Xu, Zhaoqing; Liu, Yubing; Wang, Mengran; Wang, Rui Silver-Catalyzed Difluoroamidation of Activated Alkenes for the Construction of Difluorinated 3,3-Disubstituted Oxindoles. The Journal of organic chemistry 81(13) (2016) 5782-5788
Space group: P b c a
Cell volume: 4331.7
Cell parameters: 14.3541; 12.9841; 23.2417; 90; 90; 90;  

COD ID: 4032000
CIF file Formula: - C26 H29 N O4 -
Comments: Zhurkin, Fedor E.; Hu, Xile γ-Selective Allylation of (E)-Alkenylzinc Iodides Prepared by Reductive Coupling of Arylacetylenes with Alkyl Iodides. The Journal of organic chemistry 81(13) (2016) 5795-5802
Space group: P 1 21/c 1
Cell volume: 4468.7
Cell parameters: 20.7774; 13.3315; 17.7511; 90; 114.656; 90;  

COD ID: 4032001
CIF file Formula: - C29 H26 N2 O9 -
Comments: Mukherjee, Prasun; Das, Asish R. Diastereoselective Synthesis of Structurally and Stereochemically Diversified 2-Oxa-7-azabicyclo[4.1.0]hept-3-enyl Carboxylates and Their Potential Application toward the Synthesis of Functionalized Pyranooxazolone and Pyrrole Derivatives through Skeletal Transformations. The Journal of organic chemistry 81(13) (2016) 5513-5524
Space group: P 1 21/c 1
Cell volume: 2683.9
Cell parameters: 12.2536; 11.1077; 19.8629; 90; 96.9; 90;  

COD ID: 4032002
CIF file Formula: - C17 H16 N2 O3 -
Comments: Mukherjee, Prasun; Das, Asish R. Diastereoselective Synthesis of Structurally and Stereochemically Diversified 2-Oxa-7-azabicyclo[4.1.0]hept-3-enyl Carboxylates and Their Potential Application toward the Synthesis of Functionalized Pyranooxazolone and Pyrrole Derivatives through Skeletal Transformations. The Journal of organic chemistry 81(13) (2016) 5513-5524
Space group: P 1 21 1
Cell volume: 1562.71
Cell parameters: 10.3945; 14.251; 10.8994; 90; 104.558; 90;  

COD ID: 4032003
CIF file Formula: - C26 H21 Br Cl N3 O4 -
Comments: Pozharskii, Alexander F.; Ozeryanskii, Valery A.; Mikshiev, Vladimir Y.; Antonov, Alexander S.; Chernyshev, Anatoly V.; Metelitsa, Anatoly V.; Borodkin, Gennady S.; Fedik, Nikita S.; Dyablo, Olga V. 10-Dimethylamino Derivatives of Benzo[h]quinoline and Benzo[h]quinazolines: Fluorescent Proton Sponge Analogues with Opposed peri-NMe2/-N═ Groups. How to Distinguish between Proton Sponges and Pseudo-Proton Sponges. The Journal of organic chemistry 81(13) (2016) 5574-5587
Space group: P 1 21/n 1
Cell volume: 2291.4
Cell parameters: 9.3748; 14.9234; 17.0073; 90; 105.626; 90;  

COD ID: 4032004
CIF file Formula: - C15 H15 B F4 N2 -
Comments: Pozharskii, Alexander F.; Ozeryanskii, Valery A.; Mikshiev, Vladimir Y.; Antonov, Alexander S.; Chernyshev, Anatoly V.; Metelitsa, Anatoly V.; Borodkin, Gennady S.; Fedik, Nikita S.; Dyablo, Olga V. 10-Dimethylamino Derivatives of Benzo[h]quinoline and Benzo[h]quinazolines: Fluorescent Proton Sponge Analogues with Opposed peri-NMe2/-N═ Groups. How to Distinguish between Proton Sponges and Pseudo-Proton Sponges. The Journal of organic chemistry 81(13) (2016) 5574-5587
Space group: P 1 21 1
Cell volume: 696.32
Cell parameters: 6.2123; 11.7333; 9.8071; 90; 103.073; 90;  

COD ID: 4032005
CIF file Formula: - C26 H22 Cl N3 O4 -
Comments: Pozharskii, Alexander F.; Ozeryanskii, Valery A.; Mikshiev, Vladimir Y.; Antonov, Alexander S.; Chernyshev, Anatoly V.; Metelitsa, Anatoly V.; Borodkin, Gennady S.; Fedik, Nikita S.; Dyablo, Olga V. 10-Dimethylamino Derivatives of Benzo[h]quinoline and Benzo[h]quinazolines: Fluorescent Proton Sponge Analogues with Opposed peri-NMe2/-N═ Groups. How to Distinguish between Proton Sponges and Pseudo-Proton Sponges. The Journal of organic chemistry 81(13) (2016) 5574-5587
Space group: P -1
Cell volume: 2224.5
Cell parameters: 9.464; 9.749; 24.118; 89.146; 89.296; 89.079;  

COD ID: 4032006
CIF file Formula: - C24 H20 N2 O2 -
Comments: Yugandar, S.; Konda, S.; Parameshwarappa, G.; Ila, H. One-Pot Synthesis of 2,4,5-Trisubstituted Imidazoles via [2 + 2 + 1] Cycloannulation of 1,3-Bishet(aryl)-monothio-1,3-diketones, α-Substituted Methylamines and Sodium Nitrite through α-Nitrosation of Enaminones. The Journal of organic chemistry 81(13) (2016) 5606-5622
Space group: P 21 21 21
Cell volume: 1937.36
Cell parameters: 10.4681; 10.6574; 17.3657; 90; 90; 90;  

COD ID: 4032007
CIF file Formula: - C21 H19 N3 O3 -
Comments: Yugandar, S.; Konda, S.; Parameshwarappa, G.; Ila, H. One-Pot Synthesis of 2,4,5-Trisubstituted Imidazoles via [2 + 2 + 1] Cycloannulation of 1,3-Bishet(aryl)-monothio-1,3-diketones, α-Substituted Methylamines and Sodium Nitrite through α-Nitrosation of Enaminones. The Journal of organic chemistry 81(13) (2016) 5606-5622
Space group: P 1 21/c 1
Cell volume: 1859.98
Cell parameters: 11.4995; 11.1353; 15.3917; 90; 109.315; 90;  

COD ID: 4032008
CIF file Formula: - C85 H96 Cl2 Mg2 N10 O2 S -
Comments: Ikbal, Sk Asif; Dhamija, Avinash; Brahma, Sanfaori; Rath, Sankar Prasad A Nonempirical Approach for Direct Determination of the Absolute Configuration of 1,2-Diols and Amino Alcohols Using Mg(II)bisporphyrin. The Journal of organic chemistry 81(13) (2016) 5440-5449
Space group: P 21 21 21
Cell volume: 7766
Cell parameters: 13.195; 23.759; 24.771; 90; 90; 90;  

COD ID: 4032009
CIF file Formula: - C177 H209 Cl3 Mg4 N20 O4 S2 -
Comments: Ikbal, Sk Asif; Dhamija, Avinash; Brahma, Sanfaori; Rath, Sankar Prasad A Nonempirical Approach for Direct Determination of the Absolute Configuration of 1,2-Diols and Amino Alcohols Using Mg(II)bisporphyrin. The Journal of organic chemistry 81(13) (2016) 5440-5449
Space group: P 1 21 1
Cell volume: 8094
Cell parameters: 13.376; 24.659; 24.538; 90; 90.141; 90;  

COD ID: 4032010
CIF file Formula: - C96 H112 Mg2 N8 O4 S -
Comments: Ikbal, Sk Asif; Dhamija, Avinash; Brahma, Sanfaori; Rath, Sankar Prasad A Nonempirical Approach for Direct Determination of the Absolute Configuration of 1,2-Diols and Amino Alcohols Using Mg(II)bisporphyrin. The Journal of organic chemistry 81(13) (2016) 5440-5449
Space group: P 21 21 21
Cell volume: 8732.4
Cell parameters: 13.6073; 24.816; 25.86; 90; 90; 90;  

COD ID: 4032011
CIF file Formula: - C24 H21 B2 F8 N3 -
Comments: Zhang, Xiaoping; Clennan, Edward L.; Arulsamy, Navamoney; Weber, Rachael; Weber, Jacob Synthesis, Structure, and Photochemical Behavior of [5]Heli-viologen Isomers. The Journal of organic chemistry 81(13) (2016) 5474-5486
Space group: C 1 2/c 1
Cell volume: 4666.9
Cell parameters: 22.7449; 19.7482; 11.4956; 90; 115.335; 90;  

COD ID: 4032012
CIF file Formula: - C13 H15 N O2 -
Comments: Zhao, Li-Ming; Zhang, Ai-Li; Zhang, Jie-Huan; Gao, Hua-Shuai; Zhou, Wei Zinc-Mediated C-3 α-Prenylation of Isatins with Prenyl Bromide: Access to 3-Prenyl-3-hydroxy-2-oxindoles and Its Application. The Journal of organic chemistry 81(13) (2016) 5487-5494
Space group: P 1 21/c 1
Cell volume: 1236.7
Cell parameters: 10.1491; 11.4621; 10.7009; 90; 96.569; 90;  

COD ID: 4032013
CIF file Formula: - C12 H21 Cl3 O3 -
Comments: Rodig, Michael J.; Snow, Arthur W.; Scholl, Paul; Rea, Simon Synthesis and Low Temperature Spectroscopic Observation of 1,3,5-Trioxane-2,4,6-Trione: The Cyclic Trimer of Carbon Dioxide. The Journal of organic chemistry 81(13) (2016) 5354-5361
Space group: P 1 21/c 1
Cell volume: 1574.6
Cell parameters: 9.5632; 6.0365; 27.2812; 90; 91.12; 90;  

COD ID: 4032014
CIF file Formula: - C24 H20 I4 N2 O -
Comments: Matsumoto, Shoji; Kikuchi, Shu; Norita, Naoto; Masu, Hyuma; Akazome, Motohiro Formation of Benzimidazoisoquinolinium and Benzimidazoisoindolinum Cyclic Systems by the Reaction of 2-(2-Alkynylphenyl)benzimidazoles with Iodine and Iodine-Iodine Interaction Including Halogen Bonding in Their Crystal Structures. The Journal of organic chemistry 81(13) (2016) 5322-5329
Space group: P 1 21/n 1
Cell volume: 2627.9
Cell parameters: 12.5581; 14.7892; 14.3839; 90; 100.361; 90;  

COD ID: 4032015
CIF file Formula: - C39.5 H30.5 I2 N4.5 -
Comments: Matsumoto, Shoji; Kikuchi, Shu; Norita, Naoto; Masu, Hyuma; Akazome, Motohiro Formation of Benzimidazoisoquinolinium and Benzimidazoisoindolinum Cyclic Systems by the Reaction of 2-(2-Alkynylphenyl)benzimidazoles with Iodine and Iodine-Iodine Interaction Including Halogen Bonding in Their Crystal Structures. The Journal of organic chemistry 81(13) (2016) 5322-5329
Space group: P 1 21/c 1
Cell volume: 3430.75
Cell parameters: 8.912; 10.0998; 38.1226; 90; 91.106; 90;  

COD ID: 4032016
CIF file Formula: - C28 H20 I4 N2 O -
Comments: Matsumoto, Shoji; Kikuchi, Shu; Norita, Naoto; Masu, Hyuma; Akazome, Motohiro Formation of Benzimidazoisoquinolinium and Benzimidazoisoindolinum Cyclic Systems by the Reaction of 2-(2-Alkynylphenyl)benzimidazoles with Iodine and Iodine-Iodine Interaction Including Halogen Bonding in Their Crystal Structures. The Journal of organic chemistry 81(13) (2016) 5322-5329
Space group: P 1 21/c 1
Cell volume: 2889.63
Cell parameters: 9.1058; 14.9161; 21.2943; 90; 92.442; 90;  

COD ID: 4032017
CIF file Formula: - C27 H18 I4 N2 -
Comments: Matsumoto, Shoji; Kikuchi, Shu; Norita, Naoto; Masu, Hyuma; Akazome, Motohiro Formation of Benzimidazoisoquinolinium and Benzimidazoisoindolinum Cyclic Systems by the Reaction of 2-(2-Alkynylphenyl)benzimidazoles with Iodine and Iodine-Iodine Interaction Including Halogen Bonding in Their Crystal Structures. The Journal of organic chemistry 81(13) (2016) 5322-5329
Space group: P 1 21 1
Cell volume: 1349.2
Cell parameters: 8.7; 15.83; 9.797; 90; 90.484; 90;  

COD ID: 4032018
CIF file Formula: - C21 H14 I4 N2 -
Comments: Matsumoto, Shoji; Kikuchi, Shu; Norita, Naoto; Masu, Hyuma; Akazome, Motohiro Formation of Benzimidazoisoquinolinium and Benzimidazoisoindolinum Cyclic Systems by the Reaction of 2-(2-Alkynylphenyl)benzimidazoles with Iodine and Iodine-Iodine Interaction Including Halogen Bonding in Their Crystal Structures. The Journal of organic chemistry 81(13) (2016) 5322-5329
Space group: P 1 21/n 1
Cell volume: 2262.1
Cell parameters: 8.4577; 9.7547; 27.544; 90; 95.462; 90;  

COD ID: 4032019
CIF file Formula: - C28 H20 I4 N2 -
Comments: Matsumoto, Shoji; Kikuchi, Shu; Norita, Naoto; Masu, Hyuma; Akazome, Motohiro Formation of Benzimidazoisoquinolinium and Benzimidazoisoindolinum Cyclic Systems by the Reaction of 2-(2-Alkynylphenyl)benzimidazoles with Iodine and Iodine-Iodine Interaction Including Halogen Bonding in Their Crystal Structures. The Journal of organic chemistry 81(13) (2016) 5322-5329
Space group: P 1 21/c 1
Cell volume: 2795.51
Cell parameters: 8.3087; 22.656; 14.9664; 90; 97.132; 90;  

COD ID: 4032020
CIF file Formula: - C10 H14 O4 -
Comments: Clay, Julia M.; Hesek, Dusan; Oliver, Allen G.; Lee, Mijoon; Fisher, Jed F. Ensemble of Pinanones from the Permanganate Oxidation of Myrtenal. The Journal of organic chemistry 81(13) (2016) 5705-5709
Space group: P 21 21 21
Cell volume: 998.1
Cell parameters: 6.968; 8.073; 17.744; 90; 90; 90;  

COD ID: 4032021
CIF file Formula: - C18 H26 O4 -
Comments: Clay, Julia M.; Hesek, Dusan; Oliver, Allen G.; Lee, Mijoon; Fisher, Jed F. Ensemble of Pinanones from the Permanganate Oxidation of Myrtenal. The Journal of organic chemistry 81(13) (2016) 5705-5709
Space group: P 21 21 21
Cell volume: 1565.02
Cell parameters: 9.4198; 9.7083; 17.1134; 90; 90; 90;  

COD ID: 4032022
CIF file Formula: - C50 H60 O10 -
Comments: Della Sala, Paolo; Gaeta, Carmine; Navarra, Wanda; Talotta, Carmen; De Rosa, Margherita; Brancatelli, Giovanna; Geremia, Silvano; Capitelli, Francesco; Neri, Placido Improved Synthesis of Larger Resorcinarenes. The Journal of organic chemistry 81(13) (2016) 5726-5731
Space group: P -1
Cell volume: 2128
Cell parameters: 11.2; 13.43; 16.32; 103.467; 94.715; 114.462;  

COD ID: 4032023
CIF file Formula: - C60 H72 O12 -
Comments: Della Sala, Paolo; Gaeta, Carmine; Navarra, Wanda; Talotta, Carmen; De Rosa, Margherita; Brancatelli, Giovanna; Geremia, Silvano; Capitelli, Francesco; Neri, Placido Improved Synthesis of Larger Resorcinarenes. The Journal of organic chemistry 81(13) (2016) 5726-5731
Space group: P 1 21/c 1
Cell volume: 5219.9
Cell parameters: 13.48; 15.127; 25.768; 90; 96.565; 90;  

COD ID: 4032024
CIF file Formula: - C40 H40 O8 -
Comments: Della Sala, Paolo; Gaeta, Carmine; Navarra, Wanda; Talotta, Carmen; De Rosa, Margherita; Brancatelli, Giovanna; Geremia, Silvano; Capitelli, Francesco; Neri, Placido Improved Synthesis of Larger Resorcinarenes. The Journal of organic chemistry 81(13) (2016) 5726-5731
Space group: P 1 21/c 1
Cell volume: 3500
Cell parameters: 8.864; 51.49; 7.808; 90; 100.81; 90;  

COD ID: 4032025
CIF file Formula: - C12 H16 O2 -
Comments: Berry, Ellen; Gomes, Gabriel Dos Passos; MacLean, Alex; Martin, Justin R.; Wiget, Paul A. Discovery of a Long-Range Perlin Effect in a Conformationally Constrained Oxocane. The Journal of organic chemistry 81(13) (2016) 5740-5744
Space group: P b c n
Cell volume: 2055.44
Cell parameters: 15.72; 10.2218; 12.7916; 90; 90; 90;  

COD ID: 4032026
CIF file Formula: - C21 H19 B S -
Comments: Messersmith, Reid E.; Siegler, Maxime A.; Tovar, John D. Aromaticity Competition in Differentially Fused Borepin-Containing Polycyclic Aromatics. The Journal of organic chemistry 81(13) (2016) 5595-5605
Space group: P 1 21/n 1
Cell volume: 1725.64
Cell parameters: 9.3963; 7.9827; 23.0568; 90; 93.8; 90;  

COD ID: 4032027
CIF file Formula: - C25 H21 B S -
Comments: Messersmith, Reid E.; Siegler, Maxime A.; Tovar, John D. Aromaticity Competition in Differentially Fused Borepin-Containing Polycyclic Aromatics. The Journal of organic chemistry 81(13) (2016) 5595-5605
Space group: P -1
Cell volume: 942.08
Cell parameters: 7.7856; 11.4781; 12.1; 115.871; 100.097; 94.798;  

COD ID: 4032028
CIF file Formula: - C22 H16 O S -
Comments: Zhang, Xing-Song; Jiao, Jun-Ying; Zhang, Xiao-Hong; Hu, Bo-Lun; Zhang, Xing-Guo Synthesis of 2-Sulfenylindenones via One-Pot Tandem Meyer-Schuster Rearrangement and Radical Cyclization of Arylpropynols with Disulfides. The Journal of organic chemistry 81(13) (2016) 5710-5716
Space group: P 1 21/c 1
Cell volume: 1751.9
Cell parameters: 10.168; 15.7; 11.009; 90; 94.542; 90;  

COD ID: 4032029
CIF file Formula: - C21 H25 N O3 -
Comments: Kong, De-Long; Cheng, Liang; Yue, Tao; Wu, Hong-Ru; Feng, Wei-Chun; Wang, Dong; Liu, Li Cobalt-Catalyzed Peroxidation of 2-Oxindoles with Hydroperoxides. The Journal of organic chemistry 81(13) (2016) 5337-5344
Space group: P 1 21/c 1
Cell volume: 1903.4
Cell parameters: 9.368; 15.869; 12.83; 90; 93.658; 90;  

COD ID: 4032030
CIF file Formula: - C27 H33 N3 O5 -
Comments: Zou, Gong-Feng; Zhang, Shi-Qiang; Wang, Jia-Xin; Liao, Wei-Wei Asymmetric Construction of Functionalized 1,2-Dihydropyridine and Pyridine Derivatives with Adjacent Stereocenters via a Unified Metal-Free Catalytic Approach. The Journal of organic chemistry 81(13) (2016) 5717-5725
Space group: P 1 21 1
Cell volume: 1338.9
Cell parameters: 7.74; 15.74; 10.99; 90; 90.17; 90;  

COD ID: 4032031
CIF file Formula: - C27 H22 Br N3 O4 -
Comments: Zou, Gong-Feng; Zhang, Shi-Qiang; Wang, Jia-Xin; Liao, Wei-Wei Asymmetric Construction of Functionalized 1,2-Dihydropyridine and Pyridine Derivatives with Adjacent Stereocenters via a Unified Metal-Free Catalytic Approach. The Journal of organic chemistry 81(13) (2016) 5717-5725
Space group: P 21 21 21
Cell volume: 2572.1
Cell parameters: 11.3822; 13.3519; 16.9247; 90; 90; 90;  

COD ID: 4032032
CIF file Formula: - C29 H30 N2 O2 S -
Comments: Huang, Xin; Liu, Miao; Pham, Kenny; Zhang, Xiaofeng; Yi, Wen-Bin; Jasinski, Jerry P.; Zhang, Wei Organocatalytic One-Pot Asymmetric Synthesis of Thiolated Spiro-γ-lactam Oxindoles Bearing Three Stereocenters. The Journal of organic chemistry 81(13) (2016) 5362-5369
Space group: P 1 21/n 1
Cell volume: 2834.7
Cell parameters: 8.4691; 16.8355; 19.884; 90; 90.96; 90;  

COD ID: 4032033
CIF file Formula: - C23 H17 Cl N4 O5 -
Comments: You, Yong; Wu, Zhi-Jun; Chen, Jian-Feng; Wang, Zhen-Hua; Xu, Xiao-Ying; Zhang, Xiao-Mei; Yuan, Wei-Cheng Organocatalytic Asymmetric Michael Addition of 3-Pyrrolyloxindoles to β-Phthalimidonitroethene for the Synthesis of 3,3'-Disubstituted Oxindoles Bearing Contiguous 3,α,β-Triamino Functionality. The Journal of organic chemistry 81(13) (2016) 5759-5765
Space group: P 1 21 1
Cell volume: 1058.12
Cell parameters: 9.0167; 9.9451; 12.302; 90; 106.426; 90;  

COD ID: 4032034
CIF file Formula: - C9 H5 F5 O2 S -
Comments: Ponomarenko, Maksym V.; Grabowsky, Simon; Pal, Rumpa; Röschenthaler, Gerd-Volker; Fokin, Andrey A. SF5-Enolates in Ti(IV)-Mediated Aldol Reactions. The Journal of organic chemistry 81(15) (2016) 6783-6791
Space group: C 1 2/c 1
Cell volume: 1943.83
Cell parameters: 18.9912; 9.2127; 12.1513; 90; 113.891; 90;  

COD ID: 4032035
CIF file Formula: - C10 H10 F5 N O5 S -
Comments: Ponomarenko, Maksym V.; Grabowsky, Simon; Pal, Rumpa; Röschenthaler, Gerd-Volker; Fokin, Andrey A. SF5-Enolates in Ti(IV)-Mediated Aldol Reactions. The Journal of organic chemistry 81(15) (2016) 6783-6791
Space group: P 1 21/c 1
Cell volume: 1294.9
Cell parameters: 14.587; 6.5046; 15.2015; 90; 116.131; 90;  

COD ID: 4032036
CIF file Formula: - C11 H11 F5 O3 S -
Comments: Ponomarenko, Maksym V.; Grabowsky, Simon; Pal, Rumpa; Röschenthaler, Gerd-Volker; Fokin, Andrey A. SF5-Enolates in Ti(IV)-Mediated Aldol Reactions. The Journal of organic chemistry 81(15) (2016) 6783-6791
Space group: P -1
Cell volume: 610.85
Cell parameters: 8.4711; 8.8607; 8.9602; 99.478; 110.838; 95.682;  

COD ID: 4032052
CIF file Formula: - C44 H49 O11 Os3 P -
Comments: Park, Boyoung Y.; Luong, Tom; Sato, Hiroki; Krische, Michael J. Osmium(0)-Catalyzed C-C Coupling of Ethylene and α-Olefins with Diols, Ketols, or Hydroxy Esters via Transfer Hydrogenation. The Journal of organic chemistry 81(18) (2016) 8585-8594
Space group: P -1
Cell volume: 2216.17
Cell parameters: 11.6048; 13.5575; 15.1224; 74.397; 75.404; 84.186;  

COD ID: 4032053
CIF file Formula: - C22 H28 Br2 O4 S -
Comments: Park, Boyoung Y.; Luong, Tom; Sato, Hiroki; Krische, Michael J. Osmium(0)-Catalyzed C-C Coupling of Ethylene and α-Olefins with Diols, Ketols, or Hydroxy Esters via Transfer Hydrogenation. The Journal of organic chemistry 81(18) (2016) 8585-8594
Space group: P 1 21/n 1
Cell volume: 2305.2
Cell parameters: 5.8411; 15.53; 25.512; 90; 95.069; 90;  

COD ID: 4032054
CIF file Formula: - C36 H32 Br2 N2 O2 -
Comments: Hu, Weiming; Yu, Jin-Tao; Ye, Dengman; Zhou, Zhou; Sun, Song; Cheng, Jiang Iron-Mediated Annulation between Methylene Ketones and Diethanolamines: A Sustainable and Scalable Procedure toward N-(2-Hydroxyethyl) Pyrroles. The Journal of organic chemistry 81(19) (2016) 9389-9395
Space group: P -1
Cell volume: 1581.2
Cell parameters: 9.022; 11.781; 15.387; 98.559; 101.929; 90.335;  

COD ID: 4032056
CIF file Formula: - C12 H11 N O3 -
Comments: Xuan, Zi; Jung, Da Jung; Jeon, Hyun Ji; Lee, Sang-Gi Pd-Catalyzed Aminocarbonylation of the Blaise Reaction Intermediate: One-Pot Synthesis of (Z)-3-Methyleneisoindolin-1-ones from Nitriles. The Journal of organic chemistry 81(20) (2016) 10094
Space group: P c a 21
Cell volume: 4355.47
Cell parameters: 15.8194; 7.2095; 38.1891; 90; 90; 90;  

COD ID: 4032059
CIF file Formula: - C23 H18 N2 O3 S -
Comments: Zheng, Yang; Zhang, Xiaolu; Yao, Ruwei; Wen, Yuecheng; Huang, Jingjing; Xu, Xinfang 1,3-Dipolar Cycloaddition of Alkyne-Tethered N-Tosylhydrazones: Synthesis of Fused Polycyclic Pyrazoles. The Journal of organic chemistry 81(22) (2016) 11072
Space group: P 1 21/c 1
Cell volume: 1888.6
Cell parameters: 7.5026; 20.3104; 12.4356; 90; 94.704; 90;  

COD ID: 4036366
CIF file Formula: - C27 H41 Cl N4 -
Comments: Belding, Lee; Stoyanov, Peter; Dudding, Travis Synthesis, Theoretical Analysis, and Experimental pKa Determination of a Fluorescent, Nonsymmetric, In-Out Proton Sponge. The Journal of organic chemistry 81(1) (2016) 6-13
Space group: C 1 2/c 1
Cell volume: 6383.5
Cell parameters: 33.592; 11.1346; 18.5547; 90; 113.102; 90;  

COD ID: 4036415
CIF file Formula: - C29 H26 N O2 P -
Comments: Zhang, Honglin; Gu, Zhangxi; Li, Zhenyi; Pan, Changduo; Li, Weipeng; Hu, Hongwen; Zhu, Chengjian Silver-Catalyzed Cascade Radical Cyclization: A Direct Approach to 3,4-Disubstituted Dihydroquinolin-2(1H)-ones through Activation of the P-H Bond and Functionalization of the C(sp(2))-H Bond. The Journal of organic chemistry 81(5) (2016) 2122-2127
Space group: P 1 21/c 1
Cell volume: 2376
Cell parameters: 16.157; 9.129; 16.109; 90; 90.44; 90;  

COD ID: 4036445
CIF file Formula: - C24 H18 F3 N O -
Comments: Liu, Kai; Chen, Shuang; Li, Xing Guang; Liu, Pei Nian Multicomponent Cascade Synthesis of Trifluoroethyl Isoquinolines from Alkynes and Vinyl Azides. The Journal of organic chemistry 81(1) (2016) 265-270
Space group: P 1 21/c 1
Cell volume: 3810.2
Cell parameters: 12.1351; 10.8659; 28.897; 90; 90.356; 90;  

COD ID: 4036462
CIF file Formula: - C22 H15 N O -
Comments: Miao, Chun-Bao; Zeng, Yu-Mei; Shi, Tong; Liu, Rui; Wei, Peng-Fei; Sun, Xiao-Qiang; Yang, Hai-Tao 2-Oxindole Acts as a Synthon of 2-Aminobenzoyl Anion in the K2CO3-Catalyzed Reaction with Enones: Preparation of 1,4-Diketones Bearing an Amino Group and Their Further Transformations. The Journal of organic chemistry 81(1) (2016) 43-50
Space group: P 1 21/c 1
Cell volume: 1628.1
Cell parameters: 12.326; 8.3378; 16.792; 90; 109.366; 90;  

COD ID: 4036463
CIF file Formula: - C23 H19 N O2 -
Comments: Miao, Chun-Bao; Zeng, Yu-Mei; Shi, Tong; Liu, Rui; Wei, Peng-Fei; Sun, Xiao-Qiang; Yang, Hai-Tao 2-Oxindole Acts as a Synthon of 2-Aminobenzoyl Anion in the K2CO3-Catalyzed Reaction with Enones: Preparation of 1,4-Diketones Bearing an Amino Group and Their Further Transformations. The Journal of organic chemistry 81(1) (2016) 43-50
Space group: P 1 21/n 1
Cell volume: 1798.5
Cell parameters: 10.4215; 13.6655; 13.0813; 90; 105.12; 90;  

COD ID: 4036464
CIF file Formula: - C24 H23 N O4 -
Comments: Miao, Chun-Bao; Zeng, Yu-Mei; Shi, Tong; Liu, Rui; Wei, Peng-Fei; Sun, Xiao-Qiang; Yang, Hai-Tao 2-Oxindole Acts as a Synthon of 2-Aminobenzoyl Anion in the K2CO3-Catalyzed Reaction with Enones: Preparation of 1,4-Diketones Bearing an Amino Group and Their Further Transformations. The Journal of organic chemistry 81(1) (2016) 43-50
Space group: P -1
Cell volume: 983.9
Cell parameters: 8.024; 9.535; 13.836; 87.961; 81.861; 69.892;  

COD ID: 4036480
CIF file Formula: - C23 H25 N4 O P S -
Comments: Mulla, Karimulla; Aleshire, Kyle L.; Forster, Paul M.; Kang, Jun Yong Utility of Bifunctional N-Heterocyclic Phosphine (NHP)-Thioureas for Metal-Free Carbon-Phosphorus Bond Construction toward Regio- and Stereoselective Formation of Vinylphosphonates. The Journal of organic chemistry 81(1) (2016) 77-88
Space group: P -1
Cell volume: 1093.5
Cell parameters: 6.3703; 12.1555; 15.503; 108.683; 98.291; 100.081;  

COD ID: 4036481
CIF file Formula: - C20 H23 N2 O3 P -
Comments: Mulla, Karimulla; Aleshire, Kyle L.; Forster, Paul M.; Kang, Jun Yong Utility of Bifunctional N-Heterocyclic Phosphine (NHP)-Thioureas for Metal-Free Carbon-Phosphorus Bond Construction toward Regio- and Stereoselective Formation of Vinylphosphonates. The Journal of organic chemistry 81(1) (2016) 77-88
Space group: P b c a
Cell volume: 3585.4
Cell parameters: 18.5763; 9.734; 19.8284; 90; 90; 90;  

COD ID: 4036490
CIF file Formula: - C29 H19 N O2 -
Comments: Fischer, Fabian; Siegle, Alexander F.; Checinski, Marek; Fischer, Christine; Kral, Karolin; Thede, Richard; Trapp, Oliver; Hapke, Marko Synthesis of Naphthylpyridines from Unsymmetrical Naphthylheptadiynes and the Configurational Stability of the Biaryl Axis. The Journal of organic chemistry 81(8) (2016) 3087-3102
Space group: P b c a
Cell volume: 4099.9
Cell parameters: 8.1798; 18.7387; 26.748; 90; 90; 90;  

COD ID: 4036506
CIF file Formula: - C18 H20 N2 O2 -
Comments: Mazzanti, Andrea; Chiarucci, Michel; Prati, Luca; Bentley, Keith W.; Wolf, Christian Computational and DNMR Analysis of the Conformational Isomers and Stereodynamics of Secondary 2,2'-Bisanilides. The Journal of organic chemistry 81(1) (2016) 89-99
Space group: P 21 21 21
Cell volume: 1598.51
Cell parameters: 6.7926; 14.0221; 16.7829; 90; 90; 90;  

COD ID: 4036507
CIF file Formula: - C16 H16 N2 O2 -
Comments: Mazzanti, Andrea; Chiarucci, Michel; Prati, Luca; Bentley, Keith W.; Wolf, Christian Computational and DNMR Analysis of the Conformational Isomers and Stereodynamics of Secondary 2,2'-Bisanilides. The Journal of organic chemistry 81(1) (2016) 89-99
Space group: P 1 21/n 1
Cell volume: 1440.73
Cell parameters: 9.7641; 8.7428; 17.2364; 90; 101.718; 90;  

COD ID: 4036508
CIF file Formula: - C16 H10 F6 N2 O2 -
Comments: Mazzanti, Andrea; Chiarucci, Michel; Prati, Luca; Bentley, Keith W.; Wolf, Christian Computational and DNMR Analysis of the Conformational Isomers and Stereodynamics of Secondary 2,2'-Bisanilides. The Journal of organic chemistry 81(1) (2016) 89-99
Space group: C 2 2 21
Cell volume: 3298.11
Cell parameters: 13.1234; 15.3338; 16.3896; 90; 90; 90;  

COD ID: 4036509
CIF file Formula: - C20 H24 N2 O2 -
Comments: Mazzanti, Andrea; Chiarucci, Michel; Prati, Luca; Bentley, Keith W.; Wolf, Christian Computational and DNMR Analysis of the Conformational Isomers and Stereodynamics of Secondary 2,2'-Bisanilides. The Journal of organic chemistry 81(1) (2016) 89-99
Space group: P n a 21
Cell volume: 3767
Cell parameters: 18.2405; 7.4669; 27.6578; 90; 90; 90;  

COD ID: 4036511
CIF file Formula: - C28 H30 N O5 P -
Comments: Vélez Del Burgo, Ander; Ochoa de Retana, Ana M.; de Los Santos, Jesús M; Palacios, Francisco Reaction of 2H-Azirine-Phosphine Oxides and -Phosphonates with Enolates Derived from β-Keto Esters. The Journal of organic chemistry 81(1) (2016) 100-108
Space group: P 1 21/n 1
Cell volume: 3068
Cell parameters: 9.554; 25.347; 12.978; 90; 102.53; 90;  

COD ID: 4036512
CIF file Formula: - C23 H24 N O3 P -
Comments: Vélez Del Burgo, Ander; Ochoa de Retana, Ana M.; de Los Santos, Jesús M; Palacios, Francisco Reaction of 2H-Azirine-Phosphine Oxides and -Phosphonates with Enolates Derived from β-Keto Esters. The Journal of organic chemistry 81(1) (2016) 100-108
Space group: P -1
Cell volume: 1067.3
Cell parameters: 8.587; 10.068; 13.25; 102.196; 101.982; 99.839;  

COD ID: 4036513
CIF file Formula: - C10 H9 Cl O3 -
Comments: Olomola, Temitope O.; Klein, Rosalyn; Caira, Mino R.; Kaye, Perry T. Elucidating Latent Mechanistic Complexity in Competing Acid-Catalyzed Reactions of Salicylaldehyde-Derived Baylis-Hillman Adducts. The Journal of organic chemistry 81(1) (2016) 109-120
Space group: P -1
Cell volume: 467.43
Cell parameters: 5.1208; 7.8498; 11.9863; 99.256; 91.114; 100.217;  

COD ID: 4036515
CIF file Formula: - C23 H20 Br N O -
Comments: Hirata, Tomoaki; Takahashi, Isao; Suzuki, Yuya; Yoshida, Hiroaki; Hasegawa, Hiroshi; Kitagawa, Osamu Catalytic Enantioselective Synthesis of N-C Axially Chiral Phenanthridin-6-one Derivatives. The Journal of organic chemistry 81(1) (2016) 318-323
Space group: P 1 21 1
Cell volume: 941
Cell parameters: 6.4683; 13.4256; 11.0713; 90; 101.845; 90;  

COD ID: 4036516
CIF file Formula: - C24 H30 O6 Rh S -
Comments: Zhao, Lili; Zhang, Hongyang; Wang, Yuanhua Dirhodium(II)-Catalyzed Sulfide Oxygenations: Catalyst Removal by Coprecipitation with Sulfoxides. The Journal of organic chemistry 81(1) (2016) 129-136
Space group: P 1 21/n 1
Cell volume: 2462.21
Cell parameters: 13.9681; 10.30952; 17.1108; 90; 92.2033; 90;  

COD ID: 4036517
CIF file Formula: - C32 H40 O8 Rh S2 -
Comments: Zhao, Lili; Zhang, Hongyang; Wang, Yuanhua Dirhodium(II)-Catalyzed Sulfide Oxygenations: Catalyst Removal by Coprecipitation with Sulfoxides. The Journal of organic chemistry 81(1) (2016) 129-136
Space group: P -1
Cell volume: 1615.5
Cell parameters: 11.4979; 11.639; 14.4566; 113.631; 98.7999; 106.77;  

COD ID: 4036518
CIF file Formula: - C15 H10 Br N3 O2 -
Comments: Šenica, Luka; Stopar, Karmen; Friedrich, Miha; Grošelj, Uroš; Plavec, Janez; Počkaj, Marta; Podlipnik, Črtomir; Štefane, Bogdan; Svete, Jurij Synthesis and Rotational Isomerism of 1-Substituted Methyl (S)-[5-(2-Nitrophenyl)-1H-pyrazole-4-carbonyl]alaninates. The Journal of organic chemistry 81(1) (2016) 146-161
Space group: P 1 21/c 1
Cell volume: 1463.39
Cell parameters: 12.5293; 15.6705; 7.8287; 90; 107.814; 90;  

COD ID: 4036519
CIF file Formula: - C17 H12 Cl N3 O4 -
Comments: Šenica, Luka; Stopar, Karmen; Friedrich, Miha; Grošelj, Uroš; Plavec, Janez; Počkaj, Marta; Podlipnik, Črtomir; Štefane, Bogdan; Svete, Jurij Synthesis and Rotational Isomerism of 1-Substituted Methyl (S)-[5-(2-Nitrophenyl)-1H-pyrazole-4-carbonyl]alaninates. The Journal of organic chemistry 81(1) (2016) 146-161
Space group: P 1 21/c 1
Cell volume: 1676.5
Cell parameters: 10.3978; 8.8539; 18.5649; 90; 101.21; 90;  

COD ID: 4036520
CIF file Formula: - C17 H10 Cl3 N3 O4 -
Comments: Šenica, Luka; Stopar, Karmen; Friedrich, Miha; Grošelj, Uroš; Plavec, Janez; Počkaj, Marta; Podlipnik, Črtomir; Štefane, Bogdan; Svete, Jurij Synthesis and Rotational Isomerism of 1-Substituted Methyl (S)-[5-(2-Nitrophenyl)-1H-pyrazole-4-carbonyl]alaninates. The Journal of organic chemistry 81(1) (2016) 146-161
Space group: P -1
Cell volume: 883.53
Cell parameters: 8.1048; 9.4611; 11.8699; 89.649; 83.896; 77.526;  

COD ID: 4036521
CIF file Formula: - C16 H10 N4 O2 -
Comments: Šenica, Luka; Stopar, Karmen; Friedrich, Miha; Grošelj, Uroš; Plavec, Janez; Počkaj, Marta; Podlipnik, Črtomir; Štefane, Bogdan; Svete, Jurij Synthesis and Rotational Isomerism of 1-Substituted Methyl (S)-[5-(2-Nitrophenyl)-1H-pyrazole-4-carbonyl]alaninates. The Journal of organic chemistry 81(1) (2016) 146-161
Space group: P -1
Cell volume: 716.93
Cell parameters: 7.9251; 8.593; 11.6468; 69.962; 74.221; 85.653;  

COD ID: 4036522
CIF file Formula: - C20 H18 Cl N3 O3 -
Comments: Šenica, Luka; Stopar, Karmen; Friedrich, Miha; Grošelj, Uroš; Plavec, Janez; Počkaj, Marta; Podlipnik, Črtomir; Štefane, Bogdan; Svete, Jurij Synthesis and Rotational Isomerism of 1-Substituted Methyl (S)-[5-(2-Nitrophenyl)-1H-pyrazole-4-carbonyl]alaninates. The Journal of organic chemistry 81(1) (2016) 146-161
Space group: P 1 21 1
Cell volume: 1980.57
Cell parameters: 9.8681; 19.3196; 11.1852; 90; 111.754; 90;  

COD ID: 4036523
CIF file Formula: - C50 H58 Cl4 O6 -
Comments: Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F. Synthesis of Substituted Trinaphthylenes. The Journal of organic chemistry 81(1) (2016) 193-196
Space group: P n m a
Cell volume: 4669.8
Cell parameters: 26.828; 21.29; 8.1758; 90; 90; 90;  

COD ID: 4036524
CIF file Formula: - C66 H90 O6 -
Comments: Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F. Synthesis of Substituted Trinaphthylenes. The Journal of organic chemistry 81(1) (2016) 193-196
Space group: P 1 21/n 1
Cell volume: 5826.9
Cell parameters: 25.7088; 8.779; 27.1747; 90; 108.187; 90;  

COD ID: 4036525
CIF file Formula: - C49 H56 Cl2 O6 -
Comments: Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F. Synthesis of Substituted Trinaphthylenes. The Journal of organic chemistry 81(1) (2016) 193-196
Space group: C 1 2/c 1
Cell volume: 4333.7
Cell parameters: 6.4102; 40.028; 16.89; 90; 90.352; 90;  

COD ID: 4036526
CIF file Formula: - C56 H70 Cl4 O6 -
Comments: Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F. Synthesis of Substituted Trinaphthylenes. The Journal of organic chemistry 81(1) (2016) 193-196
Space group: P -1
Cell volume: 2616.8
Cell parameters: 8.5192; 15.3684; 20.385; 87.9604; 82.649; 81.3905;  

COD ID: 4036527
CIF file Formula: - C39 H36 Cl6 O6 -
Comments: Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F. Synthesis of Substituted Trinaphthylenes. The Journal of organic chemistry 81(1) (2016) 193-196
Space group: C 1 2/c 1
Cell volume: 3795.4
Cell parameters: 16.483; 17.791; 12.945; 90; 91.095; 90;  

COD ID: 4036528
CIF file Formula: - C45 H48 Cl6 O6 -
Comments: Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F. Synthesis of Substituted Trinaphthylenes. The Journal of organic chemistry 81(1) (2016) 193-196
Space group: P -1
Cell volume: 2156.6
Cell parameters: 9.1337; 14.8366; 17.3737; 109.186; 97.454; 98.746;  

COD ID: 4036529
CIF file Formula: - C11 H10 Br F3 O6 S -
Comments: Horn, Evan J.; Silverston, Joel S.; Vanderwal, Christopher D. A Failed Late-Stage Epimerization Thwarts an Approach to Ineleganolide. The Journal of organic chemistry 81(5) (2016) 1819-1838
Space group: P 1 21/c 1
Cell volume: 1405.6
Cell parameters: 17.8748; 7.8647; 10.3954; 90; 105.882; 90;  

COD ID: 4036530
CIF file Formula: - C12 H18 O4 -
Comments: Horn, Evan J.; Silverston, Joel S.; Vanderwal, Christopher D. A Failed Late-Stage Epimerization Thwarts an Approach to Ineleganolide. The Journal of organic chemistry 81(5) (2016) 1819-1838
Space group: P c a 21
Cell volume: 1092.7
Cell parameters: 20.31; 7.868; 6.8379; 90; 90; 90;  

COD ID: 4036531
CIF file Formula: - C18 H11 F -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: P 1 21/c 1
Cell volume: 1142.1
Cell parameters: 9.604; 8.74; 13.695; 90; 96.535; 90;  

COD ID: 4036532
CIF file Formula: - C22 H14 -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: P c a 21
Cell volume: 1392.1
Cell parameters: 25.004; 9.417; 5.912; 90; 90; 90;  

COD ID: 4036533
CIF file Formula: - C18 H11 F -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: P 1 21 1
Cell volume: 1180.7
Cell parameters: 13.173; 5.8386; 15.894; 90; 105.009; 90;  

COD ID: 4036534
CIF file Formula: - C18 H11 F -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: P 21 21 21
Cell volume: 1171.72
Cell parameters: 5.7493; 13.9077; 14.6539; 90; 90; 90;  

COD ID: 4036535
CIF file Formula: - C22 H13 F -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: P 1 21 1
Cell volume: 711.1
Cell parameters: 9.2304; 5.3143; 14.9947; 90; 104.81; 90;  

COD ID: 4036536
CIF file Formula: - C22 H13 F -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: P b c a
Cell volume: 2771.8
Cell parameters: 12.0445; 7.3901; 31.14; 90; 90; 90;  

COD ID: 4036537
CIF file Formula: - C18 H12 -
Comments: Banerjee, Shaibal; Sinha, Saikat; Pradhan, Padmanava; Caruso, Alessio; Liebowitz, Daniel; Parrish, Damon; Rossi, Miriam; Zajc, Barbara Regiospecifically Fluorinated Polycyclic Aromatic Hydrocarbons via Julia-Kocienski Olefination and Oxidative Photocyclization. Effect of Fluorine Atom Substitution on Molecular Shape. The Journal of organic chemistry 81(10) (2016) 3983-3993
Space group: C 1 2/c 1
Cell volume: 1138
Cell parameters: 22.64; 6.163; 8.231; 90; 97.56; 90;  

COD ID: 4036538
CIF file Formula: - C23 H24 Br N O4 -
Comments: Miller, Ricarda; Carreras, Javier; Muratore, Michael E.; Gaydou, Morgane; Camponovo, Francesco; Echavarren, Antonio M. Broad Scope Aminocyclization of Enynes with Cationic JohnPhos-Gold(I) Complex as the Catalyst. The Journal of organic chemistry 81(5) (2016) 1839-1849
Space group: P -1
Cell volume: 1056.6
Cell parameters: 7.7964; 11.2871; 12.1556; 85.121; 86.964; 82.875;  

COD ID: 4036539
CIF file Formula: - C19 H24 Br N O4 -
Comments: Miller, Ricarda; Carreras, Javier; Muratore, Michael E.; Gaydou, Morgane; Camponovo, Francesco; Echavarren, Antonio M. Broad Scope Aminocyclization of Enynes with Cationic JohnPhos-Gold(I) Complex as the Catalyst. The Journal of organic chemistry 81(5) (2016) 1839-1849
Space group: P 1 21/c 1
Cell volume: 1878.5
Cell parameters: 10.8261; 13.3487; 13.767; 90; 109.233; 90;  

COD ID: 4036540
CIF file Formula: - C25 H23 F6 N O4 -
Comments: Miller, Ricarda; Carreras, Javier; Muratore, Michael E.; Gaydou, Morgane; Camponovo, Francesco; Echavarren, Antonio M. Broad Scope Aminocyclization of Enynes with Cationic JohnPhos-Gold(I) Complex as the Catalyst. The Journal of organic chemistry 81(5) (2016) 1839-1849
Space group: C 1 2/c 1
Cell volume: 4826.5
Cell parameters: 19.972; 16.8768; 14.6858; 90; 102.828; 90;  

COD ID: 4036541
CIF file Formula: - C12 H15 N3 O4 -
Comments: Miller, Ricarda; Carreras, Javier; Muratore, Michael E.; Gaydou, Morgane; Camponovo, Francesco; Echavarren, Antonio M. Broad Scope Aminocyclization of Enynes with Cationic JohnPhos-Gold(I) Complex as the Catalyst. The Journal of organic chemistry 81(5) (2016) 1839-1849
Space group: P 1 21/n 1
Cell volume: 1278.1
Cell parameters: 7.886; 16.68; 9.935; 90; 102.028; 90;  

COD ID: 4036542
CIF file Formula: - C21 H16 Cl F7 N4 O6 -
Comments: Luo, Qiang; Liu, Chunmei; Tong, Jingjing; Shao, Ying; Shan, Wenyu; Wang, Hanghang; Zheng, Hao; Cheng, Jiang; Wan, Xiaobing Cu-Catalyzed Multicomponent Reaction of Styrenes, Perfluoroalkyl Halide, Alcohol, and tert-Butyl Hydroperoxide: One-Pot Synthesis of (Z)-β-Alkoxyperfluoroalkenone. The Journal of organic chemistry 81(8) (2016) 3103-3111
Space group: P 1 21/c 1
Cell volume: 2378.3
Cell parameters: 13.1005; 15.4782; 11.8098; 90; 96.704; 90;  

COD ID: 4036543
CIF file Formula: - C21 H26 O4 -
Comments: Singh, Latika; Pressly, Brandon; Mengeling, Brenda J.; Fettinger, James C.; Furlow, J. David; Lein, Pamela J.; Wulff, Heike; Singh, Vikrant Chasing the Elusive Benzofuran Impurity of the THR Antagonist NH-3: Synthesis, Isotope Labeling, and Biological Activity. The Journal of organic chemistry 81(5) (2016) 1870-1876
Space group: P 1 21/n 1
Cell volume: 1872.25
Cell parameters: 12.8293; 7.2371; 20.234; 90; 94.7353; 90;  

COD ID: 4036544
CIF file Formula: - C29 H28 Cl3 N O6 -
Comments: Singh, Latika; Pressly, Brandon; Mengeling, Brenda J.; Fettinger, James C.; Furlow, J. David; Lein, Pamela J.; Wulff, Heike; Singh, Vikrant Chasing the Elusive Benzofuran Impurity of the THR Antagonist NH-3: Synthesis, Isotope Labeling, and Biological Activity. The Journal of organic chemistry 81(5) (2016) 1870-1876
Space group: C 1 2/c 1
Cell volume: 5646.56
Cell parameters: 40.9253; 5.5276; 24.9684; 90; 91.4288; 90;  

COD ID: 4036545
CIF file Formula: - C24 H40 N4 O6 S2 -
Comments: Martí-Centelles, Vicente; Burguete, M. Isabel; Luis, Santiago V. Macrocycle Synthesis by Chloride-Templated Amide Bond Formation. The Journal of organic chemistry 81(5) (2016) 2143-2147
Space group: P 1 21 1
Cell volume: 1475.55
Cell parameters: 9.61329; 9.54113; 16.1853; 90; 96.3113; 90;  

COD ID: 4036546
CIF file Formula: - C22 H20 Br N3 O4 -
Comments: Stucchi, Mattia; Lesma, Giordano; Meneghetti, Fiorella; Rainoldi, Giulia; Sacchetti, Alessandro; Silvani, Alessandra Organocatalytic Asymmetric Biginelli-like Reaction Involving Isatin. The Journal of organic chemistry 81(5) (2016) 1877-1884
Space group: P 1 21/a 1
Cell volume: 2075.52
Cell parameters: 12.5875; 11.6251; 15.0354; 90; 109.377; 90;  

COD ID: 4036547
CIF file Formula: - C38 H36 F6 N3 O6.5 S2 -
Comments: Coe, Benjamin J.; Rusanova, Daniela; Joshi, Vishwas D.; Sánchez, Sergio; Vávra, Jan; Khobragade, Dushant; Severa, Lukáš; Císařová, Ivana; Šaman, David; Pohl, Radek; Clays, Koen; Depotter, Griet; Brunschwig, Bruce S.; Teplý, Filip Helquat Dyes: Helicene-like Push-Pull Systems with Large Second-Order Nonlinear Optical Responses. The Journal of organic chemistry 81(5) (2016) 1912-1920
Space group: P 1
Cell volume: 1790.12
Cell parameters: 9.7985; 10.1396; 19.4403; 89.593; 83.894; 68.851;  

COD ID: 4036548
CIF file Formula: - C30 H29 F12 N3 P2 -
Comments: Coe, Benjamin J.; Rusanova, Daniela; Joshi, Vishwas D.; Sánchez, Sergio; Vávra, Jan; Khobragade, Dushant; Severa, Lukáš; Císařová, Ivana; Šaman, David; Pohl, Radek; Clays, Koen; Depotter, Griet; Brunschwig, Bruce S.; Teplý, Filip Helquat Dyes: Helicene-like Push-Pull Systems with Large Second-Order Nonlinear Optical Responses. The Journal of organic chemistry 81(5) (2016) 1912-1920
Space group: P 1 21/c 1
Cell volume: 3000
Cell parameters: 8.385; 23.46; 15.353; 90; 96.621; 90;  

COD ID: 4036549
CIF file Formula: - C17 H20 F N3 O5 S -
Comments: Wu, Yong-Jin; Guernon, Jason; Park, Hyunsoo; Thompson, Lorin A. Expedient Synthesis of Furo[2,3-d][1,3]thiazinamines and Pyrano[2,3-d][1,3]thiazinamines from Enones and Thiourea. The Journal of organic chemistry 81(8) (2016) 3386-3390
Space group: P 21 21 21
Cell volume: 1874.03
Cell parameters: 5.8866; 8.325; 38.2408; 90; 90; 90;  

COD ID: 4036550
CIF file Formula: - C17 H20 F N3 O5 S -
Comments: Wu, Yong-Jin; Guernon, Jason; Park, Hyunsoo; Thompson, Lorin A. Expedient Synthesis of Furo[2,3-d][1,3]thiazinamines and Pyrano[2,3-d][1,3]thiazinamines from Enones and Thiourea. The Journal of organic chemistry 81(8) (2016) 3386-3390
Space group: P 21 21 21
Cell volume: 1874.94
Cell parameters: 5.8864; 8.3268; 38.2524; 90; 90; 90;  

COD ID: 4036551
CIF file Formula: - C33 H19 B N6 O -
Comments: Gotfredsen, Henrik; Jevric, Martyn; Broman, Søren L; Petersen, Anne U.; Nielsen, Mogens Brøndsted Aluminum Chloride Mediated Alkynylation of Boron Subphthalocyanine Chloride Using Trimethylsilyl-Capped Acetylenes. The Journal of organic chemistry 81(1) (2016) 1-5
Space group: P -1
Cell volume: 1270.79
Cell parameters: 9.8803; 10.8574; 12.6802; 82.68; 70.815; 83.638;  

COD ID: 4036552
CIF file Formula: - C41 H29 B Fe N6 Si -
Comments: Gotfredsen, Henrik; Jevric, Martyn; Broman, Søren L; Petersen, Anne U.; Nielsen, Mogens Brøndsted Aluminum Chloride Mediated Alkynylation of Boron Subphthalocyanine Chloride Using Trimethylsilyl-Capped Acetylenes. The Journal of organic chemistry 81(1) (2016) 1-5
Space group: P -1
Cell volume: 1719.4
Cell parameters: 8.0159; 12.6153; 17.649; 91.609; 94.08; 104.775;  

COD ID: 4036553
CIF file Formula: - C50 H38 B N7 -
Comments: Gotfredsen, Henrik; Jevric, Martyn; Broman, Søren L; Petersen, Anne U.; Nielsen, Mogens Brøndsted Aluminum Chloride Mediated Alkynylation of Boron Subphthalocyanine Chloride Using Trimethylsilyl-Capped Acetylenes. The Journal of organic chemistry 81(1) (2016) 1-5
Space group: P -1
Cell volume: 1919.8
Cell parameters: 11.5499; 13.613; 13.749; 72.403; 68.708; 83.03;  

COD ID: 4036554
CIF file Formula: - C34 H21 B Fe N6 -
Comments: Gotfredsen, Henrik; Jevric, Martyn; Broman, Søren L; Petersen, Anne U.; Nielsen, Mogens Brøndsted Aluminum Chloride Mediated Alkynylation of Boron Subphthalocyanine Chloride Using Trimethylsilyl-Capped Acetylenes. The Journal of organic chemistry 81(1) (2016) 1-5
Space group: P -1
Cell volume: 1280.1
Cell parameters: 10.052; 11.868; 12.406; 103.051; 105.779; 107.469;  

COD ID: 4036555
CIF file Formula: - C25 H32 O3 -
Comments: Zhang, Xiang-Zhi; Du, Ji-Yuan; Deng, Yu-Hua; Chu, Wen-Dao; Yan, Xu; Yu, Ke-Yin; Fan, Chun-An Spirocyclopropanation Reaction of para-Quinone Methides with Sulfonium Salts: The Synthesis of Spirocyclopropanyl para-Dienones. The Journal of organic chemistry 81(6) (2016) 2598-2606
Space group: P 1 21/n 1
Cell volume: 2296.8
Cell parameters: 12.4475; 10.8201; 17.2007; 90; 97.504; 90;  

COD ID: 4036556
CIF file Formula: - C25 H34 O4 -
Comments: Zhang, Xiang-Zhi; Du, Ji-Yuan; Deng, Yu-Hua; Chu, Wen-Dao; Yan, Xu; Yu, Ke-Yin; Fan, Chun-An Spirocyclopropanation Reaction of para-Quinone Methides with Sulfonium Salts: The Synthesis of Spirocyclopropanyl para-Dienones. The Journal of organic chemistry 81(6) (2016) 2598-2606
Space group: P 1 21/c 1
Cell volume: 2347.7
Cell parameters: 10.4772; 37.395; 6.0408; 90; 97.275; 90;  

COD ID: 4036557
CIF file Formula: - C26 H36 O4 -
Comments: Zhang, Xiang-Zhi; Du, Ji-Yuan; Deng, Yu-Hua; Chu, Wen-Dao; Yan, Xu; Yu, Ke-Yin; Fan, Chun-An Spirocyclopropanation Reaction of para-Quinone Methides with Sulfonium Salts: The Synthesis of Spirocyclopropanyl para-Dienones. The Journal of organic chemistry 81(6) (2016) 2598-2606
Space group: P 1 21/c 1
Cell volume: 2460.24
Cell parameters: 10.239; 19.3276; 12.6233; 90; 99.987; 90;  

COD ID: 4036558
CIF file Formula: - C21 H18 O3 -
Comments: Zhang, Xiang-Zhi; Du, Ji-Yuan; Deng, Yu-Hua; Chu, Wen-Dao; Yan, Xu; Yu, Ke-Yin; Fan, Chun-An Spirocyclopropanation Reaction of para-Quinone Methides with Sulfonium Salts: The Synthesis of Spirocyclopropanyl para-Dienones. The Journal of organic chemistry 81(6) (2016) 2598-2606
Space group: P -1
Cell volume: 1691.3
Cell parameters: 9.0267; 11.728; 17.0697; 94.502; 93.203; 109.533;  

COD ID: 4036559
CIF file Formula: - C16 H19 N O5 -
Comments: Choe, Hyeonjeong; Pham, Thuy Trang; Lee, Joo Yun; Latif, Muhammad; Park, Haeil; Kang, Young Kee; Lee, Jongkook Remote Stereoinductive Intramolecular Nitrile Oxide Cycloaddition: Asymmetric Total Synthesis and Structure Revision of (-)-11β-Hydroxycurvularin. The Journal of organic chemistry 81(6) (2016) 2612-2617
Space group: P 1 21 1
Cell volume: 727.88
Cell parameters: 7.2483; 7.3559; 13.6601; 90; 92.012; 90;  

COD ID: 4036560
CIF file Formula: - C28 H38 O5 Si -
Comments: Essig, Sebastian; Menche, Dirk Stereoselective Synthesis of Isochromanones by an Asymmetric Ortho-Lithiation Strategy: Synthetic Access to the Isochromanone Core of the Ajudazols. The Journal of organic chemistry 81(5) (2016) 1943-1966
Space group: P -1
Cell volume: 1383.8
Cell parameters: 7.5558; 13.3993; 14.2195; 83.276; 80.259; 78.211;  

COD ID: 4036561
CIF file Formula: - C32 H59 N O4 Si2 -
Comments: Essig, Sebastian; Menche, Dirk Stereoselective Synthesis of Isochromanones by an Asymmetric Ortho-Lithiation Strategy: Synthetic Access to the Isochromanone Core of the Ajudazols. The Journal of organic chemistry 81(5) (2016) 1943-1966
Space group: P 21 21 21
Cell volume: 3623
Cell parameters: 11.406; 13.239; 23.993; 90; 90; 90;  

COD ID: 4036562
CIF file Formula: - C29 H52 N O4 Si -
Comments: Essig, Sebastian; Menche, Dirk Stereoselective Synthesis of Isochromanones by an Asymmetric Ortho-Lithiation Strategy: Synthetic Access to the Isochromanone Core of the Ajudazols. The Journal of organic chemistry 81(5) (2016) 1943-1966
Space group: P 21 21 21
Cell volume: 6519.2
Cell parameters: 11.4204; 17.2635; 33.066; 90; 90; 90;  

COD ID: 4036563
CIF file Formula: - C26 H44 O4 Si2 -
Comments: Essig, Sebastian; Menche, Dirk Stereoselective Synthesis of Isochromanones by an Asymmetric Ortho-Lithiation Strategy: Synthetic Access to the Isochromanone Core of the Ajudazols. The Journal of organic chemistry 81(5) (2016) 1943-1966
Space group: P 1 21 1
Cell volume: 6028.7
Cell parameters: 14.6819; 27.0915; 15.1614; 90; 91.392; 90;  

COD ID: 4036564
CIF file Formula: - C26 H42 N O4 -
Comments: Essig, Sebastian; Menche, Dirk Stereoselective Synthesis of Isochromanones by an Asymmetric Ortho-Lithiation Strategy: Synthetic Access to the Isochromanone Core of the Ajudazols. The Journal of organic chemistry 81(5) (2016) 1943-1966
Space group: P 41 21 2
Cell volume: 5512
Cell parameters: 15.6; 15.6; 22.648; 90; 90; 90;  

COD ID: 4036565
CIF file Formula: - C19 H14 Br F3 O4 S -
Comments: Saulnier, Steve; Golovanov, Alexander A.; Ivanov, Alexandr Yu; Boyarskaya, Irina A.; Vasilyev, Aleksander V. Transformations of Conjugated Enynones in the Superacid CF3SO3H. Synthesis of Butadienyl Triflates, Indanones, and Indenes. The Journal of organic chemistry 81(5) (2016) 1967-1980
Space group: P -1
Cell volume: 937.11
Cell parameters: 8.4568; 8.586; 13.1824; 99.649; 94.116; 94.563;  

COD ID: 4036566
CIF file Formula: - C18 H16 O3 -
Comments: Saulnier, Steve; Golovanov, Alexander A.; Ivanov, Alexandr Yu; Boyarskaya, Irina A.; Vasilyev, Aleksander V. Transformations of Conjugated Enynones in the Superacid CF3SO3H. Synthesis of Butadienyl Triflates, Indanones, and Indenes. The Journal of organic chemistry 81(5) (2016) 1967-1980
Space group: P 1 21/c 1
Cell volume: 1372.6
Cell parameters: 17.2307; 5.43162; 14.8169; 90; 98.184; 90;  

COD ID: 4036567
CIF file Formula: - C17 H13 Cl O2 -
Comments: Saulnier, Steve; Golovanov, Alexander A.; Ivanov, Alexandr Yu; Boyarskaya, Irina A.; Vasilyev, Aleksander V. Transformations of Conjugated Enynones in the Superacid CF3SO3H. Synthesis of Butadienyl Triflates, Indanones, and Indenes. The Journal of organic chemistry 81(5) (2016) 1967-1980
Space group: P 1 21/c 1
Cell volume: 1341.28
Cell parameters: 14.3087; 7.3431; 14.219; 90; 116.132; 90;  

COD ID: 4036568
CIF file Formula: - C18 H12 Cl F3 O4 S -
Comments: Saulnier, Steve; Golovanov, Alexander A.; Ivanov, Alexandr Yu; Boyarskaya, Irina A.; Vasilyev, Aleksander V. Transformations of Conjugated Enynones in the Superacid CF3SO3H. Synthesis of Butadienyl Triflates, Indanones, and Indenes. The Journal of organic chemistry 81(5) (2016) 1967-1980
Space group: P 1 21/c 1
Cell volume: 1795.5
Cell parameters: 20.6536; 8.4595; 10.5343; 90; 102.696; 90;  

COD ID: 4036569
CIF file Formula: - C21 H36 N O6 P -
Comments: Audran, Gérard; Brémond, Paul; Marque, Sylvain R. A.; Yamasaki, Toshihide C-ON Bond Homolysis of Alkoxyamines, Part 11: Activation of the Nitroxyl Fragment. The Journal of organic chemistry 81(5) (2016) 1981-1988
Space group: P 1 21 1
Cell volume: 1225.59
Cell parameters: 8.3281; 15.4335; 10.2295; 90; 111.229; 90;  

COD ID: 4036570
CIF file Formula: - C21 H36 N O6 P -
Comments: Audran, Gérard; Brémond, Paul; Marque, Sylvain R. A.; Yamasaki, Toshihide C-ON Bond Homolysis of Alkoxyamines, Part 11: Activation of the Nitroxyl Fragment. The Journal of organic chemistry 81(5) (2016) 1981-1988
Space group: P 1 21/n 1
Cell volume: 2407.18
Cell parameters: 15.9524; 8.81848; 17.6457; 90; 104.134; 90;  

COD ID: 4036571
CIF file Formula: - C21 H36 N O5 P -
Comments: Audran, Gérard; Brémond, Paul; Marque, Sylvain R. A.; Yamasaki, Toshihide C-ON Bond Homolysis of Alkoxyamines, Part 11: Activation of the Nitroxyl Fragment. The Journal of organic chemistry 81(5) (2016) 1981-1988
Space group: P 1 21/n 1
Cell volume: 2425.4
Cell parameters: 9.0756; 16.0249; 16.9442; 90; 100.193; 90;  

COD ID: 4036572
CIF file Formula: - C21 H38 N O5 P -
Comments: Audran, Gérard; Brémond, Paul; Marque, Sylvain R. A.; Yamasaki, Toshihide C-ON Bond Homolysis of Alkoxyamines, Part 11: Activation of the Nitroxyl Fragment. The Journal of organic chemistry 81(5) (2016) 1981-1988
Space group: P 1 21/c 1
Cell volume: 2401.2
Cell parameters: 14.2019; 12.1086; 14.2955; 90; 102.371; 90;  

COD ID: 4036573
CIF file Formula: - C26 H22 Br2 O2 -
Comments: Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions. The Journal of organic chemistry 81(6) (2016) 2308-2319
Space group: C 1 2/c 1
Cell volume: 4184.3
Cell parameters: 17.7101; 6.3887; 37.13; 90; 95.118; 90;  


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