Crystallography Open Database

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Searching journal of publication like 'The Journal of organic chemistry' volume of publication is 85

COD ID: 4037628
CIF file Formula: - C91 H105.5 Cl1.5 N8 Si4 -
Comments: Zhao, Kexiang; Long, Guankui; Liu, Wenbo; Li, Dong-Sheng; Gao, Weibo; Zhang, Qichun U-Shaped Helical Azaarenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 85(1) (2020) 291-295
Space group: P -1
Cell volume: 4169.9
Cell parameters: 12.6965; 17.3542; 19.577; 78.42; 87.087; 80.742;  

COD ID: 4037629
CIF file Formula: - C78 H98 N4 Si4 -
Comments: Zhao, Kexiang; Long, Guankui; Liu, Wenbo; Li, Dong-Sheng; Gao, Weibo; Zhang, Qichun U-Shaped Helical Azaarenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 85(1) (2020) 291-295
Space group: P -1
Cell volume: 3619.9
Cell parameters: 15.2399; 16.3922; 17.7725; 101.974; 113.986; 106.368;  

COD ID: 4037630
CIF file Formula: - C70 H94 N4 Si4 -
Comments: Zhao, Kexiang; Long, Guankui; Liu, Wenbo; Li, Dong-Sheng; Gao, Weibo; Zhang, Qichun U-Shaped Helical Azaarenes: Synthesis, Structures, and Properties. The Journal of organic chemistry 85(1) (2020) 291-295
Space group: P 1 21/c 1
Cell volume: 6607.4
Cell parameters: 12.4305; 25.215; 21.1193; 90; 93.47; 90;  

COD ID: 4037717
CIF file Formula: - C143 H121 Cl2 O13 -
Comments: Nejedlý, Jindřich; Šámal, Michal; Rybáček, Jiří; Sánchez, Isabel Gay; Houska, Václav; Warzecha, Tomáš; Vacek, Jaroslav; Sieger, Ladislav; Buděšínský, Miloš; Bednárová, Lucie; Fiedler, Pavel; Císařová, Ivana; Starý, Ivo; Stará, Irena G Synthesis of Racemic, Diastereopure, and Enantiopure Carba- or Oxa[5]-, [6]-, [7]-, and -[19]helicene (Di)thiol Derivatives. The Journal of organic chemistry 85(1) (2020) 248-276
Space group: P 1 21 1
Cell volume: 5730
Cell parameters: 13.575; 20.2391; 20.8569; 90; 90.607; 90;  

COD ID: 4037718
CIF file Formula: - C26 H18 O2 S2 -
Comments: Nejedlý, Jindřich; Šámal, Michal; Rybáček, Jiří; Sánchez, Isabel Gay; Houska, Václav; Warzecha, Tomáš; Vacek, Jaroslav; Sieger, Ladislav; Buděšínský, Miloš; Bednárová, Lucie; Fiedler, Pavel; Císařová, Ivana; Starý, Ivo; Stará, Irena G Synthesis of Racemic, Diastereopure, and Enantiopure Carba- or Oxa[5]-, [6]-, [7]-, and -[19]helicene (Di)thiol Derivatives. The Journal of organic chemistry 85(1) (2020) 248-276
Space group: P 1 21/c 1
Cell volume: 4140.7
Cell parameters: 21.4937; 9.3227; 21.3572; 90; 104.637; 90;  

COD ID: 4038011
CIF file Formula: - C51 H68 Cl3 N O8 -
Comments: Smith, Jordan N.; Brind, Thomasin K.; Petrie, Simon B.; Grant, Mikaela S.; Lucas, Nigel T. One-Step Synthesis of <i>C</i><sub>2v</sub>-Symmetric Resorcin[4]arene Tetraethers. The Journal of organic chemistry 85(6) (2020) 4574-4580
Space group: P -1
Cell volume: 2561.5
Cell parameters: 10.0957; 16.5247; 16.6164; 73.814; 74.718; 89.583;  

COD ID: 4038012
CIF file Formula: - C60.5 H90 O8.5 -
Comments: Smith, Jordan N.; Brind, Thomasin K.; Petrie, Simon B.; Grant, Mikaela S.; Lucas, Nigel T. One-Step Synthesis of <i>C</i><sub>2v</sub>-Symmetric Resorcin[4]arene Tetraethers. The Journal of organic chemistry 85(6) (2020) 4574-4580
Space group: P -1
Cell volume: 5539.7
Cell parameters: 15.8596; 18.1191; 20.983; 101.411; 95.612; 107.98;  

COD ID: 4038013
CIF file Formula: - C78 H121 Br2 Cl5 O8 -
Comments: Smith, Jordan N.; Brind, Thomasin K.; Petrie, Simon B.; Grant, Mikaela S.; Lucas, Nigel T. One-Step Synthesis of <i>C</i><sub>2v</sub>-Symmetric Resorcin[4]arene Tetraethers. The Journal of organic chemistry 85(6) (2020) 4574-4580
Space group: P -1
Cell volume: 3935.5
Cell parameters: 11.605; 17.8076; 20.157; 83.974; 77.65; 75.603;  

COD ID: 4038014
CIF file Formula: - C56 H72 O8 -
Comments: Smith, Jordan N.; Brind, Thomasin K.; Petrie, Simon B.; Grant, Mikaela S.; Lucas, Nigel T. One-Step Synthesis of <i>C</i><sub>2v</sub>-Symmetric Resorcin[4]arene Tetraethers. The Journal of organic chemistry 85(6) (2020) 4574-4580
Space group: P 1 21/m 1
Cell volume: 2972.94
Cell parameters: 12.5156; 18.1763; 13.11; 90; 94.555; 90;  

COD ID: 4038018
CIF file Formula: - C21 H13 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 1424.55
Cell parameters: 12.2331; 8.2123; 14.7327; 90; 105.743; 90;  

COD ID: 4038019
CIF file Formula: - C21 H13 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/n 1
Cell volume: 1362.4
Cell parameters: 13.1743; 8.2226; 13.5; 90; 111.313; 90;  

COD ID: 4038020
CIF file Formula: - C21 H13 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/n 1
Cell volume: 1392
Cell parameters: 13.194; 8.3516; 13.506; 90; 110.722; 90;  

COD ID: 4038021
CIF file Formula: - C21 H13 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 1391.1
Cell parameters: 4.623; 22.358; 13.545; 90; 96.486; 90;  

COD ID: 4038022
CIF file Formula: - C21 H13 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 4047.4
Cell parameters: 17.0774; 3.9635; 59.803; 90; 90.802; 90;  

COD ID: 4038023
CIF file Formula: - C13 H8 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 872.79
Cell parameters: 9.3677; 8.1391; 11.6155; 90; 99.766; 90;  

COD ID: 4038024
CIF file Formula: - C13 H8 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 842.84
Cell parameters: 11.0286; 5.467; 13.9855; 90; 91.742; 90;  

COD ID: 4038025
CIF file Formula: - C26 H16 N2 -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 837.8
Cell parameters: 10.979; 5.4664; 13.966; 90; 91.652; 90;  

COD ID: 4038026
CIF file Formula: - C26 H16 N2 -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/n 1
Cell volume: 840.1
Cell parameters: 3.7918; 9.006; 24.601; 90; 90.484; 90;  

COD ID: 4038027
CIF file Formula: - C13 H8 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/n 1
Cell volume: 872.8
Cell parameters: 5.589; 20.882; 7.697; 90; 103.696; 90;  

COD ID: 4038028
CIF file Formula: - C13 H8 N -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: C 1 2/c 1
Cell volume: 1719.5
Cell parameters: 12.53; 10.289; 13.803; 90; 104.918; 90;  

COD ID: 4038029
CIF file Formula: - C26 H16 N2 -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 3525.2
Cell parameters: 12.2463; 30.2305; 9.5734; 90; 95.933; 90;  

COD ID: 4038030
CIF file Formula: - C26 H16 N2 -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P 1 21/c 1
Cell volume: 3596.5
Cell parameters: 12.305; 30.386; 9.6833; 90; 96.608; 90;  

COD ID: 4038031
CIF file Formula: - C34 H32 N2 -
Comments: Lu, Qing; Kole, Goutam Kumar; Friedrich, Alexandra; Müller-Buschbaum, Klaus; Liu, Zhiqiang; Yu, Xiaoqiang; Marder, Todd B. Comparison Study of the Site-Effect on Regioisomeric Pyridyl-Pyrene Conjugates: Synthesis, Structures, and Photophysical Properties. The Journal of organic chemistry 85(6) (2020) 4256-4266
Space group: P -1
Cell volume: 1273.6
Cell parameters: 9.6837; 12.097; 12.2653; 89.133; 66.936; 75.404;  

COD ID: 4038035
CIF file Formula: - C8 H13 N O4 -
Comments: Hocine, Sofiane; Berger, Gilles; Hanessian, Stephen Design and Synthesis of Backbone-Fused, Conformationally Constrained Morpholine-Proline Chimeras. The Journal of organic chemistry 85(6) (2020) 4237-4247
Space group: P 21 21 21
Cell volume: 811.4
Cell parameters: 5.312; 11.535; 13.242; 90; 90; 90;  

COD ID: 4038038
CIF file Formula: - C20 H26 O2 -
Comments: Igawa, Kazunobu; Kawasaki, Yuuya; Nozaki, Sora; Kokan, Naoto; Tomooka, Katsuhiko Ozone Oxidation of Silylalkene: Mechanistic Study and Application for the Synthesis of Silacarboxylic Acid Derivatives. The Journal of organic chemistry 85(6) (2020) 4165-4171
Space group: P 1 21/n 1
Cell volume: 1703.6
Cell parameters: 4.8245; 13.1695; 26.813; 90; 90.043; 90;  

COD ID: 4038046
CIF file Formula: - C12 H2 F2 N4 -
Comments: Liu, En-Chih; Topczewski, Joseph J. Gram-Scale Synthesis of 2,5-Difluoro-7,7,8,8-tetracyanoquinodimethane (F<sub>2</sub>-TCNQ). The Journal of organic chemistry 85(6) (2020) 4560-4564
Space group: C 1 2/m 1
Cell volume: 497.8
Cell parameters: 10.122; 5.827; 8.812; 90; 106.72; 90;  

COD ID: 4038047
CIF file Formula: - C9 H12 F N O2 S -
Comments: Emenike, Bright U.; Dhami, Simran S. Determining the Ionization Constants of Organic Acids Using Fluorine Gauche Effects. The Journal of organic chemistry 85(7) (2020) 4896-4900
Space group: P 1 21/n 1
Cell volume: 986.57
Cell parameters: 5.8237; 8.8525; 19.1618; 90; 92.943; 90;  

COD ID: 4038052
CIF file Formula: - C20 H15 Cl N3 -
Comments: Wang, Jingdong; Liu, Yuxin; Wei, Zhonglin; Cao, Jungang; Liang, Dapeng; Lin, Yingjie; Duan, Haifeng Synthesis of 4-Azaindolines Using Phase-Transfer Catalysis via an Intramolecular Mannich Reaction. The Journal of organic chemistry 85(6) (2020) 4047-4057
Space group: P 1 21 1
Cell volume: 2541.3
Cell parameters: 9.2518; 13.2729; 20.695; 90; 90.325; 90;  

COD ID: 4038053
CIF file Formula: - C17 H13 F3 N2 O2 S -
Comments: Wang, Wei; Xiong, Wenhui; Wang, Jinping; Wang, Qiu-An; Yang, Wen Brønsted Acid-Catalyzed Asymmetric Friedel-Crafts Alkylation of Indoles with Benzothiazole-Bearing Trifluoromethyl Ketone Hydrates. The Journal of organic chemistry 85(6) (2020) 4398-4407
Space group: P 21 21 21
Cell volume: 1531
Cell parameters: 7.532; 9.197; 22.1; 90; 90; 90;  

COD ID: 4038055
CIF file Formula: - C18 H14 F0 N2 O0 -
Comments: Jia, Chunqi; Wu, Nini; Cai, Xiaofeng; Li, Gang; Zhong, Lei; Zou, Lei; Cui, Xiuling Ruthenium-Catalyzed <i>meta</i>-Selective C<sub>Ar</sub>-H Bond Formylation of Arenes. The Journal of organic chemistry 85(6) (2020) 4536-4542
Space group: P 1 21/c 1
Cell volume: 1357.3
Cell parameters: 16.003; 7.6071; 11.779; 90; 108.82; 90;  

COD ID: 4038056
CIF file Formula: - C26 H15 F O -
Comments: Hoenig, Samuel M.; Yan, Youmian; Dougherty, Emily A.; Hudson, Reuben; Petovic, Sava; Lee, Christopher K.; Hu, Yusheng; Gomez, Lucas S.; Katz, Jeffrey L. Convergent Strategy for the Synthesis of Oxa-, Thia-, and Selena[5]helicenes by Acetylene-Activated S<sub>N</sub>Ar Reactions. The Journal of organic chemistry 85(6) (2020) 4553-4559
Space group: P n a 21
Cell volume: 1747.2
Cell parameters: 7.789; 10.907; 20.566; 90; 90; 90;  

COD ID: 4038057
CIF file Formula: - C26 H15 F S -
Comments: Hoenig, Samuel M.; Yan, Youmian; Dougherty, Emily A.; Hudson, Reuben; Petovic, Sava; Lee, Christopher K.; Hu, Yusheng; Gomez, Lucas S.; Katz, Jeffrey L. Convergent Strategy for the Synthesis of Oxa-, Thia-, and Selena[5]helicenes by Acetylene-Activated S<sub>N</sub>Ar Reactions. The Journal of organic chemistry 85(6) (2020) 4553-4559
Space group: P 1 21/c 1
Cell volume: 1818.8
Cell parameters: 12.8863; 18.6245; 7.636; 90; 97.048; 90;  

COD ID: 4038061
CIF file Formula: - C19 H23 N7 O2 S -
Comments: Zaķis, Ja Nis Miķelis; Ozols, Kristers; Novosjolova, Irina; Vilšķe Rsts, Reinis; Mishnev, Anatoly; Turks, Ma Ris Sulfonyl Group Dance: A Tool for the Synthesis of 6-Azido-2-sulfonylpurine Derivatives. The Journal of organic chemistry 85(7) (2020) 4753-4771
Space group: P n a 21
Cell volume: 4102.59
Cell parameters: 16.5513; 9.6657; 25.6444; 90; 90; 90;  

COD ID: 4038062
CIF file Formula: - C18 H21 Cl N4 O2 S -
Comments: Zaķis, Ja Nis Miķelis; Ozols, Kristers; Novosjolova, Irina; Vilšķe Rsts, Reinis; Mishnev, Anatoly; Turks, Ma Ris Sulfonyl Group Dance: A Tool for the Synthesis of 6-Azido-2-sulfonylpurine Derivatives. The Journal of organic chemistry 85(7) (2020) 4753-4771
Space group: P -1
Cell volume: 926.32
Cell parameters: 6.2963; 12.2014; 12.3922; 89.249; 79.699; 81.512;  

COD ID: 4038063
CIF file Formula: - C34 H35 F6 N7 O12 -
Comments: Niedbała, Patryk; Majdecki, Maciej; Dąbrowa, Kajetan; Jurczak, Janusz Selective Carboxylate Recognition Using Urea-Functionalized Unclosed Cryptands: Mild Synthesis and Complexation Studies. The Journal of organic chemistry 85(7) (2020) 5058-5064
Space group: P 1 21/n 1
Cell volume: 3863.9
Cell parameters: 17.907; 9.0483; 25.336; 90; 109.74; 90;  

COD ID: 4038064
CIF file Formula: - C22 H22 Br N5 -
Comments: Kour, Jaspreet; Venkateswarlu, Vunnam; Verma, Praveen K.; Hussain, Yaseen; Dubey, Gurudutt; Bharatam, Prasad V.; Sahoo, Subash C.; Sawant, Sanghapal D. Oxone-DMSO Triggered Methylene Insertion and C(sp<sup>2</sup>)-C(sp<sup>3</sup>)-H-C(sp<sup>2</sup>) Bond Formation to Access Functional Bis-Heterocycles. The Journal of organic chemistry 85(7) (2020) 4951-4962
Space group: P 1 21/n 1
Cell volume: 1999.32
Cell parameters: 5.7052; 48.2715; 7.5578; 90; 106.145; 90;  

COD ID: 4038066
CIF file Formula: - C17 H20 O6 -
Comments: Zang, Yi; Gong, Yihua; Gong, Jiaojiao; Liu, Junjun; Chen, Chunmei; Gu, Lianghu; Zhou, Yuan; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui Fungal Polyketides with Three Distinctive Ring Skeletons from the Fungus <i>Penicillium canescens</i> Uncovered by OSMAC and Molecular Networking Strategies. The Journal of organic chemistry 85(7) (2020) 4973-4980
Space group: P 1 21 1
Cell volume: 786.662
Cell parameters: 8.26368; 7.69518; 12.43341; 90; 95.7545; 90;  

COD ID: 4038067
CIF file Formula: - C20 H23 O13 -
Comments: Zang, Yi; Gong, Yihua; Gong, Jiaojiao; Liu, Junjun; Chen, Chunmei; Gu, Lianghu; Zhou, Yuan; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui Fungal Polyketides with Three Distinctive Ring Skeletons from the Fungus <i>Penicillium canescens</i> Uncovered by OSMAC and Molecular Networking Strategies. The Journal of organic chemistry 85(7) (2020) 4973-4980
Space group: C 1 2/c 1
Cell volume: 4700.53
Cell parameters: 31.4966; 12.8222; 12.3149; 90; 109.069; 90;  

COD ID: 4038069
CIF file Formula: - C18 H17 N3 O2 -
Comments: Bhujanga Rao, Chitturi; Zhang, Ning; Hu, Jiana; Wang, Yu; Liang, Yongjiu; Zhang, Rui; Yuan, Jingwen; Dong, Dewen Tf<sub>2</sub>O-Mediated Cyclization of α-Acyl-β-(2-aminopyridinyl)acrylamides: Access to N-Substituted 4<i>H</i>-Pyrido[1,2-<i>a</i>]pyrimidin-4-imines. The Journal of organic chemistry 85(7) (2020) 4695-4705
Space group: P b c a
Cell volume: 3022.15
Cell parameters: 13.2254; 7.5242; 30.3701; 90; 90; 90;  

COD ID: 4038070
CIF file Formula: - C27 H25 F N4 O2 S -
Comments: De, Pinaki Bhusan; Atta, Sayan; Pradhan, Sourav; Banerjee, Sonbidya; Shah, Tariq A.; Punniyamurthy, Tharmalingam Cp*Co(III)-Catalyzed C-7 C-C Coupling of Indolines with Aziridines: Merging C-H Activation and Ring Opening. The Journal of organic chemistry 85(7) (2020) 4785-4794
Space group: P 1 21/c 1
Cell volume: 2343.8
Cell parameters: 15.9019; 15.189; 9.7547; 90; 95.855; 90;  

COD ID: 4038072
CIF file Formula: - C13 H18 N2 O -
Comments: Outin, Johanne; Quellier, Pauline; Bélanger, Guillaume Sequential One-Pot Vilsmeier-Haack and Organocatalyzed Mannich Cyclizations to Functionalized Benzoindolizidines and Benzoquinolizidines. The Journal of organic chemistry 85(7) (2020) 4712-4729
Space group: P 1 21/c 1
Cell volume: 1149.77
Cell parameters: 9.6553; 11.4; 11.05; 90; 109.035; 90;  

COD ID: 4038073
CIF file Formula: - C16 H21 N O3 -
Comments: Outin, Johanne; Quellier, Pauline; Bélanger, Guillaume Sequential One-Pot Vilsmeier-Haack and Organocatalyzed Mannich Cyclizations to Functionalized Benzoindolizidines and Benzoquinolizidines. The Journal of organic chemistry 85(7) (2020) 4712-4729
Space group: C 1 2/c 1
Cell volume: 2852.8
Cell parameters: 30.3546; 5.078; 20.1975; 90; 113.604; 90;  

COD ID: 4038074
CIF file Formula: - C15 H19 N O3 -
Comments: Outin, Johanne; Quellier, Pauline; Bélanger, Guillaume Sequential One-Pot Vilsmeier-Haack and Organocatalyzed Mannich Cyclizations to Functionalized Benzoindolizidines and Benzoquinolizidines. The Journal of organic chemistry 85(7) (2020) 4712-4729
Space group: P 1 21/n 1
Cell volume: 1328.52
Cell parameters: 12.9004; 7.7842; 13.685; 90; 104.82; 90;  

COD ID: 4038075
CIF file Formula: - C19 H27 N O3 -
Comments: Outin, Johanne; Quellier, Pauline; Bélanger, Guillaume Sequential One-Pot Vilsmeier-Haack and Organocatalyzed Mannich Cyclizations to Functionalized Benzoindolizidines and Benzoquinolizidines. The Journal of organic chemistry 85(7) (2020) 4712-4729
Space group: P -1
Cell volume: 1701.63
Cell parameters: 9.1272; 9.8101; 19.409; 81.582; 82.675; 85.338;  

COD ID: 4038076
CIF file Formula: - C17 H23 N O3 -
Comments: Outin, Johanne; Quellier, Pauline; Bélanger, Guillaume Sequential One-Pot Vilsmeier-Haack and Organocatalyzed Mannich Cyclizations to Functionalized Benzoindolizidines and Benzoquinolizidines. The Journal of organic chemistry 85(7) (2020) 4712-4729
Space group: P -1
Cell volume: 760.08
Cell parameters: 5.4537; 10.2807; 14.458; 71.75; 81.119; 85.2;  

COD ID: 4038077
CIF file Formula: - C24 H14 F6 N2 O2 -
Comments: Das, Tamal Kanti; Madica, Krishnaprasad; Krishnan, Jagadeesh; Marelli, Udaya Kiran; Biju, Akkattu T. N-Heterocyclic Carbene Catalysis Exploiting Oxidative Imine Umpolung for the Generation of Imidoyl Azoliums. The Journal of organic chemistry 85(7) (2020) 5114-5121
Space group: P -1
Cell volume: 515.58
Cell parameters: 5.7211; 8.2943; 11.0522; 92.866; 91.401; 99.979;  

COD ID: 4038078
CIF file Formula: - C22 H15 N3 -
Comments: Yee, Nathan; Dadvand, Afshin; Perepichka, Dmitrii F. Serendipitous Formation of Semiconducting Semi-Nindigo Indigoid by the Degradation of Diindolopyrrole. The Journal of organic chemistry 85(7) (2020) 5073-5077
Space group: P c c n
Cell volume: 3088.4
Cell parameters: 11.4534; 27.6502; 9.7523; 90; 90; 90;  

COD ID: 4038079
CIF file Formula: - C20 H33 B2 N O4 -
Comments: Sarkar, Nabin; Bera, Subhadeep; Nembenna, Sharanappa Aluminum-Catalyzed Selective Hydroboration of Nitriles and Alkynes: A Multifunctional Catalyst. The Journal of organic chemistry 85(7) (2020) 4999-5009
Space group: C 1 2/c 1
Cell volume: 4320.6
Cell parameters: 12.0036; 24.1961; 15.6222; 90; 107.779; 90;  

COD ID: 4038080
CIF file Formula: - C42 H55 Al N5 -
Comments: Sarkar, Nabin; Bera, Subhadeep; Nembenna, Sharanappa Aluminum-Catalyzed Selective Hydroboration of Nitriles and Alkynes: A Multifunctional Catalyst. The Journal of organic chemistry 85(7) (2020) 4999-5009
Space group: P b c a
Cell volume: 9037.9
Cell parameters: 15.7533; 20.3581; 28.1812; 90; 90; 90;  

COD ID: 4038081
CIF file Formula: - C27 H28 N2 O6 S -
Comments: Han, Pan; Mao, Zhuo-Ya; Li, Ming; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang Synthesis of Amide Enol Carbamates and Carbonates through Cu(OTf)<sub>2</sub>-Catalyzed Reactions of Ynamides with <i>t</i>-Butyl Carbamates/Carbonates. The Journal of organic chemistry 85(7) (2020) 4740-4752
Space group: P 1 21 1
Cell volume: 1310.54
Cell parameters: 10.0988; 9.9019; 13.2271; 90; 97.768; 90;  

COD ID: 4038082
CIF file Formula: - C28 H28 Br N2 O5 S -
Comments: Han, Pan; Mao, Zhuo-Ya; Li, Ming; Si, Chang-Mei; Wei, Bang-Guo; Lin, Guo-Qiang Synthesis of Amide Enol Carbamates and Carbonates through Cu(OTf)<sub>2</sub>-Catalyzed Reactions of Ynamides with <i>t</i>-Butyl Carbamates/Carbonates. The Journal of organic chemistry 85(7) (2020) 4740-4752
Space group: P -1
Cell volume: 1339.4
Cell parameters: 8.3713; 12.9078; 13.4996; 73.9; 73.965; 79.977;  

COD ID: 4038083
CIF file Formula: - C56 H88.2 Cl3 F0.9 N8 O9.1 -
Comments: Delecluse, Magalie; Colomban, Cédric; Chatelet, Bastien; Chevallier-Michaud, Sabine; Moraleda, Delphine; Dutasta, Jean-Pierre; Martinez, Alexandre Highly Selective Fluoride Recognition by a Small Tris-Urea Covalent Cage. The Journal of organic chemistry 85(7) (2020) 4706-4711
Space group: P 1 21/n 1
Cell volume: 6111.8
Cell parameters: 12.1056; 18.4895; 27.4703; 90; 96.269; 90;  

COD ID: 4038084
CIF file Formula: - C23 H36 O6 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 1 21/c 1
Cell volume: 2237.3
Cell parameters: 7.3636; 27.079; 11.2689; 90; 95.314; 90;  

COD ID: 4038085
CIF file Formula: - C27 H46 O5 Si -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P -1
Cell volume: 1409.8
Cell parameters: 10.142; 11.29; 13.629; 83.009; 73.442; 70.541;  

COD ID: 4038086
CIF file Formula: - C27 H42 O7 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: C 1 c 1
Cell volume: 2683.2
Cell parameters: 13.152; 16.857; 12.706; 90; 107.727; 90;  

COD ID: 4038087
CIF file Formula: - C25 H42 O5 Si -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P -1
Cell volume: 1361.7
Cell parameters: 9.5936; 11.1608; 14.6705; 69.414; 79.03; 68.15;  

COD ID: 4038088
CIF file Formula: - C25 H38 O5 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 1 21/c 1
Cell volume: 5020
Cell parameters: 13.878; 17.626; 20.717; 90; 97.877; 90;  

COD ID: 4038089
CIF file Formula: - C25 H40 O5 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P b c a
Cell volume: 4706.93
Cell parameters: 11.6702; 18.6897; 21.5803; 90; 90; 90;  

COD ID: 4038090
CIF file Formula: - C25 H40 O6 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 21 21 21
Cell volume: 2384.5
Cell parameters: 8.674; 11.5004; 23.904; 90; 90; 90;  

COD ID: 4038091
CIF file Formula: - C24 H42 O5 Si -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 1 21/c 1
Cell volume: 2519.3
Cell parameters: 8.2593; 28.326; 10.769; 90; 90.695; 90;  

COD ID: 4038092
CIF file Formula: - C7 H8 O3 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P b c a
Cell volume: 1251.5
Cell parameters: 8.5906; 7.0884; 20.553; 90; 90; 90;  

COD ID: 4038093
CIF file Formula: - C15 H20 O3 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 1 21/n 1
Cell volume: 1259.81
Cell parameters: 7.8382; 16.7731; 9.7678; 90; 101.18; 90;  

COD ID: 4038094
CIF file Formula: - C22 H30 O4 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 1 21/c 1
Cell volume: 1979.11
Cell parameters: 13.1931; 9.645; 15.711; 90; 98.127; 90;  

COD ID: 4038095
CIF file Formula: - C27 H38 N2 O4 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: C 1 2/c 1
Cell volume: 19707
Cell parameters: 32.983; 19.298; 31.32; 90; 98.677; 90;  

COD ID: 4038096
CIF file Formula: - C7 H12 O3 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P -1
Cell volume: 352.68
Cell parameters: 5.9092; 7.1583; 9.1902; 92.766; 105.442; 108.026;  

COD ID: 4038097
CIF file Formula: - C15 H18 O3 -
Comments: Tong, Guanghu; Ding, Zhengwei; Liu, Zhi; Ding, You-Song; Xu, Liang; Zhang, Hailong; Li, Pengfei Total Synthesis of Prostratin, a Bioactive Tigliane Diterpenoid: Access to Multi-Stereocenter Cyclohexanes from a Phenol. The Journal of organic chemistry 85(7) (2020) 4813-4837
Space group: P 1 21 1
Cell volume: 1283.74
Cell parameters: 13.0633; 7.8253; 13.0916; 90; 106.413; 90;  

COD ID: 4038098
CIF file Formula: - C25 H35 F3 O6 Si -
Comments: Kim, Jae Hyun; Song, Yeonghun; Kim, Min Jung; Kim, Sanghee Asymmetric Total Synthesis of Inthomycins A, B, and C. The Journal of organic chemistry 85(7) (2020) 4795-4806
Space group: P 1 21 1
Cell volume: 1406.65
Cell parameters: 13.1127; 7.7038; 14.0568; 90; 97.859; 90;  

COD ID: 4038108
CIF file Formula: - C14 H17 O6 P -
Comments: Hernández-Guerra, Daniel; Kennedy, Alan R.; León, Elisa I; Martín, Ángeles; Pérez-Martín, Inés; Rodríguez, María S; Suárez, Ernesto Synthetic Approaches to Phosphasugars (2-oxo-1,2-oxaphosphacyclanes) Using the Anomeric Alkoxyl Radical β-Fragmentation Reaction as the Key Step. The Journal of organic chemistry 85(7) (2020) 4861-4880
Space group: P 21 21 21
Cell volume: 1453.51
Cell parameters: 6.1955; 13.6351; 17.2061; 90; 90; 90;  

COD ID: 4038109
CIF file Formula: - C24 H19 N O -
Comments: Parveen, Naziya; Sekar, Govindasamy Palladium Nanoparticle-Catalyzed Stereoselective Domino Synthesis of 3-Allylidene-2(3<i>H</i>)-oxindoles and 3-Allylidene-2(3<i>H</i>)-benzofuranones. The Journal of organic chemistry 85(7) (2020) 4682-4694
Space group: P 1 21/c 1
Cell volume: 1812.5
Cell parameters: 12.5295; 6.114; 24.4215; 90; 104.339; 90;  

COD ID: 4038110
CIF file Formula: - C21 H19 N O3 -
Comments: Parveen, Naziya; Sekar, Govindasamy Palladium Nanoparticle-Catalyzed Stereoselective Domino Synthesis of 3-Allylidene-2(3<i>H</i>)-oxindoles and 3-Allylidene-2(3<i>H</i>)-benzofuranones. The Journal of organic chemistry 85(7) (2020) 4682-4694
Space group: C 1 2/c 1
Cell volume: 3608.3
Cell parameters: 20.5819; 12.8776; 13.9465; 90; 102.536; 90;  

COD ID: 4038111
CIF file Formula: - C24 H19 N O2 -
Comments: Parveen, Naziya; Sekar, Govindasamy Palladium Nanoparticle-Catalyzed Stereoselective Domino Synthesis of 3-Allylidene-2(3<i>H</i>)-oxindoles and 3-Allylidene-2(3<i>H</i>)-benzofuranones. The Journal of organic chemistry 85(7) (2020) 4682-4694
Space group: P 1 21/n 1
Cell volume: 1898.34
Cell parameters: 14.253; 8.2293; 16.3693; 90; 98.613; 90;  

COD ID: 4038112
CIF file Formula: - C23 H15 Cl O2 -
Comments: Parveen, Naziya; Sekar, Govindasamy Palladium Nanoparticle-Catalyzed Stereoselective Domino Synthesis of 3-Allylidene-2(3<i>H</i>)-oxindoles and 3-Allylidene-2(3<i>H</i>)-benzofuranones. The Journal of organic chemistry 85(7) (2020) 4682-4694
Space group: P 1 c 1
Cell volume: 879.95
Cell parameters: 9.7179; 12.4696; 7.5883; 90; 106.874; 90;  

COD ID: 4038113
CIF file Formula: - C27 H25 N O4 -
Comments: Parveen, Naziya; Sekar, Govindasamy Palladium Nanoparticle-Catalyzed Stereoselective Domino Synthesis of 3-Allylidene-2(3<i>H</i>)-oxindoles and 3-Allylidene-2(3<i>H</i>)-benzofuranones. The Journal of organic chemistry 85(7) (2020) 4682-4694
Space group: P 1 21/c 1
Cell volume: 2242.9
Cell parameters: 8.1334; 31.8582; 9.231; 90; 110.33; 90;  

COD ID: 4038114
CIF file Formula: - C15 H8 O2 S2 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 1 21/n 1
Cell volume: 1258.1
Cell parameters: 9.424; 9.68; 13.829; 90; 94.214; 90;  

COD ID: 4038115
CIF file Formula: - C15 H8 O2 S2 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P n m a
Cell volume: 1233.35
Cell parameters: 15.3775; 7.2583; 11.0501; 90; 90; 90;  

COD ID: 4038116
CIF file Formula: - C13 H8 O2 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 1 21/n 1
Cell volume: 881.1
Cell parameters: 9.559; 5.316; 17.355; 90; 92.38; 90;  

COD ID: 4038117
CIF file Formula: - C13 H6 Cl2 O2 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: C 1 2/m 1
Cell volume: 1058.9
Cell parameters: 13.357; 12.364; 7.308; 90; 118.676; 90;  

COD ID: 4038118
CIF file Formula: - C15 H8 O4 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 1 21/n 1
Cell volume: 1091.9
Cell parameters: 9.217; 12.573; 9.542; 90; 99.09; 90;  

COD ID: 4038119
CIF file Formula: - C15 H8 O3 S -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 1 21/n 1
Cell volume: 1191.2
Cell parameters: 9.457; 9.423; 13.368; 90; 90.586; 90;  

COD ID: 4038120
CIF file Formula: - C21 H12 O4 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 1 21/n 1
Cell volume: 3076
Cell parameters: 11.825; 17.04; 16.23; 90; 109.86; 90;  

COD ID: 4038121
CIF file Formula: - C23 H12 O4 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P n a 21
Cell volume: 1617.2
Cell parameters: 17.395; 9.112; 10.203; 90; 90; 90;  

COD ID: 4038122
CIF file Formula: - C25 H14 O4 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 21 21 21
Cell volume: 3650
Cell parameters: 13.845; 13.921; 18.938; 90; 90; 90;  

COD ID: 4038123
CIF file Formula: - C33 H18 O4 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: C 2 2 21
Cell volume: 2410.6
Cell parameters: 8.351; 21.414; 13.48; 90; 90; 90;  

COD ID: 4038124
CIF file Formula: - C34 H20 Cl2 O4 -
Comments: Wössner, Jan S; Esser, Birgit Spiroconjugated Donor-σ-Acceptor Charge-Transfer Dyes: Effect of the π-Subsystems on the Optoelectronic Properties. The Journal of organic chemistry 85(7) (2020) 5048-5057
Space group: P 21 21 21
Cell volume: 2594
Cell parameters: 5.3479; 17.257; 28.107; 90; 90; 90;  

COD ID: 4038125
CIF file Formula: - C132 H204 Cl36 Cu12 N48 O49.66 -
Comments: Yepremyan, Akop; Mekhail, Magy A.; Niebuhr, Brian P.; Pota, Kristof; Sadagopan, Nishanth; Schwartz, Timothy M.; Green, Kayla N. Synthesis of 12-Membered Tetra-aza Macrocyclic Pyridinophanes Bearing Electron-Withdrawing Groups. The Journal of organic chemistry 85(7) (2020) 4988-4998
Space group: C 1 2/m 1
Cell volume: 9763.4
Cell parameters: 26.405; 29.054; 13.1898; 90; 105.232; 90;  

COD ID: 4038126
CIF file Formula: - C13 H20 Cl2 F6 N4 O6 S2 -
Comments: Yepremyan, Akop; Mekhail, Magy A.; Niebuhr, Brian P.; Pota, Kristof; Sadagopan, Nishanth; Schwartz, Timothy M.; Green, Kayla N. Synthesis of 12-Membered Tetra-aza Macrocyclic Pyridinophanes Bearing Electron-Withdrawing Groups. The Journal of organic chemistry 85(7) (2020) 4988-4998
Space group: P 1 21/c 1
Cell volume: 2177.3
Cell parameters: 11.471; 7.8357; 24.225; 90; 90.475; 90;  

COD ID: 4038127
CIF file Formula: - C17 H21 N O3 -
Comments: Rinaldi, Antonia; Langé, Vittoria; Scarpi, Dina; Occhiato, Ernesto G. One-Pot Access to 1,7a-Dihydro-1,3a-ethano-indene and 1,8a-Dihydro-1,3a-ethano-azulene Skeletons by a Sequential Gold(I)-Catalyzed Propargyl Claisen Rearrangement/Nazarov Cyclization/[4+2] Cycloaddition Reaction. The Journal of organic chemistry 85(7) (2020) 5078-5086
Space group: P -1
Cell volume: 739.98
Cell parameters: 8.3484; 8.596; 10.5662; 94.799; 97.856; 97.882;  

COD ID: 4038128
CIF file Formula: - C29 H22 O2 -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: P 1 21/c 1
Cell volume: 2052.48
Cell parameters: 7.7659; 24.493; 11.05; 90; 102.439; 90;  

COD ID: 4038129
CIF file Formula: - C29 H22 S2 -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: P 1 21/c 1
Cell volume: 2109.1
Cell parameters: 7.63396; 24.8669; 11.3736; 90; 102.352; 90;  

COD ID: 4038130
CIF file Formula: - C33 H32 N2 -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: I 41/a :2
Cell volume: 9965.1
Cell parameters: 30.826; 30.826; 10.4869; 90; 90; 90;  

COD ID: 4038131
CIF file Formula: - C25 H12 O S2 -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: C 1 2/c 1
Cell volume: 3395
Cell parameters: 25.198; 8.1409; 17.1786; 90; 105.547; 90;  

COD ID: 4038132
CIF file Formula: - C29 H22 N2 O -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: P 1 21/c 1
Cell volume: 1997.27
Cell parameters: 4.8822; 24.2724; 18.1588; 90; 111.851; 90;  

COD ID: 4038133
CIF file Formula: - C59 H52 N4 O -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: I -4
Cell volume: 4145.03
Cell parameters: 28.0545; 28.0545; 5.2665; 90; 90; 90;  

COD ID: 4038134
CIF file Formula: - C118 H99 N9 -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: I -4
Cell volume: 4152.71
Cell parameters: 28.056; 28.056; 5.2757; 90; 90; 90;  

COD ID: 4038135
CIF file Formula: - C61 H54 N4 O -
Comments: Górski, Krzysztof; Mech-Piskorz, Justyna; Leśniewska, Barbara; Pietraszkiewicz, Oksana; Pietraszkiewicz, Marek Toward Soluble 5,10-Diheterotruxenes: Synthesis and Reactivity of 5,10-Dioxatruxenes, 5,10-Dithiatruxenes, and 5,10-Diazatruxenes. The Journal of organic chemistry 85(7) (2020) 4672-4681
Space group: I -4
Cell volume: 4151.25
Cell parameters: 28.0572; 28.0572; 5.2734; 90; 90; 90;  

COD ID: 4038187
CIF file Formula: - C14 H9 N3 O S -
Comments: Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry 85(8) (2020) 5570-5579
Space group: P b c a
Cell volume: 2432.65
Cell parameters: 11.6638; 7.5007; 27.8059; 90; 90; 90;  

COD ID: 4038188
CIF file Formula: - C24 H20 N4 O3 S -
Comments: Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry 85(8) (2020) 5570-5579
Space group: P b c a
Cell volume: 4184.9
Cell parameters: 13.0311; 10.4176; 30.827; 90; 90; 90;  

COD ID: 4038189
CIF file Formula: - C12 H13 N3 O S2 -
Comments: Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry 85(8) (2020) 5570-5579
Space group: P 1 21/c 1
Cell volume: 1271.19
Cell parameters: 10.0149; 15.6728; 8.2966; 90; 102.539; 90;  

COD ID: 4038190
CIF file Formula: - C24 H26 N4 O3 Se -
Comments: Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry 85(8) (2020) 5570-5579
Space group: P 1 21/c 1
Cell volume: 2223.4
Cell parameters: 11.4655; 12.7451; 15.4702; 90; 100.414; 90;  

COD ID: 4038191
CIF file Formula: - C25 H25 N5 O2 -
Comments: Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry 85(8) (2020) 5570-5579
Space group: P 1 21/c 1
Cell volume: 2256.5
Cell parameters: 15.4232; 6.0725; 24.6911; 90; 102.638; 90;  

COD ID: 4038192
CIF file Formula: - C16 H16 N2 S -
Comments: Chen, Jin-Yu; Selvaraju, Manikandan; Lin, Yen-Tzu; Dhole, Sandip; Lin, Chih-Yu; Sun, Chung-Ming Molecular Iodine-Promoted [3 + 2] Oxidative Cyclization for the Synthesis of Heteroarene-Fused [1,2,4] Thiadiazoles/Selenadiazoles. The Journal of organic chemistry 85(8) (2020) 5570-5579
Space group: P 1 21/c 1
Cell volume: 1363.96
Cell parameters: 5.6027; 14.3253; 17.1845; 90; 98.536; 90;  

COD ID: 4038227
CIF file Formula: - C11 H10 N O3 S -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P 1 21/n 1
Cell volume: 1072.76
Cell parameters: 7.7122; 6.9375; 20.1264; 90; 94.982; 90;  

COD ID: 4038228
CIF file Formula: - C16 H14 N2 O5 S2 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P -1
Cell volume: 3240.7
Cell parameters: 8.7488; 16.633; 22.2697; 90.008; 89.96; 90.013;  

COD ID: 4038229
CIF file Formula: - C17 H21 N2 O2 S -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P -1
Cell volume: 829.63
Cell parameters: 7.0032; 10.8265; 11.8966; 101.805; 104.363; 100.367;  

COD ID: 4038230
CIF file Formula: - C26 H28 N4 O4 S2 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: A m a 2
Cell volume: 2542.9
Cell parameters: 27.2818; 14.841; 6.2806; 90; 90; 90;  

COD ID: 4038231
CIF file Formula: - C32 H32 N4 O6 S2 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P -1
Cell volume: 1555.31
Cell parameters: 9.7299; 13.0223; 13.4524; 94.656; 107.814; 103.627;  

COD ID: 4038232
CIF file Formula: - C28 H32 N4 O4 S2 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P -1
Cell volume: 2683.7
Cell parameters: 8.0998; 11.0792; 30.7422; 95.055; 95.992; 100.265;  

COD ID: 4038233
CIF file Formula: - C28 H28 N2 O4 S4 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P -1
Cell volume: 738.05
Cell parameters: 8.4938; 8.723; 11.1325; 68.036; 75.071; 81.671;  

COD ID: 4038234
CIF file Formula: - C28 H32 N2 O4 S4 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P -1
Cell volume: 700.79
Cell parameters: 8.575; 8.8529; 10.6185; 72.078; 67.668; 75.284;  

COD ID: 4038235
CIF file Formula: - C400 H384 N32 O64 S64 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P b c a
Cell volume: 9925.6
Cell parameters: 22.7162; 14.2568; 30.6478; 90; 90; 90;  

COD ID: 4038236
CIF file Formula: - C27 H28 N2 O4 S4 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P 21 21 2
Cell volume: 2658.7
Cell parameters: 16.76; 25.156; 6.3059; 90; 90; 90;  

COD ID: 4038237
CIF file Formula: - C19 H20 N2 O4 S4 -
Comments: Mao, Jialin; Hai, Yu; Ye, Hebo; You, Lei Adaptive Covalent Networks Enabled by Dual Reactivity: The Evolution of Reversible Covalent Bonds, Their Molecular Assemblies, and Guest Recognition. The Journal of organic chemistry 85(8) (2020) 5351-5361
Space group: P 1 21/c 1
Cell volume: 2063.63
Cell parameters: 11.2696; 11.1966; 16.4635; 90; 96.598; 90;  

COD ID: 4038238
CIF file Formula: - C25 H24 N2 O5 -
Comments: Pradhan, Sourav; Roy, Subhasish; Banerjee, Sonbidya; De, Pinaki Bhusan; Punniyamurthy, Tharmalingam Oxidative C-H/N-H Annulation of Aromatic Amides with Dialkyl Malonates: Access to Isoindolinones and Dihydrobenzoindoles. The Journal of organic chemistry 85(8) (2020) 5741-5749
Space group: P -1
Cell volume: 1125.43
Cell parameters: 9.2898; 11.6784; 12.1295; 92.062; 112.04; 110.021;  

COD ID: 4038242
CIF file Formula: - C17 H15 F2 N O S -
Comments: Ye, Zhi-Peng; Xia, Peng-Ju; Liu, Fang; Hu, Yuan-Zhuo; Song, Dan; Xiao, Jun-An; Huang, Ping; Xiang, Hao-Yue; Chen, Xiao-Qing; Yang, Hua Visible-Light-Induced, Catalyst-Free Radical Cross-Coupling Cyclization of <i>N</i>-Allylbromodifluoroacetamides with Disulfides or Diselenides. The Journal of organic chemistry 85(8) (2020) 5670-5682
Space group: P 1 21/n 1
Cell volume: 1525.32
Cell parameters: 7.7803; 10.9236; 18.3596; 90; 102.166; 90;  

COD ID: 4038244
CIF file Formula: - C23 H30 B N O6 S -
Comments: Demchuk, Oleksandr P.; Hryshchuk, Oleksandr V.; Vashchenko, Bohdan V.; Kozytskiy, Andriy V.; Tymtsunik, Andriy V.; Komarov, Igor V.; Grygorenko, Oleksandr O. Photochemical [2 + 2] Cycloaddition of Alkenyl Boronic Derivatives: An Entry into 3-Azabicyclo[3.2.0]heptane Scaffold. The Journal of organic chemistry 85(9) (2020) 5927-5940
Space group: P 1 21/c 1
Cell volume: 2325.22
Cell parameters: 23.768; 7.7729; 12.6433; 90; 95.457; 90;  

COD ID: 4038245
CIF file Formula: - C12 H15 Br N2 O2 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P 1 21/m 1
Cell volume: 569.376
Cell parameters: 9.2209; 6.6668; 9.3831; 90; 99.2121; 90;  

COD ID: 4038246
CIF file Formula: - C12 H13 Cl N2 O3 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P 1 21 1
Cell volume: 622.51
Cell parameters: 7.5174; 10.8721; 7.6231; 90; 92.3519; 90;  

COD ID: 4038247
CIF file Formula: - C64 H40 Cl8 N16 O16 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P b c a
Cell volume: 1656.5
Cell parameters: 12.5251; 7.7888; 16.98; 90; 90; 90;  

COD ID: 4038248
CIF file Formula: - C3 H3 Br N2 O3 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P 1 21 1
Cell volume: 289.4
Cell parameters: 6.849; 6.272; 7.042; 90; 106.901; 90;  

COD ID: 4038249
CIF file Formula: - C10 H5 Cl N2 O2 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P -1
Cell volume: 479.18
Cell parameters: 6.667; 6.7899; 11.05; 81.39; 86.15; 75.78;  

COD ID: 4038250
CIF file Formula: - C8 H5 Cl N2 O3 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P 1 21 1
Cell volume: 419.48
Cell parameters: 6.5586; 7.4628; 8.5758; 90; 92.046; 90;  

COD ID: 4038251
CIF file Formula: - C2 Br2 N2 O2 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P 21 21 21
Cell volume: 584.68
Cell parameters: 5.9208; 7.7879; 12.68; 90; 90; 90;  

COD ID: 4038252
CIF file Formula: - C6 H11 Cl N2 O2 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P -1
Cell volume: 869
Cell parameters: 5.36; 9.166; 18.17; 94.47; 94.802; 101.15;  

COD ID: 4038253
CIF file Formula: - C10 H6 Cl2 N2 O2 -
Comments: Matsubara, Ryosuke; Ando, Akihiro; Hasebe, Hayu; Kim, Hojin; Tsuneda, Takao; Hayashi, Masahiko Synthesis and Synthetic Application of Chloro- and Bromofuroxans. The Journal of organic chemistry 85(9) (2020) 5959-5972
Space group: P -1
Cell volume: 522.8
Cell parameters: 5.5643; 9.865; 10.798; 112.164; 95.909; 103.111;  

COD ID: 4038258
CIF file Formula: - C36 H34 P2 S2 -
Comments: Kato, Yugo; Otomura, Nobutaka; Hirano, Koji; Miura, Masahiro Synthesis of DPPP- and DPPPEN-Type Bidentate Ligands by Ring-Opening Diphosphination of Methylene- and Vinylcyclopropanes under Visible-Light-Promoted Photoredox Catalysis. The Journal of organic chemistry 85(9) (2020) 5981-5994
Space group: P 1 21/c 1
Cell volume: 3077.61
Cell parameters: 9.5224; 16.8906; 19.2805; 90; 97.05; 90;  

COD ID: 4038259
CIF file Formula: - C16 H17 F3 S -
Comments: Khoroshilova, Olesya V.; Vasilyev, Aleksander V. Generation and NMR Study of Short-Lived and Reactive Trifluoroalkyl Carbocations of the α-Halogenothiophene Series in Brønsted Superacids: Reactions of the Cations with Arenes. The Journal of organic chemistry 85(9) (2020) 5872-5883
Space group: C 1 2/c 1
Cell volume: 2848.72
Cell parameters: 27.7624; 9.77817; 10.50269; 90; 92.3518; 90;  

COD ID: 4038260
CIF file Formula: - C24 H18 N4 O4 -
Comments: Galenko, Ekaterina E.; Kryukova, Mariya A.; Novikov, Mikhail S.; Khlebnikov, Alexander F. Synthesis of Bi-, Ter-, and Quaterpyridinecarboxylates via Propargylisoxazole-Pyridine Rearrangement. The Journal of organic chemistry 85(9) (2020) 6109-6122
Space group: I 1 2/c 1
Cell volume: 1957.13
Cell parameters: 7.8057; 9.6433; 26.0047; 90; 91.031; 90;  

COD ID: 4038261
CIF file Formula: - C27 H19 N3 O4 S -
Comments: Galenko, Ekaterina E.; Kryukova, Mariya A.; Novikov, Mikhail S.; Khlebnikov, Alexander F. Synthesis of Bi-, Ter-, and Quaterpyridinecarboxylates via Propargylisoxazole-Pyridine Rearrangement. The Journal of organic chemistry 85(9) (2020) 6109-6122
Space group: P -1
Cell volume: 1098.7
Cell parameters: 8.8744; 11.6564; 11.8317; 107.65; 107.159; 93.599;  

COD ID: 4038262
CIF file Formula: - C25 H27 N O5 -
Comments: Wu, Xiang; Zhu, Zheng-Hao; He, Hao; Ren, Lei; Zhu, Cheng-Feng; Li, You-Gui Construction of 1,3-Oxazolidines through a Three-Component [3+2] Cycloaddition of Tetrahydroisoquinolines, Aldehydes, and Ethyl Ketomalonate. The Journal of organic chemistry 85(9) (2020) 6216-6224
Space group: P 1 21/c 1
Cell volume: 2174.69
Cell parameters: 14.9657; 8.176; 18.5717; 90; 106.865; 90;  

COD ID: 4038263
CIF file Formula: - C39 H33 N2 O2 P -
Comments: Pattarawarapan, Mookda; Wiriya, Nittaya; Yimklan, Saranphong; Wangngae, Sirilak; Phakhodee, Wong Zwitterionic Ring-Opened Oxyphosphonium Species from the Ph<sub>3</sub>P-I<sub>2</sub> Mediated Reactions of Benzo[<i>d</i>]oxazol-2(3<i>H</i>)-ones with Secondary Amines. The Journal of organic chemistry 85(9) (2020) 6151-6158
Space group: C 1 c 1
Cell volume: 3217.9
Cell parameters: 16.7996; 11.7198; 19.3982; 90; 122.591; 90;  

COD ID: 4038266
CIF file Formula: - C58 H80 Cl2 N8 O7 -
Comments: Poronik, Yevgen M.; Ambicki, Filip; Tseng, Sheng-Ming; Chou, Pi-Tai; Deperasińska, Irena; Gryko, Daniel T. How an Eight-Membered Ring Alters the Rhodamine Chromophore. The Journal of organic chemistry 85(9) (2020) 5973-5980
Space group: P -1
Cell volume: 1520.4
Cell parameters: 9.5119; 12.606; 13.674; 74.681; 75.133; 80.617;  

COD ID: 4038267
CIF file Formula: - C54 H64 Cl2 N8 O5 -
Comments: Poronik, Yevgen M.; Ambicki, Filip; Tseng, Sheng-Ming; Chou, Pi-Tai; Deperasińska, Irena; Gryko, Daniel T. How an Eight-Membered Ring Alters the Rhodamine Chromophore. The Journal of organic chemistry 85(9) (2020) 5973-5980
Space group: P 1 21/c 1
Cell volume: 2621.09
Cell parameters: 9.325; 12.3792; 22.7224; 90; 92.177; 90;  

COD ID: 4038268
CIF file Formula: - C33 H51 Cl3 N8 O7 -
Comments: Imani, Zeynab; Guillot, Régis; Declerck, Valérie; Aitken, David J. Local versus Global Control of Helical Folding in β-Peptide Segments Using Hydrazino Turns. The Journal of organic chemistry 85(9) (2020) 6165-6171
Space group: P 1 21 1
Cell volume: 1953.43
Cell parameters: 9.5008; 19.9938; 10.2841; 90; 90.605; 90;  

COD ID: 4038269
CIF file Formula: - C18 H25 N O5 -
Comments: Castán, Alejandro; Badorrey, Ramón; Díez, José A; Christoffersen, Claus T.; Rasmussen, Lars K.; Kehler, Jan; Köhler, Ralf; Gálvez, José A; Díaz-de-Villegas, María D Debenzylative Cycloetherification as a Synthetic Tool in the Diastereoselective Synthesis of 3,6-Disubstituted Hexahydro-2<i>H</i>-furo[3,2-<i>b</i>]pyrroles, PDE1 Enzyme Inhibitors with an Antiproliferative Effect on Melanoma Cells. The Journal of organic chemistry 85(9) (2020) 5941-5951
Space group: P 21 21 21
Cell volume: 1787.4
Cell parameters: 8.6708; 11.5329; 17.874; 90; 90; 90;  

COD ID: 4038277
CIF file Formula: - C23 H20 O S2 -
Comments: Sundaravelu, Nallappan; Guha, Somraj; Sekar, Govindasamy Iodonium Ion-Catalyzed Domino Synthesis of <i>Z</i>-Selective α,β-Diphenylthio Enones from Easily Accessible Secondary Alcohols. The Journal of organic chemistry 85(9) (2020) 5895-5906
Space group: P 1 21/n 1
Cell volume: 2034.53
Cell parameters: 10.8642; 18.7374; 11.2628; 90; 117.454; 90;  

COD ID: 4038278
CIF file Formula: - C21 H12 Cl2 O S2 -
Comments: Sundaravelu, Nallappan; Guha, Somraj; Sekar, Govindasamy Iodonium Ion-Catalyzed Domino Synthesis of <i>Z</i>-Selective α,β-Diphenylthio Enones from Easily Accessible Secondary Alcohols. The Journal of organic chemistry 85(9) (2020) 5895-5906
Space group: P -1
Cell volume: 943.19
Cell parameters: 8.2801; 10.9055; 11.3166; 72.0273; 79.5744; 77.9792;  

COD ID: 4038279
CIF file Formula: - C14 H16 N4 O4 -
Comments: Carlson, Angela S.; Liu, En-Chih; Topczewski, Joseph J. A Cascade Reaction of Cinnamyl Azides with Acrylates Directly Generates Tetrahydro-Pyrrolo-Pyrazole Heterocycles. The Journal of organic chemistry 85(9) (2020) 6044-6059
Space group: P 1 21/c 1
Cell volume: 1448.12
Cell parameters: 7.108; 10.7667; 18.9286; 90; 91.471; 90;  

COD ID: 4038280
CIF file Formula: - C68 H90 Cl6 N12 O8 -
Comments: Carlson, Angela S.; Liu, En-Chih; Topczewski, Joseph J. A Cascade Reaction of Cinnamyl Azides with Acrylates Directly Generates Tetrahydro-Pyrrolo-Pyrazole Heterocycles. The Journal of organic chemistry 85(9) (2020) 6044-6059
Space group: P 1 21/c 1
Cell volume: 7101.4
Cell parameters: 14.0598; 15.723; 32.139; 90; 91.764; 90;  

COD ID: 4038281
CIF file Formula: - C24 H20 N4 O3 -
Comments: Carlson, Angela S.; Liu, En-Chih; Topczewski, Joseph J. A Cascade Reaction of Cinnamyl Azides with Acrylates Directly Generates Tetrahydro-Pyrrolo-Pyrazole Heterocycles. The Journal of organic chemistry 85(9) (2020) 6044-6059
Space group: P 1 21/c 1
Cell volume: 2030
Cell parameters: 29.875; 5.607; 12.349; 90; 101.081; 90;  

COD ID: 4038282
CIF file Formula: - C13 H15 N3 O2 -
Comments: Carlson, Angela S.; Liu, En-Chih; Topczewski, Joseph J. A Cascade Reaction of Cinnamyl Azides with Acrylates Directly Generates Tetrahydro-Pyrrolo-Pyrazole Heterocycles. The Journal of organic chemistry 85(9) (2020) 6044-6059
Space group: P 21 21 21
Cell volume: 1194.04
Cell parameters: 6.0964; 10.1676; 19.2632; 90; 90; 90;  

COD ID: 4038285
CIF file Formula: - C12 H11 B F2 I N3 O S -
Comments: Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Luboradzki, Roman; Ceborska, Magdalena; Hladka, Iryna; Danyliv, Yan; Grazulevicius, Juozas V. Organolithium-Mediated Postfunctionalization of Thiazolo[3,2-<i>c</i>][1,3,5,2]oxadiazaborinine Fluorescent Dyes. The Journal of organic chemistry 85(9) (2020) 6060-6072
Space group: P 1 21/c 1
Cell volume: 1454.2
Cell parameters: 15.7049; 12.0661; 7.702; 90; 94.888; 90;  

COD ID: 4038286
CIF file Formula: - C13 H14 B F2 N3 O S -
Comments: Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Luboradzki, Roman; Ceborska, Magdalena; Hladka, Iryna; Danyliv, Yan; Grazulevicius, Juozas V. Organolithium-Mediated Postfunctionalization of Thiazolo[3,2-<i>c</i>][1,3,5,2]oxadiazaborinine Fluorescent Dyes. The Journal of organic chemistry 85(9) (2020) 6060-6072
Space group: P 1 21/c 1
Cell volume: 1366.72
Cell parameters: 15.5882; 11.6785; 7.5331; 90; 94.724; 90;  

COD ID: 4038287
CIF file Formula: - C18 H16 B F2 N3 O3 S2 -
Comments: Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Luboradzki, Roman; Ceborska, Magdalena; Hladka, Iryna; Danyliv, Yan; Grazulevicius, Juozas V. Organolithium-Mediated Postfunctionalization of Thiazolo[3,2-<i>c</i>][1,3,5,2]oxadiazaborinine Fluorescent Dyes. The Journal of organic chemistry 85(9) (2020) 6060-6072
Space group: C 1 2/c 1
Cell volume: 3807.73
Cell parameters: 18.8716; 12.5058; 17.1769; 90; 110.067; 90;  

COD ID: 4038288
CIF file Formula: - C14 H16 B F2 N3 O S -
Comments: Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Luboradzki, Roman; Ceborska, Magdalena; Hladka, Iryna; Danyliv, Yan; Grazulevicius, Juozas V. Organolithium-Mediated Postfunctionalization of Thiazolo[3,2-<i>c</i>][1,3,5,2]oxadiazaborinine Fluorescent Dyes. The Journal of organic chemistry 85(9) (2020) 6060-6072
Space group: P 1 21/c 1
Cell volume: 1469.39
Cell parameters: 12.6493; 6.2227; 19.5519; 90; 107.296; 90;  

COD ID: 4038289
CIF file Formula: - C16 H18 B F2 N3 O3 S -
Comments: Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Luboradzki, Roman; Ceborska, Magdalena; Hladka, Iryna; Danyliv, Yan; Grazulevicius, Juozas V. Organolithium-Mediated Postfunctionalization of Thiazolo[3,2-<i>c</i>][1,3,5,2]oxadiazaborinine Fluorescent Dyes. The Journal of organic chemistry 85(9) (2020) 6060-6072
Space group: P 1 21/n 1
Cell volume: 1669.46
Cell parameters: 14.262; 8.0464; 14.6468; 90; 96.67; 90;  

COD ID: 4038326
CIF file Formula: - C34 H42 N4 O7 -
Comments: Nguyen, Khiem Chau; Wang, Pengzhi; Sommer, Roger D.; Lindsey, Jonathan S. Asymmetric Synthesis of a Bacteriochlorophyll Model Compound Containing <i>trans</i>-Dialkyl Substituents in Ring D. The Journal of organic chemistry 85(10) (2020) 6605-6619
Space group: P 1 21 1
Cell volume: 3395.25
Cell parameters: 14.5879; 10.2102; 23.8219; 90; 106.882; 90;  

COD ID: 4038476
CIF file Formula: - C17 H17 Cl N2 O S -
Comments: Zheng, Nian; Liu, Ce; Ding, Ya-Nan; Shi, Wei-Yu; Zhang, Bo-Sheng; Liang, Yong-Min Copper-Catalyzed Three-Component Redox-Neutral Ring Opening of Benzothiazoles to 1-Amino-<i>N</i>-(2-(phenylthio)phenyl)methanimine. The Journal of organic chemistry 85(12) (2020) 7666-7673
Space group: P 1 21/c 1
Cell volume: 3336.87
Cell parameters: 16.4728; 9.39367; 22.5176; 90; 106.731; 90;  

COD ID: 4038477
CIF file Formula: - C18 H17 F3 N2 O S -
Comments: Zheng, Nian; Liu, Ce; Ding, Ya-Nan; Shi, Wei-Yu; Zhang, Bo-Sheng; Liang, Yong-Min Copper-Catalyzed Three-Component Redox-Neutral Ring Opening of Benzothiazoles to 1-Amino-<i>N</i>-(2-(phenylthio)phenyl)methanimine. The Journal of organic chemistry 85(12) (2020) 7666-7673
Space group: P 1 21/n 1
Cell volume: 1785.69
Cell parameters: 7.56093; 10.6632; 22.1615; 90; 91.968; 90;  

COD ID: 4038478
CIF file Formula: - C21 H24 N2 O2 S -
Comments: Zheng, Nian; Liu, Ce; Ding, Ya-Nan; Shi, Wei-Yu; Zhang, Bo-Sheng; Liang, Yong-Min Copper-Catalyzed Three-Component Redox-Neutral Ring Opening of Benzothiazoles to 1-Amino-<i>N</i>-(2-(phenylthio)phenyl)methanimine. The Journal of organic chemistry 85(12) (2020) 7666-7673
Space group: P 1 21/c 1
Cell volume: 1956.02
Cell parameters: 17.7949; 11.2697; 10.0677; 90; 104.349; 90;  

COD ID: 4038495
CIF file Formula: - C54 H78 O8 -
Comments: Vargas-Romero, Katherine; Martínez-Torres, Fátima C; Aguilar-Granda, Andrés; Pérez-Estrada, Salvador; Flores-Alamo, Marcos; Rodríguez-Molina, Braulio; Iglesias-Arteaga, Martín A Synthesis and Solid-State Dynamics of a Crystalline Steroid Molecular Rotor without the Alkyne Axle: Steroid Dimers Based on a 1,4-Di(1,3-dioxan-2-yl)benzene Moiety. The Journal of organic chemistry 85(13) (2020) 8501-8509
Space group: P 1
Cell volume: 2363.3
Cell parameters: 13.4848; 13.8175; 14.4535; 74.959; 88.351; 65.812;  

COD ID: 4038496
CIF file Formula: - C54 H78 O8 -
Comments: Vargas-Romero, Katherine; Martínez-Torres, Fátima C; Aguilar-Granda, Andrés; Pérez-Estrada, Salvador; Flores-Alamo, Marcos; Rodríguez-Molina, Braulio; Iglesias-Arteaga, Martín A Synthesis and Solid-State Dynamics of a Crystalline Steroid Molecular Rotor without the Alkyne Axle: Steroid Dimers Based on a 1,4-Di(1,3-dioxan-2-yl)benzene Moiety. The Journal of organic chemistry 85(13) (2020) 8501-8509
Space group: P 1 21 1
Cell volume: 2353.2
Cell parameters: 13.7565; 10.3255; 16.8608; 90; 100.716; 90;  

COD ID: 4038498
CIF file Formula: - C29 H18 F6 N2 O -
Comments: Zhu, Lifan; Guo, Hongyu; Feng, Xiujuan; Yamamoto, Yoshinori; Bao, Ming Copper-Catalyzed One-Pot Synthesis of 1,3-Enynes from 2-Chloro-<i>N</i>-(quinolin-8-yl)acetamides and Terminal Alkynes. The Journal of organic chemistry 85(13) (2020) 8740-8748
Space group: P 1 21/c 1
Cell volume: 2437.98
Cell parameters: 16.5939; 13.739; 10.851; 90; 99.769; 90;  

COD ID: 4038499
CIF file Formula: - C22 H19 Br O4 S -
Comments: Formánek, Bedřich; Tauchman, Jiří; Císařová, Ivana; Veselý, Jan Access to Spirocyclic Benzothiophenones with Multiple Stereocenters via an Organocatalytic Cascade Reaction. The Journal of organic chemistry 85(13) (2020) 8510-8521
Space group: P 21 21 21
Cell volume: 1976.23
Cell parameters: 11.0046; 11.4721; 15.6538; 90; 90; 90;  

COD ID: 4038500
CIF file Formula: - C13 H9 Cl O2 -
Comments: Tong, Zhou; Tang, Zhi; Au, Chak-Tong; Qiu, Renhua Nickel-Catalyzed Decarbonyloxidation of 3-Aryl Benzofuran-2(<i>3H</i>)-ones to 2-Hydroxybenzophenones. The Journal of organic chemistry 85(13) (2020) 8533-8543
Space group: P 1 21/c 1
Cell volume: 1036.2
Cell parameters: 15.3318; 5.8627; 11.9302; 90; 104.921; 90;  

COD ID: 4038504
CIF file Formula: - C17 H18 N2 S2 -
Comments: Qi, Peng; Sun, Fang; Chen, Ning; Du, Hongguang Cross-Dehydrogenative Coupling of Azoarenes with Dialkyl Disulfides. The Journal of organic chemistry 85(13) (2020) 8588-8596
Space group: P -1
Cell volume: 796.86
Cell parameters: 8.2539; 9.845; 10.1665; 85.666; 76.94; 82.44;  

COD ID: 4038505
CIF file Formula: - C20 H21 N O6 S -
Comments: Ghosh, Koushik; Ghosh, Arghadip; Mukherjee, Kallol; Rit, Raja K.; Sahoo, Akhila K. Sulfoximine-Assisted Unsymmetrical Twofold C-H Functionalization of Arenes. The Journal of organic chemistry 85(13) (2020) 8618-8626
Space group: P 1 21/n 1
Cell volume: 2004.7
Cell parameters: 8.4889; 23.1788; 10.7372; 90; 108.396; 90;  

COD ID: 4038506
CIF file Formula: - C18 H15 N O3 -
Comments: Ghosh, Koushik; Ghosh, Arghadip; Mukherjee, Kallol; Rit, Raja K.; Sahoo, Akhila K. Sulfoximine-Assisted Unsymmetrical Twofold C-H Functionalization of Arenes. The Journal of organic chemistry 85(13) (2020) 8618-8626
Space group: P -1
Cell volume: 709.31
Cell parameters: 8.8161; 9.5583; 9.7852; 70.157; 73.487; 68.453;  

COD ID: 4038507
CIF file Formula: - C18 H17 F3 N2 O5 -
Comments: Fang, Zheng; Yin, Hongshan; Lin, Lu; Wen, Shunli; Xie, Lili; Huang, Yangjie; Weng, Zhiqiang Collaborative Activation of Trifluoroacetyl Diazoester by a Lewis Acid and Base for the Synthesis of Polysubstituted 4-Trifluoromethylpyrazoles. The Journal of organic chemistry 85(13) (2020) 8714-8722
Space group: P 1 21/c 1
Cell volume: 1831.3
Cell parameters: 8.6117; 13.1472; 16.255; 90; 95.684; 90;  

COD ID: 4038508
CIF file Formula: - C12 H13 Cl O2 -
Comments: Gao, Shenghua; Gao, Xuezhi; Wu, Zenong; Li, Houyong; Yang, Zhezhou; Zhang, Fuli Process for (<i>S</i>)-Ketamine and (<i>S</i>)-Norketamine via Resolution Combined with Racemization. The Journal of organic chemistry 85(13) (2020) 8656-8664
Space group: P 21 21 21
Cell volume: 1104.4
Cell parameters: 7.2414; 8.1329; 18.752; 90; 90; 90;  

COD ID: 4038509
CIF file Formula: - C13 H17 Cl2 N O -
Comments: Gao, Shenghua; Gao, Xuezhi; Wu, Zenong; Li, Houyong; Yang, Zhezhou; Zhang, Fuli Process for (<i>S</i>)-Ketamine and (<i>S</i>)-Norketamine via Resolution Combined with Racemization. The Journal of organic chemistry 85(13) (2020) 8656-8664
Space group: P 1 21 1
Cell volume: 680.1
Cell parameters: 8.5612; 7.1443; 11.337; 90; 101.245; 90;  

COD ID: 4038510
CIF file Formula: - C21 H17 B F7 N3 -
Comments: Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry 85(13) (2020) 8360-8370
Space group: P 1 21/c 1
Cell volume: 2060.93
Cell parameters: 18.1713; 13.699; 8.3562; 90; 97.785; 90;  

COD ID: 4038511
CIF file Formula: - C24 H26 B Br2 F2 N3 -
Comments: Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry 85(13) (2020) 8360-8370
Space group: P 21 21 21
Cell volume: 2481.7
Cell parameters: 9.656; 14.574; 17.635; 90; 90; 90;  

COD ID: 4038512
CIF file Formula: - C24 H25 B Br3 F2 N3 -
Comments: Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry 85(13) (2020) 8360-8370
Space group: P 1 21/c 1
Cell volume: 2594.7
Cell parameters: 12.489; 11.29; 18.975; 90; 104.119; 90;  

COD ID: 4038513
CIF file Formula: - C66 H68 B3 F6 N9 -
Comments: Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry 85(13) (2020) 8360-8370
Space group: P -1
Cell volume: 3126.8
Cell parameters: 10.9684; 17.472; 18.559; 114.162; 102.168; 93.667;  

COD ID: 4038514
CIF file Formula: - C30 H29 B Br2 Cl F2 N3 -
Comments: Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry 85(13) (2020) 8360-8370
Space group: P 21 21 21
Cell volume: 3079.3
Cell parameters: 8.7637; 17.0551; 20.6021; 90; 90; 90;  

COD ID: 4038515
CIF file Formula: - C30 H30 B F2 N3 -
Comments: Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry 85(13) (2020) 8360-8370
Space group: C 1 2/c 1
Cell volume: 5207.7
Cell parameters: 16.8071; 19.0449; 16.4613; 90; 98.752; 90;  

COD ID: 4038516
CIF file Formula: - C31 H24 Cl N O4 -
Comments: Zimnitskiy, Nikolay S.; Denikaev, Andrey D.; Barkov, Alexey Y.; Kutyashev, Igor B.; Korotaev, Vladislav Y.; Sosnovskikh, Vyacheslav Y. Catalyst-free Tandem 1,3-Dipolar Cycloaddition/Aldol Condensation: Diastereoselective Construction of the Azatetraquinane Skeleton. The Journal of organic chemistry 85(13) (2020) 8683-8694
Space group: P 1 21/n 1
Cell volume: 2515.3
Cell parameters: 9.7883; 26.2735; 10.597; 90; 112.636; 90;  

COD ID: 4038517
CIF file Formula: - C27 H38 N2 O2 Si -
Comments: Pati, Tanmay K.; Ajarul, Sk; Kundu, Mrinalkanti; Tayde, Deepak; Khamrai, Uttam; Maiti, Dilip K. Synthesis of Functionalized Arylacetamido-2-pyridones through <i>ortho</i>-C(sp<sup>2</sup>)-H-Activated Installation of Olefins and Alkynes. The Journal of organic chemistry 85(13) (2020) 8563-8579
Space group: P -1
Cell volume: 1276.72
Cell parameters: 8.8912; 11.9339; 12.6741; 85.22; 74.19; 80.966;  

COD ID: 4038518
CIF file Formula: - C27 H22 -
Comments: Nishida, Masaki; Lee, Donghyeon; Shintani, Ryo Intermolecular Three-Component Synthesis of Fluorene Derivatives by a Rhodium-Catalyzed Stitching Reaction/Remote Nucleophilic Substitution Sequence. The Journal of organic chemistry 85(13) (2020) 8489-8500
Space group: P 1 21/n 1
Cell volume: 1883
Cell parameters: 8.2882; 11.6286; 19.897; 90; 100.909; 90;  

COD ID: 4038519
CIF file Formula: - C31 H27 Cl N2 O2 -
Comments: Tejeneki, Hossein Zahedian; Nikbakht, Ali; Balalaie, Saeed; Rominger, Frank Regio- and Diastereoselective Indium-Catalyzed Conia-Ene Reaction of <i>ortho</i>-Alkynyl Diketopiperazines to Access Fused Diketopiperazinoindolines. The Journal of organic chemistry 85(13) (2020) 8544-8552
Space group: C 1 2/c 1
Cell volume: 4986.1
Cell parameters: 21.532; 8.0393; 29.212; 90; 99.5823; 90;  

COD ID: 4038520
CIF file Formula: - C31 H27 Br N2 O2 -
Comments: Tejeneki, Hossein Zahedian; Nikbakht, Ali; Balalaie, Saeed; Rominger, Frank Regio- and Diastereoselective Indium-Catalyzed Conia-Ene Reaction of <i>ortho</i>-Alkynyl Diketopiperazines to Access Fused Diketopiperazinoindolines. The Journal of organic chemistry 85(13) (2020) 8544-8552
Space group: P 21 21 21
Cell volume: 2524.2
Cell parameters: 15.5188; 21.4989; 7.5658; 90; 90; 90;  

COD ID: 4038544
CIF file Formula: - C14 H23 I O3 Si -
Comments: Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry 85(14) (2020) 8952-8989
Space group: P 1 21/c 1
Cell volume: 1689.75
Cell parameters: 21.9715; 6.3739; 12.0779; 90; 92.562; 90;  

COD ID: 4038545
CIF file Formula: - C19 H24 O5 -
Comments: Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry 85(14) (2020) 8952-8989
Space group: P 1 21 1
Cell volume: 832.43
Cell parameters: 11.2611; 6.3708; 12.0672; 90; 105.942; 90;  

COD ID: 4038546
CIF file Formula: - C23 H35 O5 -
Comments: Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry 85(14) (2020) 8952-8989
Space group: P c a 21
Cell volume: 4560.7
Cell parameters: 19.7853; 22.1644; 10.4; 90; 90; 90;  

COD ID: 4038547
CIF file Formula: - C21 H31 I O4 -
Comments: Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry 85(14) (2020) 8952-8989
Space group: P 1 21/c 1
Cell volume: 4262.76
Cell parameters: 17.2644; 11.1326; 23.6238; 90; 110.142; 90;  

COD ID: 4038548
CIF file Formula: - C21 H27 Cl O4 -
Comments: Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry 85(14) (2020) 8952-8989
Space group: F d d 2
Cell volume: 23601
Cell parameters: 64.915; 22.4355; 16.2049; 90; 90; 90;  

COD ID: 4038549
CIF file Formula: - C13 H19 I O3 -
Comments: Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry 85(14) (2020) 8952-8989
Space group: P 1 21/n 1
Cell volume: 4244.5
Cell parameters: 24.9006; 6.3095; 28.91; 90; 110.855; 90;  

COD ID: 4038564
CIF file Formula: - C25 H23 N3 O5 S2 -
Comments: Kumar, Chepuri V Suneel; Holyoke, Jr, Caleb W; Keller, Taylor M.; Fleming, Fraser F. Asmic Isocyanide [3 + 2] Cascade to Dihydrooxazoles and Dihydroimidazoles. The Journal of organic chemistry 85(14) (2020) 9153-9160
Space group: P 1 21/c 1
Cell volume: 2392.5
Cell parameters: 14.6337; 8.212; 19.9944; 90; 95.296; 90;  

COD ID: 4038639
CIF file Formula: - C43 H29 N O2 S -
Comments: Yang, Sheng-Yi; Tian, Qi-Sheng; Yu, You-Jun; Zou, Sheng-Nan; Li, Hong-Cheng; Khan, Aziz; Wu, Qian-Han; Jiang, Zuo-Quan; Liao, Liang-Sheng Sky-Blue Thermally Activated Delayed Fluorescence with Intramolecular Spatial Charge Transfer Based on a Dibenzothiophene Sulfone Emitter. The Journal of organic chemistry 85(16) (2020) 10628-10637
Space group: P 1 21/c 1
Cell volume: 3137.5
Cell parameters: 8.2499; 16.3857; 23.2184; 90; 91.583; 90;  

COD ID: 4038640
CIF file Formula: - C44 H28 Cl3 N O2 S -
Comments: Yang, Sheng-Yi; Tian, Qi-Sheng; Yu, You-Jun; Zou, Sheng-Nan; Li, Hong-Cheng; Khan, Aziz; Wu, Qian-Han; Jiang, Zuo-Quan; Liao, Liang-Sheng Sky-Blue Thermally Activated Delayed Fluorescence with Intramolecular Spatial Charge Transfer Based on a Dibenzothiophene Sulfone Emitter. The Journal of organic chemistry 85(16) (2020) 10628-10637
Space group: P 1 21/c 1
Cell volume: 3448.2
Cell parameters: 19.4003; 8.8494; 21.4549; 90; 110.588; 90;  

COD ID: 4038690
CIF file Formula: - C17 H15 N O2 Se -
Comments: Chen, Jia-Min; Qi, Lin; Zhang, Linlin; Li, Li-Jun; Hou, Cong-Ying; Li, Wei; Wang, Li-Jing Copper/DTBP-Promoted Oxyselenation of Propargylic Amines with Diselenides and CO<sub>2</sub>: Synthesis of Selenyl 2-Oxazolidinones. The Journal of organic chemistry 85(16) (2020) 10924-10933
Space group: P c a 21
Cell volume: 3096.1
Cell parameters: 18.769; 5.6852; 29.015; 90; 90; 90;  

COD ID: 4038740
CIF file Formula: - C23 H12 B Br F4 O2 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P -1
Cell volume: 932.01
Cell parameters: 8.406; 8.466; 14.6974; 89.549; 77.343; 66.477;  

COD ID: 4038741
CIF file Formula: - C24 H14 B Br F4 O3 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P -1
Cell volume: 1028.42
Cell parameters: 8.8561; 9.3777; 14.1453; 91.724; 98.862; 116.907;  

COD ID: 4038742
CIF file Formula: - C29 H26 B Br F4 N2 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P -1
Cell volume: 3398.1
Cell parameters: 12.7765; 16.0668; 17.3836; 77.279; 80.071; 80.432;  

COD ID: 4038743
CIF file Formula: - C55 H44 B2 Br2 Cl2 F8 N2 O4 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P 1
Cell volume: 1232.8
Cell parameters: 7.7507; 12.3048; 13.5177; 104.972; 95.439; 94.459;  

COD ID: 4038744
CIF file Formula: - C23 H11 Br O3 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P 1 21/c 1
Cell volume: 1575.88
Cell parameters: 20.2508; 4.24318; 19.0965; 90; 106.186; 90;  

COD ID: 4038745
CIF file Formula: - C29 H28 Br N O4 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P 1 21/n 1
Cell volume: 2496.25
Cell parameters: 8.9485; 21.3763; 13.2147; 90; 99.059; 90;  

COD ID: 4038746
CIF file Formula: - C28 H24 Br Cl2 N O2 -
Comments: Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry 85(18) (2020) 11908-11923
Space group: P -1
Cell volume: 1195.28
Cell parameters: 9.9075; 11.5025; 12.5629; 110.42; 95.401; 112.56;  

COD ID: 4038748
CIF file Formula: - C5 H6 F2 O2 -
Comments: Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry 85(19) (2020) 12692-12702
Space group: P 1 21/c 1
Cell volume: 572.05
Cell parameters: 5.422; 8.6988; 12.1636; 90; 94.341; 90;  

COD ID: 4038749
CIF file Formula: - C11 H10 F3 N O -
Comments: Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry 85(19) (2020) 12692-12702
Space group: P 1 21/n 1
Cell volume: 1027.3
Cell parameters: 5.1598; 11.2723; 17.688; 90; 93.058; 90;  

COD ID: 4038750
CIF file Formula: - C4 H8 Cl F2 N -
Comments: Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry 85(19) (2020) 12692-12702
Space group: P -1
Cell volume: 315.16
Cell parameters: 6.0157; 7.4732; 7.6279; 106.605; 105.053; 91.961;  

COD ID: 4038751
CIF file Formula: - C11 H10 F3 N O -
Comments: Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry 85(19) (2020) 12692-12702
Space group: P b c a
Cell volume: 2157.8
Cell parameters: 8.6036; 11.7912; 21.27; 90; 90; 90;  

COD ID: 4038753
CIF file Formula: - C13 H9 F N2 O2 S -
Comments: Nguyen, Thi Mo; Cao, Hoang Anh; Thuong Cao, Thi Thuong; Koyama, Satoki; Mac, Dinh Hung; Nguyen, Thanh Binh Access to [2,1]Benzothiazine <i>S</i>,<i>S</i>-Dioxides from β-Substituted <i>o</i>-Nitrostyrenes and Sulfur. The Journal of organic chemistry 85(19) (2020) 12058-12066
Space group: P 21 21 21
Cell volume: 1492.12
Cell parameters: 7.3094; 11.286; 18.0876; 90; 90; 90;  

COD ID: 4038754
CIF file Formula: - C13 H9 F N2 O2 S -
Comments: Nguyen, Thi Mo; Cao, Hoang Anh; Thuong Cao, Thi Thuong; Koyama, Satoki; Mac, Dinh Hung; Nguyen, Thanh Binh Access to [2,1]Benzothiazine <i>S</i>,<i>S</i>-Dioxides from β-Substituted <i>o</i>-Nitrostyrenes and Sulfur. The Journal of organic chemistry 85(19) (2020) 12058-12066
Space group: F d d 2
Cell volume: 4667.1
Cell parameters: 19.2656; 33.47; 7.2379; 90; 90; 90;  

COD ID: 4038755
CIF file Formula: - C14 H7 Br N2 S -
Comments: Sodre, Elaine R.; Guido, Bruna C.; de Souza, Paulo E. N.; Machado, Daniel F. S.; Carvalho-Silva, Valter H; Chaker, Juliano A.; Gatto, Claudia C.; Correa, Jose R.; Fernandes, Talita de A; Neto, Brenno A. D. Deciphering the Dynamics of Organic Nanoaggregates with AIEE Effect and Excited States: Lipophilic Benzothiadiazole Derivatives as Selective Cell Imaging Probes. The Journal of organic chemistry 85(19) (2020) 12614-12634
Space group: P 1 21/n 1
Cell volume: 1227.6
Cell parameters: 13.453; 4.8445; 19.075; 90; 99.076; 90;  

COD ID: 4038756
CIF file Formula: - C22 H12 N2 S -
Comments: Sodre, Elaine R.; Guido, Bruna C.; de Souza, Paulo E. N.; Machado, Daniel F. S.; Carvalho-Silva, Valter H; Chaker, Juliano A.; Gatto, Claudia C.; Correa, Jose R.; Fernandes, Talita de A; Neto, Brenno A. D. Deciphering the Dynamics of Organic Nanoaggregates with AIEE Effect and Excited States: Lipophilic Benzothiadiazole Derivatives as Selective Cell Imaging Probes. The Journal of organic chemistry 85(19) (2020) 12614-12634
Space group: P 1 21/c 1
Cell volume: 1711.5
Cell parameters: 12.0548; 10.6734; 13.4266; 90; 97.826; 90;  

COD ID: 4038757
CIF file Formula: - C18 H17 Br F N O2 -
Comments: Zhang, Lili; Deng, Kezuan; Wu, Gaorong; Yang, Jinyue; Tang, Shibiao; Fu, Xiaopan; Xia, Chengcai; Ji, Yafei Ruthenium(II)-Catalyzed α-Fluoroalkenylation of Oxime Ethers with <i>gem</i>-Difluorostyrenes <i>via</i> C-H Activation and C-F Cleavage. The Journal of organic chemistry 85(19) (2020) 12670-12681
Space group: P -1
Cell volume: 839.39
Cell parameters: 6.8494; 10.5416; 11.8942; 78.408; 89.07; 86.152;  

COD ID: 4038762
CIF file Formula: - C23 H15 N O2 S2 -
Comments: Chen, Xia; Zhang, Lianpeng; Wang, Yuzhe; Qiu, Guanyinsheng; Liang, Qinghui; Zhou, Hongwei Copper-Catalyzed Tandem Radical Cyclization of 8-Ethynyl-1-naphthyl-amines for the Synthesis of 2<i>H</i>-Benzo[<i>e</i>][1,2]thiazine 1,1-Dioxides and its Fluorescence Properties. The Journal of organic chemistry 85(19) (2020) 12526-12534
Space group: P 1 21/c 1
Cell volume: 1869.3
Cell parameters: 13.7554; 7.8485; 18.5; 90; 110.617; 90;  

COD ID: 4038763
CIF file Formula: - C20 H21 F O3 -
Comments: Wang, Shifang; Liu, Xiaowei; Zhu, Dongsheng; Wang, Mang Copper-Catalyzed Ring-Opening Defluorinative Alkylation of Siloxydifluorocyclopropanes: Synthesis of γ-Fluoro-δ-Ketoesters and γ,δ-Diketonitriles. The Journal of organic chemistry 85(19) (2020) 12408-12417
Space group: P 1 21/c 1
Cell volume: 1745.4
Cell parameters: 20.058; 14.261; 6.1046; 90; 91.741; 90;  

COD ID: 4038764
CIF file Formula: - C19 H17 N O2 -
Comments: Wang, Shifang; Liu, Xiaowei; Zhu, Dongsheng; Wang, Mang Copper-Catalyzed Ring-Opening Defluorinative Alkylation of Siloxydifluorocyclopropanes: Synthesis of γ-Fluoro-δ-Ketoesters and γ,δ-Diketonitriles. The Journal of organic chemistry 85(19) (2020) 12408-12417
Space group: P 1 21/n 1
Cell volume: 1530.2
Cell parameters: 5.942; 26.684; 9.9612; 90; 104.342; 90;  

COD ID: 4038765
CIF file Formula: - C25 H27 Cl N2 O4 S -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P 21 21 21
Cell volume: 2485.3
Cell parameters: 10.906; 13.6614; 16.6806; 90; 90; 90;  

COD ID: 4038766
CIF file Formula: - C19 H22 N2 O3 S -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P -1
Cell volume: 955.2
Cell parameters: 8.596; 10.656; 11.508; 107.17; 97.829; 103.488;  

COD ID: 4038767
CIF file Formula: - C18 H18 Cl2 N2 O3 -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P b c a
Cell volume: 3715.6
Cell parameters: 13.8795; 11.3828; 23.518; 90; 90; 90;  

COD ID: 4038768
CIF file Formula: - C24 H26 N2 O2 -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P 1 21/n 1
Cell volume: 2080
Cell parameters: 9.495; 15.333; 14.547; 90; 100.886; 90;  

COD ID: 4038769
CIF file Formula: - C26 H28 Cl N3 O2 -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P 1 21/n 1
Cell volume: 2381.2
Cell parameters: 12.1225; 12.8572; 15.2915; 90; 92.451; 90;  

COD ID: 4038770
CIF file Formula: - C15 H22 N2 O2 -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P 1 21/n 1
Cell volume: 3030.8
Cell parameters: 10.4657; 15.208; 19.367; 90; 100.511; 90;  

COD ID: 4038771
CIF file Formula: - C18 H29 N3 O2 -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P 1 21/n 1
Cell volume: 1743.1
Cell parameters: 8.066; 15.096; 14.762; 90; 104.125; 90;  

COD ID: 4038772
CIF file Formula: - C18 H17 Cl F N2 O2 S -
Comments: Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry 85(19) (2020) 12561-12578
Space group: P -1
Cell volume: 1862.9
Cell parameters: 9.244; 12.1783; 16.9973; 88.74; 82.005; 79.455;  

COD ID: 4038773
CIF file Formula: - C14 H25 N3 O7 -
Comments: Richaud, Alexis D.; Roche, Stéphane P Structure-Property Relationship Study of <i>N</i>-(Hydroxy)Peptides for the Design of Self-Assembled Parallel β-Sheets. The Journal of organic chemistry 85(19) (2020) 12329-12342
Space group: P 1 21 1
Cell volume: 1747
Cell parameters: 9.5051; 8.8409; 20.79; 90; 90.242; 90;  

COD ID: 4038774
CIF file Formula: - C11 H12 N2 S -
Comments: Geng, Xinyu; Liu, Siyuan; Wang, Wenyao; Qu, Jingping; Wang, Baomin <i>tert</i>-Amino Effect-Promoted Rearrangement of Aryl Isothiocyanate: A Versatile Approach to Benzimidazothiazepines and Benzimidazothioethers. The Journal of organic chemistry 85(19) (2020) 12635-12643
Space group: P -1
Cell volume: 492.57
Cell parameters: 6.5847; 8.4285; 9.4274; 89.0396; 72.6274; 80.7426;  

COD ID: 4038775
CIF file Formula: - C25 H32 O7 -
Comments: Chen, Shu-Rong; Wang, Shih-Wei; Sheu, Jyh-Horng; Chang, Ting-Hsuan; Cheng, Yuan-Bin Zoanthamine Alkaloid Derivatives from the Zoantharian <i>Zoanthus vietnamensis</i> with Antimetastatic Activity. The Journal of organic chemistry 85(19) (2020) 12553-12560
Space group: P 21 21 21
Cell volume: 2276.84
Cell parameters: 8.1574; 13.7272; 20.3329; 90; 90; 90;  

COD ID: 4038776
CIF file Formula: - C32 H26 N2 O4 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1331
Cell parameters: 8.9799; 10.3963; 15.1711; 96.679; 97.41; 106.252;  

COD ID: 4038777
CIF file Formula: - C36 H28 N2 O5 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P 1 21/c 1
Cell volume: 2900.6
Cell parameters: 14.3741; 11.5458; 17.6215; 90; 97.324; 90;  

COD ID: 4038778
CIF file Formula: - C24 H18 N2 O4 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1204.46
Cell parameters: 8.9949; 12.2989; 12.9055; 63.957; 71.155; 75.637;  

COD ID: 4038779
CIF file Formula: - C25 H20 N2 O4 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P 1 21/n 1
Cell volume: 2557.6
Cell parameters: 14.2296; 8.9965; 20.0891; 90; 96.003; 90;  

COD ID: 4038780
CIF file Formula: - C28 H20 N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1197.3
Cell parameters: 10.1008; 11.3688; 11.6597; 82.638; 64.947; 81.864;  

COD ID: 4038781
CIF file Formula: - C28 H19 Cl N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1239.3
Cell parameters: 10.2791; 11.3288; 11.7187; 90.027; 114.297; 94.437;  

COD ID: 4038782
CIF file Formula: - C32 H28 N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1373
Cell parameters: 11.444; 11.462; 12.299; 88.192; 63.357; 73.396;  

COD ID: 4038783
CIF file Formula: - C32 H27 Cl N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1392.8
Cell parameters: 8.426; 11.0834; 15.3702; 91.376; 96.474; 102.111;  

COD ID: 4038784
CIF file Formula: - C32 H27 F N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P -1
Cell volume: 1384.85
Cell parameters: 8.3862; 11.0478; 15.4388; 91.9752; 96.6881; 102.411;  

COD ID: 4038785
CIF file Formula: - C36 H28 N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P 1 21/n 1
Cell volume: 2963.5
Cell parameters: 8.3197; 18.7648; 19.0758; 90; 95.6621; 90;  

COD ID: 4038786
CIF file Formula: - C35 H25 F N2 O6 S -
Comments: Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry 85(19) (2020) 12117-12127
Space group: P n a 21
Cell volume: 3022.9
Cell parameters: 15.1594; 13.7549; 14.4974; 90; 90; 90;  

COD ID: 4038787
CIF file Formula: - C16 H16 N2 -
Comments: Aksenov, Nicolai A.; Aksenov, Dmitrii A.; Skomorokhov, Anton A.; Prityko, Lidiya A.; Aksenov, Alexander V.; Griaznov, Georgii D.; Rubin, Michael Synthesis of 2-(1<i>H</i>-Indol-2-yl)acetamides via Brønsted Acid-Assisted Cyclization Cascade. The Journal of organic chemistry 85(19) (2020) 12128-12146
Space group: P b c a
Cell volume: 2612.52
Cell parameters: 11.62377; 11.62379; 19.3359; 90; 90; 90;  

COD ID: 4038788
CIF file Formula: - C22 H32 N2 O9 P2 -
Comments: Shu, Zhihao; Zhou, Jianhui; Li, Junyou; Cheng, Yilang; Liu, Hong; Wang, Dechuan; Zhou, Yu Rh(III)-Catalyzed Dual C-H Functionalization/Cyclization Cascade by a Removable Directing Group: A Method for Synthesis of Polycyclic Fused Pyrano[<i>de</i>]Isochromenes. The Journal of organic chemistry 85(19) (2020) 12097-12107
Space group: P 1 21/c 1
Cell volume: 2548.7
Cell parameters: 10.246; 21.331; 12.725; 90; 113.59; 90;  

COD ID: 4038789
CIF file Formula: - C17 H22 O8 P2 -
Comments: Shu, Zhihao; Zhou, Jianhui; Li, Junyou; Cheng, Yilang; Liu, Hong; Wang, Dechuan; Zhou, Yu Rh(III)-Catalyzed Dual C-H Functionalization/Cyclization Cascade by a Removable Directing Group: A Method for Synthesis of Polycyclic Fused Pyrano[<i>de</i>]Isochromenes. The Journal of organic chemistry 85(19) (2020) 12097-12107
Space group: C 1 2/c 1
Cell volume: 1938.1
Cell parameters: 22.428; 8.079; 10.933; 90; 101.949; 90;  

COD ID: 4038790
CIF file Formula: - C16 H15 O4 P -
Comments: Shu, Zhihao; Zhou, Jianhui; Li, Junyou; Cheng, Yilang; Liu, Hong; Wang, Dechuan; Zhou, Yu Rh(III)-Catalyzed Dual C-H Functionalization/Cyclization Cascade by a Removable Directing Group: A Method for Synthesis of Polycyclic Fused Pyrano[<i>de</i>]Isochromenes. The Journal of organic chemistry 85(19) (2020) 12097-12107
Space group: P b c a
Cell volume: 2879.97
Cell parameters: 13.6; 7.1637; 29.5605; 90; 90; 90;  

COD ID: 4038791
CIF file Formula: - C39 H28 Br N O6 S -
Comments: Yan, Juzhang; Li, Xiaoping; Chen, Yuzhen; Li, Ying; Chen, Weiwen; Zhan, Ruoting; Huang, Huicai Organocatalytic 1,4-Addition of Azadienes with 3-Homoacyl Coumarins toward Highly Enantioenriched Benzofuran Coumarin Skeletons. The Journal of organic chemistry 85(19) (2020) 12175-12186
Space group: P 41 21 2
Cell volume: 7873.58
Cell parameters: 23.9795; 23.9795; 13.6928; 90; 90; 90;  

COD ID: 4038792
CIF file Formula: - C11 H9 N3 O -
Comments: Wang, Jian; Li, Jiang-Hua; Guo, Yidong; Dong, Hongbo; Liu, Qiang; Yu, Xiao-Qi TEMPO-Mediated C-H Amination of Benzoxazoles with N-Heterocycles. The Journal of organic chemistry 85(19) (2020) 12797-12803
Space group: P -1
Cell volume: 467.42
Cell parameters: 7.073; 8.1167; 8.7016; 86.895; 81.037; 71.308;  

COD ID: 4038793
CIF file Formula: - C47 H44 N4 O -
Comments: Selby, Joshua; Holzapfel, Marco; Lombe, Blaise Kimbadi; Schmidt, David; Krause, Ana-Maria; Würthner, Frank; Bringmann, Gerhard; Lambert, Christoph Chiroptical Properties of Indolenine Squaraines with a Stereogenic Center at Close Proximity. The Journal of organic chemistry 85(19) (2020) 12227-12242
Space group: P 1 21 1
Cell volume: 1918.4
Cell parameters: 9.5514; 10.8418; 18.966; 90; 102.372; 90;  

COD ID: 4038794
CIF file Formula: - C41 H48 N4 O -
Comments: Selby, Joshua; Holzapfel, Marco; Lombe, Blaise Kimbadi; Schmidt, David; Krause, Ana-Maria; Würthner, Frank; Bringmann, Gerhard; Lambert, Christoph Chiroptical Properties of Indolenine Squaraines with a Stereogenic Center at Close Proximity. The Journal of organic chemistry 85(19) (2020) 12227-12242
Space group: P 1 21 1
Cell volume: 1773.3
Cell parameters: 12.5152; 8.1909; 18.3478; 90; 109.467; 90;  

COD ID: 4038795
CIF file Formula: - C20 H21 F3 N2 O7 -
Comments: Li, Luyao; Yang, Tianxiao; Zhang, Tao; Zhu, Bo; Chang, Junbiao Organocatalytic Asymmetric Tandem Cyclization/Michael Addition via Oxazol-5(2<i>H</i>)-One Formation: Access to Perfluoroalkyl-Containing <i>N</i>,<i>O</i>-Acetal Derivatives. The Journal of organic chemistry 85(19) (2020) 12294-12303
Space group: P 21 21 21
Cell volume: 2592.2
Cell parameters: 7.13243; 12.32391; 29.4905; 90; 90; 90;  

COD ID: 4038796
CIF file Formula: - C15 H18 O S2 -
Comments: Wang, Panpan; Jiang, Qian; Zhao, Ruibo; Xie, Xingang; Tang, Shouchu; Wang, Xiaolei Enantioselective α-Functionalization of 1,3-Dithianes by Iridium-Catalyzed Allylic Substitution. The Journal of organic chemistry 85(19) (2020) 12456-12467
Space group: P 1 21 1
Cell volume: 725.83
Cell parameters: 8.4921; 11.0952; 8.7511; 90; 118.324; 90;  

COD ID: 4038797
CIF file Formula: - C9 H14 O2 S2 -
Comments: Wang, Panpan; Jiang, Qian; Zhao, Ruibo; Xie, Xingang; Tang, Shouchu; Wang, Xiaolei Enantioselective α-Functionalization of 1,3-Dithianes by Iridium-Catalyzed Allylic Substitution. The Journal of organic chemistry 85(19) (2020) 12456-12467
Space group: P 1 21 1
Cell volume: 1081.2
Cell parameters: 11.774; 6.7993; 13.767; 90; 101.189; 90;  

COD ID: 4038798
CIF file Formula: - C128.25 H170.25 Cl6.75 O6 -
Comments: Iuliano, Veronica; Talotta, Carmen; Gaeta, Carmine; Hickey, Neal; Geremia, Silvano; Vatsouro, Ivan; Kovalev, Vladimir; Neri, Placido Influence of <i>exo</i>-Adamantyl Groups and <i>endo</i>-OH Functions on the Threading of Calix[6]arene Macrocycle. The Journal of organic chemistry 85(19) (2020) 12585-12593
Space group: P -1
Cell volume: 5583
Cell parameters: 12.959; 15.165; 29.378; 75.8; 86.69; 86.896;  

COD ID: 4038799
CIF file Formula: - C112 H136 Cl12 O6 -
Comments: Iuliano, Veronica; Talotta, Carmen; Gaeta, Carmine; Hickey, Neal; Geremia, Silvano; Vatsouro, Ivan; Kovalev, Vladimir; Neri, Placido Influence of <i>exo</i>-Adamantyl Groups and <i>endo</i>-OH Functions on the Threading of Calix[6]arene Macrocycle. The Journal of organic chemistry 85(19) (2020) 12585-12593
Space group: P -1
Cell volume: 2545
Cell parameters: 12.338; 15.813; 15.886; 62.331; 80.881; 68.02;  

COD ID: 4038800
CIF file Formula: - C56 H48 N4 -
Comments: Rakshit, Amitava; Kumar, Prashant; Alam, Tipu; Dhara, Hirendranath; Patel, Bhisma K. Visible-Light-Accelerated Pd-Catalyzed Cascade Addition/Cyclization of Arylboronic Acids to γ- and β-Ketodinitriles for the Construction of 3-Cyanopyridines and 3-Cyanopyrrole Analogues. The Journal of organic chemistry 85(19) (2020) 12482-12504
Space group: P 1 21/n 1
Cell volume: 4429.2
Cell parameters: 12.124; 21.984; 16.7347; 90; 96.781; 90;  

COD ID: 4038801
CIF file Formula: - C21 H20 Br N O2 S -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: P 1 21/c 1
Cell volume: 1968.65
Cell parameters: 13.6616; 9.18547; 17.0339; 90; 112.93; 90;  

COD ID: 4038802
CIF file Formula: - C23 H19 N O3 S -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: C 1 2/c 1
Cell volume: 3878.58
Cell parameters: 17.59534; 10.30762; 22.2729; 90; 106.229; 90;  

COD ID: 4038803
CIF file Formula: - C41 H40 N2 O4 S2 -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: P n a 21
Cell volume: 3844
Cell parameters: 21.6005; 9.3977; 18.9366; 90; 90; 90;  

COD ID: 4038804
CIF file Formula: - C24 H17 N O3 S -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: P -1
Cell volume: 1045.48
Cell parameters: 9.6034; 10.0317; 12.4075; 99.201; 111.404; 102.937;  

COD ID: 4038805
CIF file Formula: - C26 H21 N O2 S -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: P 1 21/c 1
Cell volume: 2162.1
Cell parameters: 15.6423; 16.3109; 8.6514; 90; 101.62; 90;  

COD ID: 4038806
CIF file Formula: - C25 H18 F N O2 S -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: P n a 21
Cell volume: 2017.5
Cell parameters: 13.6766; 12.8566; 11.474; 90; 90; 90;  

COD ID: 4038807
CIF file Formula: - C22.5 H22 Cl N O2 S -
Comments: Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry 85(19) (2020) 12270-12283
Space group: C 1 2/c 1
Cell volume: 4258.1
Cell parameters: 27.805; 10.095; 15.272; 90; 96.621; 90;  

COD ID: 4038815
CIF file Formula: - C19 H20 B F4 N O -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P 1 21/n 1
Cell volume: 1770.2
Cell parameters: 15.456; 7.0443; 16.266; 90; 91.746; 90;  

COD ID: 4038816
CIF file Formula: - C18 H18 B F4 N O -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P -1
Cell volume: 3331.7
Cell parameters: 9.2376; 16.4663; 23.0599; 101.102; 91.828; 103.786;  

COD ID: 4038817
CIF file Formula: - C22 H20 B F4 N -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P 1 21/n 1
Cell volume: 1847.83
Cell parameters: 12.0267; 8.0762; 19.1306; 90; 96.044; 90;  

COD ID: 4038818
CIF file Formula: - C18 H21 B F4 N2 -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P 1 21/c 1
Cell volume: 1708.35
Cell parameters: 12.1916; 9.9536; 14.3268; 90; 100.697; 90;  

COD ID: 4038819
CIF file Formula: - C19 H14 B F4 N -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P 1 21/n 1
Cell volume: 1545.94
Cell parameters: 8.3874; 12.2927; 15.2185; 90; 99.854; 90;  

COD ID: 4038820
CIF file Formula: - C17 H15 N O -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P n a 21
Cell volume: 1273.4
Cell parameters: 6.165; 17.073; 12.098; 90; 90; 90;  

COD ID: 4038821
CIF file Formula: - C18 H15 N O -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P 1 21/c 1
Cell volume: 1319.4
Cell parameters: 9.4054; 14.334; 9.7907; 90; 91.688; 90;  

COD ID: 4038822
CIF file Formula: - C26 H20 B2 F8 N2 O -
Comments: Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry 85(19) (2020) 12468-12481
Space group: P 1 21/c 1
Cell volume: 2344.3
Cell parameters: 14.3987; 13.0464; 12.6405; 90; 99.152; 90;  

COD ID: 4038823
CIF file Formula: - C18 H14 N2 O3 -
Comments: Mittendorf, Fabia; Mohr, Fabian; Kirsch, Stefan F. Ring Expansion of 2-Azido-2-phenyl-indan-1,3-dione for the Generation of Heterocyclic Scaffolds. The Journal of organic chemistry 85(19) (2020) 12760-12769
Space group: P 21 21 21
Cell volume: 1460.85
Cell parameters: 8.0529; 8.1749; 22.1907; 90; 90; 90;  

COD ID: 4038824
CIF file Formula: - C23 H20 N2 O3 -
Comments: Mittendorf, Fabia; Mohr, Fabian; Kirsch, Stefan F. Ring Expansion of 2-Azido-2-phenyl-indan-1,3-dione for the Generation of Heterocyclic Scaffolds. The Journal of organic chemistry 85(19) (2020) 12760-12769
Space group: P 1 21/n 1
Cell volume: 3623.2
Cell parameters: 13.0463; 12.6415; 22.773; 90; 105.273; 90;  

COD ID: 4038827
CIF file Formula: - C22 H27 N3 -
Comments: Zhang, Zengyu; Huang, Shiqing; Huang, Linwei; Xu, Xingyu; Zhao, Hongyan; Yan, Xiaoyu Synthesis of Mesoionic N-Heterocyclic Olefins and Catalytic Application for Hydroboration Reactions. The Journal of organic chemistry 85(19) (2020) 12036-12043
Space group: C 1 2/c 1
Cell volume: 1936.8
Cell parameters: 22.445; 10.5768; 8.1673; 90; 92.685; 90;  

COD ID: 4038828
CIF file Formula: - C28 H39 N3 -
Comments: Zhang, Zengyu; Huang, Shiqing; Huang, Linwei; Xu, Xingyu; Zhao, Hongyan; Yan, Xiaoyu Synthesis of Mesoionic N-Heterocyclic Olefins and Catalytic Application for Hydroboration Reactions. The Journal of organic chemistry 85(19) (2020) 12036-12043
Space group: P -1
Cell volume: 1288.6
Cell parameters: 8.9279; 12.3384; 13.3669; 66.588; 81.982; 72.54;  

COD ID: 4038833
CIF file Formula: - C23 H16 B F3 N2 O -
Comments: Yang, Tianbao; Cao, Xin; Zhang, Xing-Xing; Ou, Yifeng; Au, Chak-Tong; Yin, Shuang-Feng; Qiu, Renhua Iodine-Catalyzed Synthesis of <i>N,N</i>'-Chelate Organoboron Aminoquinolate. The Journal of organic chemistry 85(19) (2020) 12430-12443
Space group: P 1 21/c 1
Cell volume: 1852.2
Cell parameters: 9.638; 16.4283; 12.1516; 90; 105.707; 90;  

COD ID: 4038834
CIF file Formula: - C25 H17 B Br F3 N2 O4 -
Comments: Yang, Tianbao; Cao, Xin; Zhang, Xing-Xing; Ou, Yifeng; Au, Chak-Tong; Yin, Shuang-Feng; Qiu, Renhua Iodine-Catalyzed Synthesis of <i>N,N</i>'-Chelate Organoboron Aminoquinolate. The Journal of organic chemistry 85(19) (2020) 12430-12443
Space group: P 1 21/c 1
Cell volume: 2312.27
Cell parameters: 17.3714; 14.8912; 9.2154; 90; 104.076; 90;  

COD ID: 4038835
CIF file Formula: - C29 H36 N2 O5 Si -
Comments: Zhang, Yan-Xue; Chen, Ling-Yan; Sun, Jian-Ting; Si, Chang-Mei; Wei, Bang-Guo Gold-Catalyzed Addition-<i>N</i>-Boc Cleavage-Cyclization of <i>N</i>,<i>O</i>-Acetal with Ynamides for Construction of 6-(<i>tert</i>-Butyldimethylsilyl)oxy-tetrahydropyrrolo[1,2-<i>c</i>][1,3]oxazin-1-ones. The Journal of organic chemistry 85(19) (2020) 12603-12613
Space group: P -1
Cell volume: 1563.19
Cell parameters: 10.2581; 11.4654; 14.5949; 70.423; 85.801; 75.155;  

COD ID: 4038838
CIF file Formula: - C16 H18 O2 S -
Comments: Li, Shu-Sen; Wang, Jianbo Cu(I)/Chiral Bisoxazoline-Catalyzed Enantioselective Sommelet-Hauser Rearrangement of Sulfonium Ylides. The Journal of organic chemistry 85(19) (2020) 12343-12358
Space group: P 1 21 1
Cell volume: 713.4
Cell parameters: 9.6838; 8.3369; 9.8668; 90; 116.416; 90;  

COD ID: 4038859
CIF file Formula: - C39 H34 N3 O P -
Comments: Pattarawarapan, Mookda; Yamano, Dolnapa; Wiriya, Nittaya; Yimklan, Saranphong; Phakhodee, Wong Simultaneous Formation and Functionalization of Aryliminophosphoranes Using 1,3-Dihydro-1<i>H</i>-benzimidazol-2-ones as Precursors. The Journal of organic chemistry 85(20) (2020) 13330-13338
Space group: P 1 21/c 1
Cell volume: 3246.27
Cell parameters: 9.2046; 16.5447; 21.3255; 90; 91.645; 90;  

COD ID: 4038863
CIF file Formula: - C26 H21 N O2 -
Comments: Debnath, Sudipto; Das, Tuluma; Pati, Tanmay K.; Majumdar, Swapan; Maiti, Dilip K. Metal-Free Indole-Phenacyl Bromide Cyclization: A Regioselective Synthesis of 3,5-Diarylcarbazoles. The Journal of organic chemistry 85(20) (2020) 13272-13279
Space group: P 1 21 1
Cell volume: 966.4
Cell parameters: 10.676; 8.467; 11.173; 90; 106.897; 90;  

COD ID: 4038875
CIF file Formula: - C24 H27 N O4 -
Comments: Zhen, Li; Tong, Shuo; Zhu, Jieping; Wang, Mei-Xiang Construction of the Erythrinane Core Skeleton via Asymmetric Catalytic Cascade Reaction of Tertiary Enamides. The Journal of organic chemistry 85(20) (2020) 13211-13219
Space group: P 21 21 21
Cell volume: 2101.05
Cell parameters: 6.7505; 13.9462; 22.3174; 90; 90; 90;  

COD ID: 4038876
CIF file Formula: - C24 H27 N O4 -
Comments: Zhen, Li; Tong, Shuo; Zhu, Jieping; Wang, Mei-Xiang Construction of the Erythrinane Core Skeleton via Asymmetric Catalytic Cascade Reaction of Tertiary Enamides. The Journal of organic chemistry 85(20) (2020) 13211-13219
Space group: P 21 21 21
Cell volume: 2037.69
Cell parameters: 6.0637; 16.8612; 19.9302; 90; 90; 90;  


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