Crystallography Open Database
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|---|---|---|---|---|---|---|
| 4038835 | CIF | C29 H36 N2 O5 Si | P -1 | 10.2581; 11.4654; 14.5949 70.423; 85.801; 75.155 | 1563.19 | 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, 2020, 85, 12603-12613 |
| 4038836 | CIF | C26 H24 N O P | P b c a | 18.889; 11.865; 19.04 90; 90; 90 | 4267.2 | Lim, Taehyun; Kim, Byeong Moon Synthesis of α-aminophosphonates via phosphonylation of an aryne-imine adduct. The Journal of organic chemistry, 2020 |
| 4038837 | CIF | C28 H27 N O3 | P -1 | 11.4662; 13.068; 16.186 82.877; 88.111; 79.015 | 2362.4 | Lepovitz, Lance T.; Martin, Stephen F. Biomimetically Inspired, One-Step Synthesis of Exotine A and Exotine B. The Journal of organic chemistry, 2020 |
| 4038838 | CIF | C16 H18 O2 S | P 1 21 1 | 9.6838; 8.3369; 9.8668 90; 116.416; 90 | 713.4 | Li, Shu-Sen; Wang, Jianbo Cu(I)/Chiral Bisoxazoline-Catalyzed Enantioselective Sommelet-Hauser Rearrangement of Sulfonium Ylides. The Journal of organic chemistry, 2020, 85, 12343-12358 |
| 4038839 | CIF | C16 H14 N2 | C 1 c 1 | 23.2393; 7.5636; 7.3759 90; 100.902; 90 | 1273.08 | Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020 |
| 4038840 | CIF | C16 H20 N2 | P 1 n 1 | 6.381; 13.803; 7.88 90; 95.82; 90 | 690.5 | Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020 |
| 4038841 | CIF | C21 H18 N2 O2 | P 1 c 1 | 7.327; 15.647; 7.711 90; 96.781; 90 | 877.8 | Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020 |
| 4038842 | CIF | C29 H38 N O2 P | P 1 21/n 1 | 11.799; 18.531; 12.441 90; 101.186; 90 | 2668.5 | Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020 |
| 4038843 | CIF | C28 H22 N O3 P | P -1 | 8.3188; 9.3992; 15.4909 75.866; 82.881; 74.752 | 1130.91 | Lou, Qin-Xin; Niu, Yuan; Qi, Zhi-Chao; Yang, Shang-Dong Ir(III)-Catalyzed C-H Functionalization of Triphenylphosphine Oxide Towards 3-Aryl Oxindoles. The Journal of organic chemistry, 2020 |
| 4038844 | CIF | C21 H24 N2 O2 | P -1 | 8.7033; 10.3399; 11.7859 113.729; 92.491; 101.392 | 942.86 | Yang, Zi; Yue, Qi; Yang, Mengqi; Zhang, Hong; Cui, Xiuling Ru(II)-catalyzed tunable cascade reaction via C-H/C-C bond cleavage. The Journal of organic chemistry, 2020 |
| 4038845 | CIF | C24 H23 N3 O2 | P 1 21/c 1 | 9.8585; 9.5244; 21.7395 90; 99.223; 90 | 2014.9 | Golmohammadi, Farhad; Balalaie, Saeed; Fathi Vavsari, Vaezeh; Anwar, Muhammad U.; Al-Harrasi, Ahmed Synthesis of Spiro-β-lactam-pyrroloquinolines as Fused Heterocyclic Scaffolds through Post-transformation Reactions The Journal of Organic Chemistry, 2020 |
| 4038846 | CIF | C18 H16 Cl N O3 | P 1 21/n 1 | 10.01784; 10.98794; 15.5845 90; 105.645; 90 | 1651.92 | Peng, Haiyun; Zhang, Yu; Zhu, Yang; Deng, Guisheng Silver(I)-catalyzed Domino Cyclization/Cyclopropanation/Ring-Cleavage/Nucleophilic Substitution Reaction of Enynones with Enamines: Synthesis of 4-(furan-2-yl)-3,4-dihydro-2<i>H</i>-pyrrol-2-one. The Journal of organic chemistry, 2020 |
| 4038847 | CIF | C19 H19 N O S2 | P c a 21 | 9.4553; 7.4507; 24.9074 90; 90; 90 | 1754.69 | Cheng, Bin; Li, Hui; Hou, Jieping; Zhang, Xinping; He, Yixuan; Sun, Haiyan; Xu, Wei; Wang, Taimin; Zhai, Hongbin Synthesis of 3,4-Dihydro-2H-1,3-thiazines from α-Enolic Dithioesters and 1,3,5-Triazinanes via a Formal (3 + 3) Annulation Reaction The Journal of Organic Chemistry, 2020 |
| 4038848 | CIF | C18 H22 N2 O6 | P 21 21 21 | 5.921; 9.6597; 32.1824 90; 90; 90 | 1840.68 | Yuan, Jinping; Jain, Pankaj; Antilla, Jon C. Bi(cyclopentyl)diol-Derived Boronates in Highly Enantioselective Chiral Phosphoric Acid-Catalyzed Allylation, Propargylation and Crotylation of Aldehydes. The Journal of organic chemistry, 2020 |
| 4038849 | CIF | C13 H12 N2 O | P n a 21 | 9.11; 10.547; 11.7739 90; 90; 90 | 1131.27 | Zhao, Yulei; Guo, Xuqiang; Si, Zhiyao; Hu, Yanan; Sun, Ying; Liu, Yunlin; Ji, Zhongyin; You, Jinmao Hydrosilane-Assisted Synthesis of Urea Derivatives from CO<sub>2</sub> and Amines. The Journal of organic chemistry, 2020 |
| 4038850 | CIF | C21 H17 Br N2 O | P 1 21/c 1 | 16.1173; 6.0319; 19.9118 90; 110.983; 90 | 1807.42 | Kumar, Jogendra; Suresh, Eringathodi; Bhadra, Sukalyan Catalytic Direct α-Amination of Arylacetic Acid Synthons with Anilines The Journal of Organic Chemistry, 2020 |
| 4038851 | CIF | C24 H18 N2 S | P 1 21/c 1 | 10.0472; 9.0898; 20.6002 90; 98.372; 90 | 1861.3 | Kumar, Jogendra; Suresh, Eringathodi; Bhadra, Sukalyan Catalytic Direct α-Amination of Arylacetic Acid Synthons with Anilines The Journal of Organic Chemistry, 2020 |
| 4038852 | CIF | C15 H11 Br O2 | P 1 21/n 1 | 9.5102; 8.4541; 16.722 90; 104.133; 90 | 1303.76 | Hu, Sha; Lu, Zuolin; Liu, Minjie; Xu, Hanlin; Wu, Jiale; Chen, Fener TfOH-Catalyzed Cascade C-H Activation/Lactonization of Phenols with alpha-Aryl-alpha-Diazoesters: Rapid Access to alpha-Aryl Benzofuranones. The Journal of organic chemistry, 2020 |
| 4038853 | CIF | C93 H87 N4 O4 | P 1 21/c 1 | 19.334; 15.9626; 24.978 90; 97.191; 90 | 7648.1 | Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020 |
| 4038854 | CIF | C85 H80 Cl2 N4 O4 | P 1 21/n 1 | 13.151; 18.373; 29.23 90; 97.522; 90 | 7002 | Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020 |
| 4038855 | CIF | C85 H80 Cl2 N4 O4 | P 1 21/c 1 | 14.701; 38.079; 14.624 90; 110.677; 90 | 7659.2 | Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020 |
| 4038856 | CIF | C85.52 H83.04 Cl5.04 N4 O12 | P -1 | 15.172; 15.412; 17.553 81.596; 75.237; 86.921 | 3925.7 | Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020 |
| 4038857 | CIF | C87.5 H83 Cl3 F6 N4 O10 S2 | P -1 | 15.715; 15.84; 16.452 97.24; 90.434; 99.096 | 4010 | Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020 |
| 4038858 | CIF | C86 H81 Cl3 N4 O5 Zn | P -1 | 15.3192; 16.6129; 17.287 92.847; 100.839; 108.55 | 4068.1 | Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020 |
| 4038859 | CIF | C39 H34 N3 O P | P 1 21/c 1 | 9.2046; 16.5447; 21.3255 90; 91.645; 90 | 3246.27 | 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, 2020, 85, 13330-13338 |
| 4038860 | CIF | C22 H28 N O6.5 | C 1 2/c 1 | 22.801; 17.372; 13.239 90; 94.494; 90 | 5228 | Xiong, Wei; Wang, Xiaohong; Shen, Xianyan; Hu, Cuifang; Wang, Xin; Wang, Fei; Zhang, Guolin; Wang, Chun Synthesis of Flavonols via Pyrrolidine Catalysis: Origins of the Selectivity for Flavonol versus Aurone. The Journal of organic chemistry, 2020 |
| 4038861 | CIF | C26 H41 Br O4 Si | P 1 21 1 | 7.756; 43.788; 9.04 90; 114.516; 90 | 2793.4 | Kleiner, Yolanda; Hammann, Peter; Becker, Jonathan; Bauer, Armin; Pöverlein, Christoph; Schuler, Sören M M Total Synthesis and Structure Revision of (-)-Avicennone C. The Journal of organic chemistry, 2020 |
| 4038862 | CIF | C15 H16 O3 | P 65 | 24.0111; 24.0111; 22.65 90; 90; 120 | 11309 | Kleiner, Yolanda; Hammann, Peter; Becker, Jonathan; Bauer, Armin; Pöverlein, Christoph; Schuler, Sören M M Total Synthesis and Structure Revision of (-)-Avicennone C. The Journal of organic chemistry, 2020 |
| 4038863 | CIF | C26 H21 N O2 | P 1 21 1 | 10.676; 8.467; 11.173 90; 106.897; 90 | 966.4 | 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, 2020, 85, 13272-13279 |
| 4038864 | CIF | C22 H21 O3 P | P 1 21/c 1 | 10.434; 6.0505; 29.2143 90; 96.876; 90 | 1831.1 | Han, Zeyu; Röhner, David; Samedov, Kerim; Gates, Derek P. Isolable Phosphaalkenes Bearing 2,4,6-Trimethoxyphenyl and 2,6-Bis(trifluoromethyl)phenyl as P-Substituents. The Journal of organic chemistry, 2020 |
| 4038865 | CIF | C9 H13 O3 P | P 1 21/n 1 | 10.6804; 7.2713; 12.814 90; 90.712; 90 | 995.06 | Han, Zeyu; Röhner, David; Samedov, Kerim; Gates, Derek P. Isolable Phosphaalkenes Bearing 2,4,6-Trimethoxyphenyl and 2,6-Bis(trifluoromethyl)phenyl as P-Substituents. The Journal of organic chemistry, 2020 |
| 4038866 | CIF | C21 H13 F6 P | P 1 21/n 1 | 9.7568; 16.9083; 11.2062 90; 94.842; 90 | 1842.1 | Han, Zeyu; Röhner, David; Samedov, Kerim; Gates, Derek P. Isolable Phosphaalkenes Bearing 2,4,6-Trimethoxyphenyl and 2,6-Bis(trifluoromethyl)phenyl as P-Substituents. The Journal of organic chemistry, 2020 |
| 4038867 | CIF | C42 H58 N2 P4 | C 1 2/c 1 | 21.8967; 8.026; 25.7249 90; 111.928; 90 | 4193.9 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038868 | CIF | C48 H66 N2 P4 | P -1 | 12.6527; 13.775; 16.0646 104.584; 98.638; 115.784 | 2329 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038869 | CIF | C44 H62 N2 P4 | P -1 | 11.3964; 13.8689; 15.4979 106.832; 103.174; 105.045 | 2139.1 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038870 | CIF | C24 H29 N3 O2 P2 | P -1 | 10.11; 11.896; 12.699 113.23; 104.32; 98.18 | 1310 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038871 | CIF | C42 H58 B2 F8 N2 Ni P4 | P 1 21/c 1 | 13.1558; 21.3869; 16.3943 90; 108.413; 90 | 4376.58 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038872 | CIF | C48 H58 B2 F8 N6 Ni P4 | P -1 | 10.99; 13.243; 20.297 88.718; 84.969; 71.022 | 2782.6 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038873 | CIF | C52 H66 B2 F8 N6 Ni O0 P4 | P 1 21 1 | 10.957; 19.503; 13.36 90; 106.509; 90 | 2737.3 | Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020 |
| 4038874 | CIF | C21 H27 N2 O6 | P -1 | 8.1218; 11.2194; 13.0487 65.267; 79.27; 78.503 | 1051.2 | Chen, Yanhui; Lv, Weiwei; Ba, Dan; Wen, Si; Cheng, Guolin Palladium-Catalyzed Chemoselective Synthesis of 2-Aminocinnamyl Esters via Sequential Amination and Olefination of Aryl Iodides. The Journal of organic chemistry, 2020 |
| 4038875 | CIF | C24 H27 N O4 | P 21 21 21 | 6.7505; 13.9462; 22.3174 90; 90; 90 | 2101.05 | 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, 2020, 85, 13211-13219 |
| 4038876 | CIF | C24 H27 N O4 | P 21 21 21 | 6.0637; 16.8612; 19.9302 90; 90; 90 | 2037.69 | 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, 2020, 85, 13211-13219 |
| 4038877 | CIF | C93 H65 Cl3 O7 | P 1 | 6.3659; 17.1828; 20.1654 66.231; 89.24; 89.986 | 2018.46 | Zhang, Xiang-Zhi; Li, Bao Qiong; Qiu, Zong-Wang; Ma, Aijun; Peng, Jin-Bao; Du, Ji-Yuan; Feng, Na; Xu, Xue-Tao; Pan, Han-Peng Synthesis of Naphthopyrans <i>via</i> Formal (3+3)-Annulation of Propargylic (Aza)-<i>para</i>-Quinone Methides with Naphthols. The Journal of organic chemistry, 2020 |
| 4038878 | CIF | C20 H18 Br N O2 | P 21 21 21 | 6.4266; 15.5268; 16.3329 90; 90; 90 | 1629.77 | Yadav, Jyothi; Pawar, Amol Prakash; Nagare, Yadav Kacharu; Iype, Eldhose; Rangan, Krishnan; Ohshita, Joji; Kumar, Dalip; Kumar, Indresh Direct Amine-Catalyzed Enantioselective Synthesis of Pentacyclic Dibenzo[<i>b</i>,<i>f</i>][1,4]oxazepine/Thiazepine-Fused Isoquinuclidines along with DFT Calculations. The Journal of organic chemistry, 2020 |
| 4038879 | CIF | C16 H24 O4 | P 1 21/c 1 | 9.3426; 21.642; 7.3217 90; 95.5215; 90 | 1473.5 | El-Hage, Firas; Schöll, Christopher; Pospech, Jola Photo-mediated Decarboxylative Giese-Type Reaction using Organic Pyrimidopteridine Photoredox Catalysts. The Journal of organic chemistry, 2020 |
| 4038880 | CIF | C90 H108 N6 | P n n a | 29.9197; 21.7163; 12.1918 90; 90; 90 | 7921.6 | Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020 |
| 4038881 | CIF | C48 H66 N8 | P 3 1 c | 11.9345; 11.9345; 40.593 90; 90; 120 | 5007.1 | Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020 |
| 4038882 | CIF | C66 H84 N6 | P -1 | 13.1663; 14.0425; 18.3518 71.914; 88.948; 85.804 | 3216.7 | Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020 |
| 4038883 | CIF | C24 H20 N4 O2 | P 1 21/c 1 | 7.919; 34.155; 7.5867 90; 92.857; 90 | 2049.5 | Beesu, Mallesh; Mehta, Goverdhan Orthogonal Strapping of o-Haloaryl Ynones with Pyrazolones: A One-Pot, Domino Process toward Spiropyrazolones The Journal of Organic Chemistry, 2020 |
| 4038884 | CIF | C20 H16 N2 O2 | P b c n | 52.965; 8.731; 14.249 90; 90; 90 | 6589 | Beesu, Mallesh; Mehta, Goverdhan Orthogonal Strapping of o-Haloaryl Ynones with Pyrazolones: A One-Pot, Domino Process toward Spiropyrazolones The Journal of Organic Chemistry, 2020 |
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