Crystallography Open Database

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4038835 CIFC29 H36 N2 O5 SiP -110.2581; 11.4654; 14.5949
70.423; 85.801; 75.155
1563.19Zhang, 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 CIFC26 H24 N O PP b c a18.889; 11.865; 19.04
90; 90; 90
4267.2Lim, Taehyun; Kim, Byeong Moon
Synthesis of α-aminophosphonates via phosphonylation of an aryne-imine adduct.
The Journal of organic chemistry, 2020
4038837 CIFC28 H27 N O3P -111.4662; 13.068; 16.186
82.877; 88.111; 79.015
2362.4Lepovitz, Lance T.; Martin, Stephen F.
Biomimetically Inspired, One-Step Synthesis of Exotine A and Exotine B.
The Journal of organic chemistry, 2020
4038838 CIFC16 H18 O2 SP 1 21 19.6838; 8.3369; 9.8668
90; 116.416; 90
713.4Li, 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 CIFC16 H14 N2C 1 c 123.2393; 7.5636; 7.3759
90; 100.902; 90
1273.08Huang, 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 CIFC16 H20 N2P 1 n 16.381; 13.803; 7.88
90; 95.82; 90
690.5Huang, 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 CIFC21 H18 N2 O2P 1 c 17.327; 15.647; 7.711
90; 96.781; 90
877.8Huang, 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 CIFC29 H38 N O2 PP 1 21/n 111.799; 18.531; 12.441
90; 101.186; 90
2668.5Huang, 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 CIFC28 H22 N O3 PP -18.3188; 9.3992; 15.4909
75.866; 82.881; 74.752
1130.91Lou, 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 CIFC21 H24 N2 O2P -18.7033; 10.3399; 11.7859
113.729; 92.491; 101.392
942.86Yang, 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 CIFC24 H23 N3 O2P 1 21/c 19.8585; 9.5244; 21.7395
90; 99.223; 90
2014.9Golmohammadi, 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 CIFC18 H16 Cl N O3P 1 21/n 110.01784; 10.98794; 15.5845
90; 105.645; 90
1651.92Peng, 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 CIFC19 H19 N O S2P c a 219.4553; 7.4507; 24.9074
90; 90; 90
1754.69Cheng, 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 CIFC18 H22 N2 O6P 21 21 215.921; 9.6597; 32.1824
90; 90; 90
1840.68Yuan, 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 CIFC13 H12 N2 OP n a 219.11; 10.547; 11.7739
90; 90; 90
1131.27Zhao, 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 CIFC21 H17 Br N2 OP 1 21/c 116.1173; 6.0319; 19.9118
90; 110.983; 90
1807.42Kumar, Jogendra; Suresh, Eringathodi; Bhadra, Sukalyan
Catalytic Direct α-Amination of Arylacetic Acid Synthons with Anilines
The Journal of Organic Chemistry, 2020
4038851 CIFC24 H18 N2 SP 1 21/c 110.0472; 9.0898; 20.6002
90; 98.372; 90
1861.3Kumar, Jogendra; Suresh, Eringathodi; Bhadra, Sukalyan
Catalytic Direct α-Amination of Arylacetic Acid Synthons with Anilines
The Journal of Organic Chemistry, 2020
4038852 CIFC15 H11 Br O2P 1 21/n 19.5102; 8.4541; 16.722
90; 104.133; 90
1303.76Hu, 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 CIFC93 H87 N4 O4P 1 21/c 119.334; 15.9626; 24.978
90; 97.191; 90
7648.1Ishizuka, 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 CIFC85 H80 Cl2 N4 O4P 1 21/n 113.151; 18.373; 29.23
90; 97.522; 90
7002Ishizuka, 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 CIFC85 H80 Cl2 N4 O4P 1 21/c 114.701; 38.079; 14.624
90; 110.677; 90
7659.2Ishizuka, 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 CIFC85.52 H83.04 Cl5.04 N4 O12P -115.172; 15.412; 17.553
81.596; 75.237; 86.921
3925.7Ishizuka, 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 CIFC87.5 H83 Cl3 F6 N4 O10 S2P -115.715; 15.84; 16.452
97.24; 90.434; 99.096
4010Ishizuka, 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 CIFC86 H81 Cl3 N4 O5 ZnP -115.3192; 16.6129; 17.287
92.847; 100.839; 108.55
4068.1Ishizuka, 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 CIFC39 H34 N3 O PP 1 21/c 19.2046; 16.5447; 21.3255
90; 91.645; 90
3246.27Pattarawarapan, 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 CIFC22 H28 N O6.5C 1 2/c 122.801; 17.372; 13.239
90; 94.494; 90
5228Xiong, 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 CIFC26 H41 Br O4 SiP 1 21 17.756; 43.788; 9.04
90; 114.516; 90
2793.4Kleiner, 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 CIFC15 H16 O3P 6524.0111; 24.0111; 22.65
90; 90; 120
11309Kleiner, 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 CIFC26 H21 N O2P 1 21 110.676; 8.467; 11.173
90; 106.897; 90
966.4Debnath, 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 CIFC22 H21 O3 PP 1 21/c 110.434; 6.0505; 29.2143
90; 96.876; 90
1831.1Han, 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 CIFC9 H13 O3 PP 1 21/n 110.6804; 7.2713; 12.814
90; 90.712; 90
995.06Han, 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 CIFC21 H13 F6 PP 1 21/n 19.7568; 16.9083; 11.2062
90; 94.842; 90
1842.1Han, 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 CIFC42 H58 N2 P4C 1 2/c 121.8967; 8.026; 25.7249
90; 111.928; 90
4193.9Musina, 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 CIFC48 H66 N2 P4P -112.6527; 13.775; 16.0646
104.584; 98.638; 115.784
2329Musina, 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 CIFC44 H62 N2 P4P -111.3964; 13.8689; 15.4979
106.832; 103.174; 105.045
2139.1Musina, 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 CIFC24 H29 N3 O2 P2P -110.11; 11.896; 12.699
113.23; 104.32; 98.18
1310Musina, 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 CIFC42 H58 B2 F8 N2 Ni P4P 1 21/c 113.1558; 21.3869; 16.3943
90; 108.413; 90
4376.58Musina, 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 CIFC48 H58 B2 F8 N6 Ni P4P -110.99; 13.243; 20.297
88.718; 84.969; 71.022
2782.6Musina, 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 CIFC52 H66 B2 F8 N6 Ni O0 P4P 1 21 110.957; 19.503; 13.36
90; 106.509; 90
2737.3Musina, 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 CIFC21 H27 N2 O6P -18.1218; 11.2194; 13.0487
65.267; 79.27; 78.503
1051.2Chen, 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 CIFC24 H27 N O4P 21 21 216.7505; 13.9462; 22.3174
90; 90; 90
2101.05Zhen, 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 CIFC24 H27 N O4P 21 21 216.0637; 16.8612; 19.9302
90; 90; 90
2037.69Zhen, 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 CIFC93 H65 Cl3 O7P 16.3659; 17.1828; 20.1654
66.231; 89.24; 89.986
2018.46Zhang, 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 CIFC20 H18 Br N O2P 21 21 216.4266; 15.5268; 16.3329
90; 90; 90
1629.77Yadav, 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 CIFC16 H24 O4P 1 21/c 19.3426; 21.642; 7.3217
90; 95.5215; 90
1473.5El-Hage, Firas; Schöll, Christopher; Pospech, Jola
Photo-mediated Decarboxylative Giese-Type Reaction using Organic Pyrimidopteridine Photoredox Catalysts.
The Journal of organic chemistry, 2020
4038880 CIFC90 H108 N6P n n a29.9197; 21.7163; 12.1918
90; 90; 90
7921.6Schick, 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 CIFC48 H66 N8P 3 1 c11.9345; 11.9345; 40.593
90; 90; 120
5007.1Schick, 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 CIFC66 H84 N6P -113.1663; 14.0425; 18.3518
71.914; 88.948; 85.804
3216.7Schick, 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 CIFC24 H20 N4 O2P 1 21/c 17.919; 34.155; 7.5867
90; 92.857; 90
2049.5Beesu, 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 CIFC20 H16 N2 O2P b c n52.965; 8.731; 14.249
90; 90; 90
6589Beesu, 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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