Crystallography Open Database

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1555955 CIFC13 H15 Cl OP 21 21 218.7518; 8.9722; 13.5378
90; 90; 90
1063.03Han, Yixin; Breitler, Simon; Zheng, Shao-Liang; Corey, E. J.
Enantioselective Conversion of Achiral Cyclohexadienones to Chiral Cyclohexenones by Desymmetrization.
Organic letters, 2016, 18, 6172-6175
1555956 CIFC21 H16 OP b a 218.9446; 24.3426; 6.2244
90; 90; 90
2870.45Yoon, Hyung; Lossouarn, Alexis; Landau, Felicitas; Lautens, Mark
Pd-Catalyzed Spirocyclization via C-H Activation and Benzyne Insertion.
Organic letters, 2016, 18, 6324-6327
1555957 CIFC22 H17 N OP 1 21/c 111.8751; 8.3673; 15.6764
90; 90.689; 90
1557.5Yoon, Hyung; Lossouarn, Alexis; Landau, Felicitas; Lautens, Mark
Pd-Catalyzed Spirocyclization via C-H Activation and Benzyne Insertion.
Organic letters, 2016, 18, 6324-6327
1555958 CIFC53 H44 Cl3 N O P2 PdP 1 21/c 111.7599; 18.0933; 23.3373
90; 103.385; 90
4830.7Yoon, Hyung; Lossouarn, Alexis; Landau, Felicitas; Lautens, Mark
Pd-Catalyzed Spirocyclization via C-H Activation and Benzyne Insertion.
Organic letters, 2016, 18, 6324-6327
1555959 CIFC26 H18 Cl N OP -18.9082; 9.9372; 11.1764
90.17; 100.71; 95.382
967.63Samineni, Ramesh; Bandi, Chandramohan Reddy C.; Srihari, Pabbaraja; Mehta, Goverdhan
Multiple Aryne Insertions into Oxindoles: Synthesis of Bioactive 3,3-Diarylated Oxindoles and Dibenzo[b,e]azepin-6-ones.
Organic letters, 2016, 18, 6184-6187
1555960 CIFC21 H21 N3 O2P 1 21 18.51; 12.408; 8.644
90; 90.049; 90
912.7Samineni, Ramesh; Bandi, Chandramohan Reddy C.; Srihari, Pabbaraja; Mehta, Goverdhan
Multiple Aryne Insertions into Oxindoles: Synthesis of Bioactive 3,3-Diarylated Oxindoles and Dibenzo[b,e]azepin-6-ones.
Organic letters, 2016, 18, 6184-6187
1555961 CIFC26 H18 Br N OP -18.996; 9.168; 14.637
90.061; 106.475; 117.452
1014.9Samineni, Ramesh; Bandi, Chandramohan Reddy C.; Srihari, Pabbaraja; Mehta, Goverdhan
Multiple Aryne Insertions into Oxindoles: Synthesis of Bioactive 3,3-Diarylated Oxindoles and Dibenzo[b,e]azepin-6-ones.
Organic letters, 2016, 18, 6184-6187
1555962 CIFC57 H52 Cl4 N2 O7P 1 21/n 111.5586; 37.6596; 12.2407
90; 110.032; 90
5005.9Zhu, Congzhi; Mu, Anthony U.; Lin, Yen-Hao; Guo, Zi-Hao; Yuan, Tianyu; Wheeler, Steven E.; Fang, Lei
Molecular Coplanarity and Self-Assembly Promoted by Intramolecular Hydrogen Bonds.
Organic letters, 2016, 18, 6332-6335
1555963 CIFC66 H5 Co OP n a 2119.3264; 16.2685; 9.8756
90; 90; 90
3105Hashikawa, Yoshifumi; Murata, Michihisa; Wakamiya, Atsushi; Murata, Yasujiro
Co(I)-Mediated Removal of Addends on the C<sub>60</sub> Cage and Formation of the Monovalent Cobalt Complex CpCo(CO)(η<sup>2</sup>-C<sub>60</sub>).
Organic letters, 2016, 18, 6348-6351
1555964 CIFC27 H27 N3P -110.8707; 12.3272; 16.2931
79.118; 82.74; 72.757
2041.96Fandrick, Daniel R.; Hart, Christine A.; Okafor, Ifeanyi S.; Mercadante, Michael A.; Sanyal, Sanjit; Masters, James T.; Sarvestani, Max; Fandrick, Keith R.; Stockdill, Jennifer L.; Grinberg, Nelu; Gonnella, Nina; Lee, Heewon; Senanayake, Chris H.
Copper-Catalyzed Asymmetric Propargylation of Cyclic Aldimines.
Organic letters, 2016, 18, 6192-6195
1555965 CIFC19 H18 OP 21 21 215.9076; 8.2748; 28.655
90; 90; 90
1400.8Kusy, RafaƂ; Grela, Karol
E- and Z-Selective Transfer Semihydrogenation of Alkynes Catalyzed by Standard Ruthenium Olefin Metathesis Catalysts.
Organic letters, 2016, 18, 6196-6199
1555966 CIFC27 H22 Cl N O5 SP 1 21/c 110.9967; 16.5944; 25.1871
90; 91.593; 90
4594.46Xuan, Jun; Daniliuc, Constantin G.; Studer, Armido
Construction of Polycyclic γ-Lactams and Related Heterocycles via Electron Catalysis.
Organic letters, 2016, 18, 6372-6375
1555967 CIFC21 H22 F2 N2 O7C 1 2 113.014; 9.45; 18.211
90; 98.828; 90
2213.1Evans, Christopher E.; Matarlo, Joe S.; Tonge, Peter J.; Tan, Derek S.
Stereoselective Synthesis, Docking, and Biological Evaluation of Difluoroindanediol-Based MenE Inhibitors as Antibiotics.
Organic letters, 2016, 18, 6384-6387
1555968 CIFC24 H16 N2 O2P -17.1492; 10.4607; 12.1607
77.086; 77.386; 87.983
864.96Zhang, Cheng; Huang, Jingjing; Qiu, Lihua; Xu, Xinfang
Thermally Induced [3 + 2] Cycloaddition of Alkynyl-Tethered Diazoamides: Synthetic and Mechanistic Insights.
Organic letters, 2016, 18, 6208-6211
1555969 CIFC12 H21 N3 O3P 1 21/c 112.2885; 6.3383; 17.583
90; 100.49; 90
1346.62Zhang, Cheng; Huang, Jingjing; Qiu, Lihua; Xu, Xinfang
Thermally Induced [3 + 2] Cycloaddition of Alkynyl-Tethered Diazoamides: Synthetic and Mechanistic Insights.
Organic letters, 2016, 18, 6208-6211
1555970 CIFC23 H31 NP 21 21 217.1278; 11.0317; 24.0691
90; 90; 90
1892.6Dethe, Dattatraya H.; Sau, Susanta Kumar; Mahapatra, Samarpita
Biomimetic Enantioselective Total Synthesis of (-)-Mycoleptodiscin A.
Organic letters, 2016, 18, 6392-6395
1555971 CIFC33 H21 N O SP 1 21/c 122.035; 10.8485; 22.733
90; 114.59; 90
4941.4Shankar, Majji; Ghosh, Koushik; Mukherjee, Kallol; Rit, Raja K.; Sahoo, Akhila K.
Ru-Catalyzed One-Pot Diannulation of Heteroaryls: Direct Access to π-Conjugated Polycyclic Amides.
Organic letters, 2016, 18, 6416-6419
1555972 CIFC35 H22 F N OP 1 21/c 117.6372; 11.5066; 12.8191
90; 107.487; 90
2481.3Shankar, Majji; Ghosh, Koushik; Mukherjee, Kallol; Rit, Raja K.; Sahoo, Akhila K.
Ru-Catalyzed One-Pot Diannulation of Heteroaryls: Direct Access to π-Conjugated Polycyclic Amides.
Organic letters, 2016, 18, 6416-6419
1555973 CIFC19 H29 B O4P 1 21/c 110.8565; 16.1793; 12.2433
90; 114.148; 90
1962.3Butcher, Trevor W.; McClain, Edward J.; Hamilton, Tyler G.; Perrone, Trina M.; Kroner, Kayla M.; Donohoe, Gregory C.; Akhmedov, Novruz G.; Petersen, Jeffrey L.; Popp, Brian V.
Regioselective Copper-Catalyzed Boracarboxylation of Vinyl Arenes.
Organic letters, 2016, 18, 6428-6431
1555974 CIFC17 H14 Br N3 OP 1 21 15.4346; 9.6489; 14.5339
90; 99.157; 90
752.41Vyas, Vijyesh K.; Bhanage, Bhalchandra M.
Kinetic Resolution Driven Diastereo- and Enantioselective Synthesis of cis-β-Heteroaryl Amino Cycloalkanols by Ruthenium-Catalyzed Asymmetric Transfer Hydrogenation.
Organic letters, 2016, 18, 6436-6439
1555975 CIFC11 H9 F0.5 N0.5 O1.5P -16.2872; 10.7075; 13.7223
80.562; 85.731; 87.096
908.06Liu, Jianchao; Peng, Hui; Lu, Lin; Xu, Xiaobing; Jiang, Huanfeng; Yin, Biaolin
Diastereospecific and Enantioselective Access to Dispirooxindoles from Furfurylcyclobutanols by Means of a Pd-Catalyzed Arylative Dearomatization/Ring Expansion Cascade.
Organic letters, 2016, 18, 6440-6443
1555976 CIFC26 H16 Cl2P 1 21/c 111.7842; 10.5042; 16.7068
90; 109.462; 90
1949.87Li, Jen-Yi; Chang, Hung-Ing; Feng, Chieh-Ning; Wu, Yao-Ting
Rotation of Aryl Groups in 9,10-Diarylphenanthrenes: Does the Rotational Barrier Become Lower as the Backbone Becomes More Crowded?
Organic letters, 2016, 18, 6444-6447
1555977 CIFC34 H34P 21 21 217.2192; 12.2678; 27.633
90; 90; 90
2447.3Li, Jen-Yi; Chang, Hung-Ing; Feng, Chieh-Ning; Wu, Yao-Ting
Rotation of Aryl Groups in 9,10-Diarylphenanthrenes: Does the Rotational Barrier Become Lower as the Backbone Becomes More Crowded?
Organic letters, 2016, 18, 6444-6447
1555978 CIFC26 H16 Cl2P 1 21/c 19.1927; 29.468; 7.4968
90; 104.857; 90
1962.9Li, Jen-Yi; Chang, Hung-Ing; Feng, Chieh-Ning; Wu, Yao-Ting
Rotation of Aryl Groups in 9,10-Diarylphenanthrenes: Does the Rotational Barrier Become Lower as the Backbone Becomes More Crowded?
Organic letters, 2016, 18, 6444-6447
1555979 CIFC34 H34P 1 21/n 110.724; 14.6596; 15.9412
90; 106.043; 90
2408.5Li, Jen-Yi; Chang, Hung-Ing; Feng, Chieh-Ning; Wu, Yao-Ting
Rotation of Aryl Groups in 9,10-Diarylphenanthrenes: Does the Rotational Barrier Become Lower as the Backbone Becomes More Crowded?
Organic letters, 2016, 18, 6444-6447
1555981 CIFC22 H19 Br O2P 1 21 111.8971; 5.9845; 12.3079
90; 95.961; 90
871.56Ming, Jialin; Hayashi, Tamio
Aryloxymethyltrifluoroborates for Rhodium-Catalyzed Asymmetric Conjugate Arylation. o-Methoxyarylation through 1,4-Rhodium Shift.
Organic letters, 2016, 18, 6452-6455
1555982 CIFC22 H22 N2 O2P b c a15.792; 12.08; 19.334
90; 90; 90
3688.3Hu, Ming; Zou, Hua-Xu; Song, Ren-Jie; Xiang, Jian-Nan; Li, Jin-Heng
Copper-Catalyzed C-H Oxidative Radical Functionalization and Annulation of Aniline-Linked 1,7-Enynes: Evidence for a 1,5-Hydride Shift Mechanism.
Organic letters, 2016, 18, 6460-6463
1555983 CIFC13 H14 O3P 1 21/c 18.02; 19.607; 7.492
90; 95.022; 90
1173.6Sun, Peng; Gao, Shang; Yang, Chi; Guo, Songjin; Lin, Aijun; Yao, Hequan
Controllable Rh(III)-Catalyzed Annulation between Salicylaldehydes and Diazo Compounds: Divergent Synthesis of Chromones and Benzofurans.
Organic letters, 2016, 18, 6464-6467
1555984 CIFC28 H24 Br N O2P 21 21 2110.8033; 12.0109; 17.2824
90; 90; 90
2242.52Shi, Ming-Lin; Zhan, Gu; Zhou, Su-Lan; Du, Wei; Chen, Ying-Chun
Asymmetric Inverse-Electron-Demand Oxa-Diels-Alder Reaction of Allylic Ketones through Dienamine Catalysis.
Organic letters, 2016, 18, 6480-6483
1555985 CIFC22 H28 O8P 21 21 217.8152; 12.0816; 21.667
90; 90; 90
2045.8Wu, Xing-De; Luo, Dan; Tu, Wen-Chao; Deng, Zhen-Tao; Chen, Xue-Jiao; Su, Jia; Ji, Xu; Zhao, Qin-Shi
Hypophyllins A-D, Labdane-Type Diterpenoids with Vasorelaxant Activity from Hypoestes phyllostachya "Rosea".
Organic letters, 2016, 18, 6484-6487
1555986 CIFC21 H28 O6P 21 21 219.478; 9.5117; 21.743
90; 90; 90
1960.2Wu, Xing-De; Luo, Dan; Tu, Wen-Chao; Deng, Zhen-Tao; Chen, Xue-Jiao; Su, Jia; Ji, Xu; Zhao, Qin-Shi
Hypophyllins A-D, Labdane-Type Diterpenoids with Vasorelaxant Activity from Hypoestes phyllostachya "Rosea".
Organic letters, 2016, 18, 6484-6487
1555987 CIFC21 H30 O6P 21 21 216.62; 10.9943; 27.0538
90; 90; 90
1969Wu, Xing-De; Luo, Dan; Tu, Wen-Chao; Deng, Zhen-Tao; Chen, Xue-Jiao; Su, Jia; Ji, Xu; Zhao, Qin-Shi
Hypophyllins A-D, Labdane-Type Diterpenoids with Vasorelaxant Activity from Hypoestes phyllostachya "Rosea".
Organic letters, 2016, 18, 6484-6487
1555988 CIFC21 H28 O6P 1 21 17.128; 13.9482; 9.3993
90; 92.464; 90
933.64Wu, Xing-De; Luo, Dan; Tu, Wen-Chao; Deng, Zhen-Tao; Chen, Xue-Jiao; Su, Jia; Ji, Xu; Zhao, Qin-Shi
Hypophyllins A-D, Labdane-Type Diterpenoids with Vasorelaxant Activity from Hypoestes phyllostachya "Rosea".
Organic letters, 2016, 18, 6484-6487
1555989 CIFC18 H21 N O2P 1 21/n 112.2561; 15.5951; 16.3454
90; 97.262; 90
3099.12Johnson, Thomas; Pultar, Felix; Menke, Friedericke; Lautens, Mark
Palladium-Catalyzed α-Arylation of Vinylogous Esters for the Synthesis of γ,γ-Disubstituted Cyclohexenones.
Organic letters, 2016, 18, 6488-6491
1555990 CIFC47 H50 N2 O5 S SiC 1 2/c 116.0823; 18.0956; 28.619
90; 97.4057; 90
8259.2Andreansky, Eric S.; Blakey, Simon B.
An Iminium Ion Cascade Annulation Strategy for the Synthesis of Akuammiline Alkaloid Pentacyclic Core Structures.
Organic letters, 2016, 18, 6492-6495
1555991 CIFC31 H18 O8P 1 21/c 117.4605; 8.5215; 15.4752
90; 103.931; 90
2234.82Zhang, Ai Hua; Liu, Wen; Jiang, Nan; Xu, Qiang; Tan, Ren Xiang
Spirodalesol, an NLRP3 Inflammasome Activation Inhibitor.
Organic letters, 2016, 18, 6496-6499
1555995 CIFC36 H27 N O2 SR -3 :H37.5582; 37.5582; 9.9323
90; 90; 120
12133.6Jalal, Swapnadeep; Paul, Kartick; Jana, Umasish
Iron-Catalyzed 1,5-Enyne Cycloisomerization via 5-Endo-Dig Cyclization for the Synthesis of 3-(Inden-1-yl)indole Derivatives.
Organic letters, 2016, 18, 6512-6515

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