Crystallography Open Database
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Searching journal of publication like 'Journal of Organic Chemistry' volume of publication is 78
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4028533 | CIF | C45 H27 F5 N2 S | P -1 | 11.812; 12.254; 16.871 86.203; 72.152; 63.842 | 2079.6 | Ganesan Karthik; Pallavee Vitti Krushna; A. Srinivasan; Tavarekere K. Chandrashekar Calix[2]thia[4]phyrin: An Expanded Calixphyrin with Aggregation-Induced Enhanced Emission and Anion Receptor Properties Journal of Organic Chemistry, 2013, 78, 8496-8501 |
4028534 | CIF | C90.5 H56.5 Cl3.5 F10 N4 O9.5 S2 | P 1 c 1 | 17.6848; 21.47; 20.6857 90; 99.421; 90 | 7748.3 | Ganesan Karthik; Pallavee Vitti Krushna; A. Srinivasan; Tavarekere K. Chandrashekar Calix[2]thia[4]phyrin: An Expanded Calixphyrin with Aggregation-Induced Enhanced Emission and Anion Receptor Properties Journal of Organic Chemistry, 2013, 78, 8496-8501 |
4028535 | CIF | C32 H43 N3 O7 | P 21 21 21 | 7.89551; 17.34558; 22.8169 90; 90; 90 | 3124.82 | Suvendu Biswas; Nader E. Abo-Dya; Alexander Oliferenko; Amir Khiabani; Peter J. Steel; Khalid A. Alamry; Alan R. Katritzky Oxyazapeptides: Synthesis, Structure Determination, and Conformational Analysis Journal of Organic Chemistry, 2013, 78, 8502-8509 |
4028536 | CIF | C16 H14 N2 O6 | P 21 21 21 | 8.132; 12.16; 15.703 90; 90; 90 | 1552.8 | Chao Cheng; Zongwei Cai; Xiao-Shui Peng; Henry N. C. Wong Enantiomeric Recognition of Amino Acid Salts by Macrocyclic Crown Ethers Derived from Enantiomerically Pure 1,8,9,16-Tetrahydroxytetraphenylenes Journal of Organic Chemistry, 2013, 78, 8562-8573 |
4028537 | CIF | C16 H14 I2 O2 | P 21 21 21 | 7.2906; 13.4966; 16.3088 90; 90; 90 | 1604.76 | Chao Cheng; Zongwei Cai; Xiao-Shui Peng; Henry N. C. Wong Enantiomeric Recognition of Amino Acid Salts by Macrocyclic Crown Ethers Derived from Enantiomerically Pure 1,8,9,16-Tetrahydroxytetraphenylenes Journal of Organic Chemistry, 2013, 78, 8562-8573 |
4028538 | CIF | C24 H30 Cl N3 O5 | P 1 21/c 1 | 16.677; 9.9746; 15.086 90; 113.85; 90 | 2295.2 | Song Liu; John S. Scotti; Sergey A. Kozmin Emulating the Logic of Monoterpenoid Alkaloid Biogenesis to Access a Skeletally Diverse Chemical Library Journal of Organic Chemistry, 2013, 78, 8645-8654 |
4028539 | CIF | C37 H41 Cl4 N3 O8 | P 1 21/c 1 | 14.227; 13.112; 23.405 90; 117.331; 90 | 3878.7 | Song Liu; John S. Scotti; Sergey A. Kozmin Emulating the Logic of Monoterpenoid Alkaloid Biogenesis to Access a Skeletally Diverse Chemical Library Journal of Organic Chemistry, 2013, 78, 8645-8654 |
4028540 | CIF | C28.75 H32 N4 O5 | P b c a | 16.928; 9.845; 31.117 90; 90; 90 | 5186 | Song Liu; John S. Scotti; Sergey A. Kozmin Emulating the Logic of Monoterpenoid Alkaloid Biogenesis to Access a Skeletally Diverse Chemical Library Journal of Organic Chemistry, 2013, 78, 8645-8654 |
4028541 | CIF | C28 H37 Cl3 N4 O5 | P 1 21/c 1 | 10.752; 22.282; 12.459 90; 90.181; 90 | 2984.9 | Song Liu; John S. Scotti; Sergey A. Kozmin Emulating the Logic of Monoterpenoid Alkaloid Biogenesis to Access a Skeletally Diverse Chemical Library Journal of Organic Chemistry, 2013, 78, 8645-8654 |
4028542 | CIF | C28 H40 N4 O6 | P b c a | 14.162; 11.289; 33.764 90; 90; 90 | 5398 | Song Liu; John S. Scotti; Sergey A. Kozmin Emulating the Logic of Monoterpenoid Alkaloid Biogenesis to Access a Skeletally Diverse Chemical Library Journal of Organic Chemistry, 2013, 78, 8645-8654 |
4028543 | CIF | C29 H36 Cl4 N4 O4 | P -1 | 10.152; 17.836; 23.318 101.848; 93.41; 95.553 | 4099 | Song Liu; John S. Scotti; Sergey A. Kozmin Emulating the Logic of Monoterpenoid Alkaloid Biogenesis to Access a Skeletally Diverse Chemical Library Journal of Organic Chemistry, 2013, 78, 8645-8654 |
4028544 | CIF | C13 H13 Br N2 O4 | P -1 | 8.6888; 9.189; 9.4216 79.235; 65.4; 78.023 | 664.79 | Mustafa J. Raihan; R. R. Rajawinslin; Veerababurao Kavala; Chun-Wei Kuo; Ting-Shen Kuo; Chiu-Hui He; Hsiu-Ni Huang; Ching-Fa Yao Halonium Ion Mediated Synthesis of 2-Halomethylene-3-oxoketoxime Derivatives from Isoxazoline N-Oxides Journal of Organic Chemistry, 2013, 78, 8872-8879 |
4028545 | CIF | C8 H3 F6 N3 | P n a 21 | 12.113; 16.639; 4.8589 90; 90; 90 | 979.3 | Michael De Rosa; David Arnold; Douglas Hartline Four Mechanisms in the Reactions of 3-Aminopyrrole with 1,3,5-Triazines: Inverse Electron Demand Diels-Alder Cycloadditions vs SNAr Reactions via Uncatalyzed and Acid-Catalyzed Pathways Journal of Organic Chemistry, 2013, 78, 8614-8623 |
4028546 | CIF | C10 H4 F4 N8 | P 21 21 2 | 12.571; 20.299; 4.706 90; 90; 90 | 1200.9 | Michael De Rosa; David Arnold; Douglas Hartline Four Mechanisms in the Reactions of 3-Aminopyrrole with 1,3,5-Triazines: Inverse Electron Demand Diels-Alder Cycloadditions vs SNAr Reactions via Uncatalyzed and Acid-Catalyzed Pathways Journal of Organic Chemistry, 2013, 78, 8614-8623 |
4028547 | CIF | C29 H26 N2 O3 | P 1 21/c 1 | 9.024; 12.568; 21.352 90; 104.171; 90 | 2347.9 | Sahaj Gupta; Dipankar Koley; Krishnan Ravikumar; Bijoy Kundu Counter Ion Effect in Au/Ag-Catalyzed Chemoselective 6-endo-dig N- and O-Cyclizations of Enyne-Urea System: Diversity-Oriented Synthesis of Annulated Indoles Journal of Organic Chemistry, 2013, 78, 8624-8633 |
4028548 | CIF | C29 H26 N2 O3 | P 1 21/c 1 | 6.0699; 22.271; 17.599 90; 98.522; 90 | 2352.8 | Sahaj Gupta; Dipankar Koley; Krishnan Ravikumar; Bijoy Kundu Counter Ion Effect in Au/Ag-Catalyzed Chemoselective 6-endo-dig N- and O-Cyclizations of Enyne-Urea System: Diversity-Oriented Synthesis of Annulated Indoles Journal of Organic Chemistry, 2013, 78, 8624-8633 |
4028549 | CIF | C10 H18 F N O3 | P 1 21 1 | 7.7674; 8.7329; 8.4874 90; 97.962; 90 | 570.167 | Simon J. Shaw; Dane A. Goff; Luke A. Boralsky; Mark Irving; Rajinder Singh Enantioselective Synthesis of cis-3-Fluoropiperidin-4-ol, a Building Block for Medicinal Chemistry Journal of Organic Chemistry, 2013, 78, 8892-8897 |
4028550 | CIF | C10 H18 F N O3 | P 1 21 1 | 7.7639; 8.7343; 8.4835 90; 98.013; 90 | 569.67 | Simon J. Shaw; Dane A. Goff; Luke A. Boralsky; Mark Irving; Rajinder Singh Enantioselective Synthesis of cis-3-Fluoropiperidin-4-ol, a Building Block for Medicinal Chemistry Journal of Organic Chemistry, 2013, 78, 8892-8897 |
4028551 | CIF | C18 H11 N5 | P b c a | 6.7212; 16.922; 25.652 90; 90; 90 | 2917.6 | Styliana I. Mirallai; Maria Manoli; Panayiotis A. Koutentis Reactions of Tetracyanoethylene with N'-Arylbenzamidines: A Route to 2-Phenyl-3H-imidazo[4,5-b]quinoline-9-carbonitriles Journal of Organic Chemistry, 2013, 78, 8655-8668 |
4028552 | CIF | C18 H11 N5 | P b c n | 23.5138; 13.2286; 9.4729 90; 90; 90 | 2946.59 | Styliana I. Mirallai; Maria Manoli; Panayiotis A. Koutentis Reactions of Tetracyanoethylene with N'-Arylbenzamidines: A Route to 2-Phenyl-3H-imidazo[4,5-b]quinoline-9-carbonitriles Journal of Organic Chemistry, 2013, 78, 8655-8668 |
4028553 | CIF | C19 H13 N5 | C 1 2/c 1 | 18.0008; 12.1839; 14.6705 90; 108.737; 90 | 3047 | Styliana I. Mirallai; Maria Manoli; Panayiotis A. Koutentis Reactions of Tetracyanoethylene with N'-Arylbenzamidines: A Route to 2-Phenyl-3H-imidazo[4,5-b]quinoline-9-carbonitriles Journal of Organic Chemistry, 2013, 78, 8655-8668 |
4028554 | CIF | C18 H11 N5 | P 1 21/c 1 | 8.5353; 14.8828; 11.7854 90; 104.911; 90 | 1446.68 | Styliana I. Mirallai; Maria Manoli; Panayiotis A. Koutentis Reactions of Tetracyanoethylene with N'-Arylbenzamidines: A Route to 2-Phenyl-3H-imidazo[4,5-b]quinoline-9-carbonitriles Journal of Organic Chemistry, 2013, 78, 8655-8668 |
4028555 | CIF | C42 H36 Cl3 N3 O S | P -1 | 10.02; 10.25; 18.583 78.568; 87.828; 75.839 | 1814 | Tao Tao; Bin-Bin Ma; Yu-Xin Peng; Xiao-Xu Wang; Wei Huang; Xiao-Zeng You Asymmetrical/Symmetrical D-π-A/D-π-D Thiazole-Containing Aromatic Heterocyclic Fluorescent Compounds Having the Same Triphenylamino Chromophores Journal of Organic Chemistry, 2013, 78, 8669-8679 |
4028556 | CIF | C21 H15 Br N2 S | P -1 | 10.0378; 10.1977; 10.4509 71.289; 72.671; 65.066 | 902.18 | Tao Tao; Bin-Bin Ma; Yu-Xin Peng; Xiao-Xu Wang; Wei Huang; Xiao-Zeng You Asymmetrical/Symmetrical D-π-A/D-π-D Thiazole-Containing Aromatic Heterocyclic Fluorescent Compounds Having the Same Triphenylamino Chromophores Journal of Organic Chemistry, 2013, 78, 8669-8679 |
4028557 | CIF | C27 H20.5 N3.5 S | P -1 | 10.2017; 12.9072; 17.458 85.786; 85.243; 73.689 | 2195.6 | Tao Tao; Bin-Bin Ma; Yu-Xin Peng; Xiao-Xu Wang; Wei Huang; Xiao-Zeng You Asymmetrical/Symmetrical D-π-A/D-π-D Thiazole-Containing Aromatic Heterocyclic Fluorescent Compounds Having the Same Triphenylamino Chromophores Journal of Organic Chemistry, 2013, 78, 8669-8679 |
4028558 | CIF | C25 H18 N2 S2 | P -1 | 10.3933; 12.6851; 16.6669 97.372; 105.335; 98.675 | 2062 | Tao Tao; Bin-Bin Ma; Yu-Xin Peng; Xiao-Xu Wang; Wei Huang; Xiao-Zeng You Asymmetrical/Symmetrical D-π-A/D-π-D Thiazole-Containing Aromatic Heterocyclic Fluorescent Compounds Having the Same Triphenylamino Chromophores Journal of Organic Chemistry, 2013, 78, 8669-8679 |
4028559 | CIF | C42 H34 N4 O2 S2 | P -1 | 10.237; 11.233; 15.634 78.122; 85.747; 79.296 | 1727.5 | Tao Tao; Bin-Bin Ma; Yu-Xin Peng; Xiao-Xu Wang; Wei Huang; Xiao-Zeng You Asymmetrical/Symmetrical D-π-A/D-π-D Thiazole-Containing Aromatic Heterocyclic Fluorescent Compounds Having the Same Triphenylamino Chromophores Journal of Organic Chemistry, 2013, 78, 8669-8679 |
4028560 | CIF | C8 H5 Br N2 S | P -1 | 5.8778; 7.415; 9.975 84.049; 87.505; 77.632 | 422.3 | Tao Tao; Bin-Bin Ma; Yu-Xin Peng; Xiao-Xu Wang; Wei Huang; Xiao-Zeng You Asymmetrical/Symmetrical D-π-A/D-π-D Thiazole-Containing Aromatic Heterocyclic Fluorescent Compounds Having the Same Triphenylamino Chromophores Journal of Organic Chemistry, 2013, 78, 8669-8679 |
4028561 | CIF | C49 H39 Cl Ir N P2 | P -1 | 10.32; 12.289; 16.52 100.239; 95.243; 94.028 | 2045 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028562 | CIF | C29 H24 Fe O | P -1 | 9.653; 14.058; 16.31 87.728; 78.385; 87.118 | 2164.2 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028563 | CIF | C26 H24 Fe O2 | P 1 21/n 1 | 15.39; 6.159; 21.75 90; 94.94; 90 | 2054 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028564 | CIF | C26 H21 Fe N | P 1 21/n 1 | 6.3952; 7.5982; 39.534 90; 91.28; 90 | 1920.6 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028565 | CIF | C27 H21 Fe N O2 | P 1 21/n 1 | 6.118; 11.4661; 29.4764 90; 91.952; 90 | 2066.56 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028566 | CIF | C26 H21 Fe N | P n a 21 | 29.415; 6.2737; 10.6309 90; 90; 90 | 1961.8 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028567 | CIF | C26 H23 Fe N3 | P 1 21/c 1 | 23; 7.545; 11.657 90; 90.115; 90 | 2022.9 | Chen Xu; Xin-Qi Hao; Zhi-Qiang Xiao; Zhi-Qiang Wang; Xiao-Er Yuan; Wei-Jun Fu; Bao-Ming Ji; Mao-Ping Song One-Pot Synthesis of Ferrocenyl Ketones Containing Biaryls and 6-Aryl-2-ferrocenylquinolines via Ir/Pd-Cocatalyzed α-Alkylation/Suzuki Reaction Journal of Organic Chemistry, 2013, 78, 8730-8738 |
4028568 | CIF | C37 H49 Cl3 O9 | R -3 :H | 12.591; 12.591; 43.157 90; 90; 120 | 5925.2 | Monica Cîrcu; Albert Soran; Niculina Daniela Hădade; Monica Rednic; Anamaria Terec; Ion Grosu Cryptands with 1,3,5-Tris(1',3'-dioxan-2'-yl)-benzene Units: Synthesis and Structural Investigations Journal of Organic Chemistry, 2013, 78, 8722-8729 |
4028569 | CIF | C47 H65 N7 O11 | P -1 | 11.684; 13.811; 16.664 106.936; 94.523; 103.162 | 2474.2 | Subrata Saha; Bidyut Akhuli; Sourav Chakraborty; Pradyut Ghosh Synthesis of a Preorganized Hybrid Macrobicycle with Distinct Amide and Amine Clefts: Tetrahedral versus Spherical Anions Binding Studies Journal of Organic Chemistry, 2013, 78, 8759-8765 |
4028570 | CIF | C47 H63 Cl2 N8 O16 | P b c a | 20.207; 16.6727; 31.039 90; 90; 90 | 10457.2 | Subrata Saha; Bidyut Akhuli; Sourav Chakraborty; Pradyut Ghosh Synthesis of a Preorganized Hybrid Macrobicycle with Distinct Amide and Amine Clefts: Tetrahedral versus Spherical Anions Binding Studies Journal of Organic Chemistry, 2013, 78, 8759-8765 |
4028571 | CIF | C47 H63 Br3 N8 O7 | P 1 21/c 1 | 14.3205; 11.8681; 32.3426 90; 113.74; 90 | 5031.7 | Subrata Saha; Bidyut Akhuli; Sourav Chakraborty; Pradyut Ghosh Synthesis of a Preorganized Hybrid Macrobicycle with Distinct Amide and Amine Clefts: Tetrahedral versus Spherical Anions Binding Studies Journal of Organic Chemistry, 2013, 78, 8759-8765 |
4028572 | CIF | C41 H56 N4 O10 Si | P 1 21 1 | 13.9515; 7.4841; 20.7748 90; 98.7267; 90 | 2144.08 | Salman Y. Jabri; Larry E. Overman Enantioselective Total Syntheses of Plectosphaeroic Acids B and C Journal of Organic Chemistry, 2013, 78, 8766-8788 |
4028573 | CIF | C19 H19 N3 O2 | P 21 21 21 | 7.1493; 12.2599; 19.056 90; 90; 90 | 1670.25 | Mani Raj Chaulagain; Albert E. Felten; Kevin Gilbert; Zachary D. Aron Diastereo- and Enantioselective Three-Component Coupling Approach to Highly Substituted Pyrrolidines Journal of Organic Chemistry, 2013, 78, 9471-9476 |
4028574 | CIF | C19 H17 Br N2 O | P n a 21 | 7.5169; 16.51; 13.022 90; 90; 90 | 1616.1 | Xiaodong Jia; Yaxin Wang; Fangfang Peng; Congde Huo; Liangliang Yu; Jing Liu; Xicun Wang Catalytic sp3C-H Oxidation of Peptides and Their Analogues by Radical Cation Salts: From Glycine Amides to Quinolines Journal of Organic Chemistry, 2013, 78, 9450-9456 |
4028575 | CIF | C15 H13 Br N2 O | P 1 21/n 1 | 4.84198; 24.6091; 11.1667 90; 97.31; 90 | 1319.77 | Xiaodong Jia; Yaxin Wang; Fangfang Peng; Congde Huo; Liangliang Yu; Jing Liu; Xicun Wang Catalytic sp3C-H Oxidation of Peptides and Their Analogues by Radical Cation Salts: From Glycine Amides to Quinolines Journal of Organic Chemistry, 2013, 78, 9450-9456 |
4028576 | CIF | C23 H28 N2 O3 S | P 1 21/c 1 | 10.5211; 19.7827; 11.4336 90; 115.473; 90 | 2148.4 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028577 | CIF | C12 H14 N2 O3 S3 | P -1 | 7.4176; 9.5552; 10.6426 73.5374; 71.7067; 89.4121 | 684.26 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028578 | CIF | C18 H18 N2 O3 S3 | C 1 2/c 1 | 24.7995; 9.1854; 15.9469 90; 90.6521; 90 | 3632.36 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028579 | CIF | C18 H15 N3 O3 S3 | P -1 | 7.6137; 10.2745; 12.3735 102.081; 93.9533; 107.418 | 894.08 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028580 | CIF | C25 H22 N4 O3 S2 | P -1 | 10.2872; 10.4831; 11.0788 82.6096; 85.8594; 80.255 | 1166.18 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028581 | CIF | C21 H23 N3 O4 S2 | P 1 21/n 1 | 8.6438; 20.1707; 12.4655 90; 110.431; 90 | 2036.66 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028582 | CIF | C18 H18 N2 O3 S3 | P -1 | 8.2612; 11.53; 11.621 118.884; 101.288; 97.331 | 918.11 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028583 | CIF | C16 H14 N2 O3 S2 | P -1 | 7.2005; 7.8115; 14.1006 82.8219; 87.622; 81.448 | 777.93 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028584 | CIF | C17 H13 N3 O3 S2 | P n a 21 | 12.106; 26.2262; 5.0256 90; 90; 90 | 1595.6 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028585 | CIF | C25 H32 N2 O3 S2 | P 1 21/c 1 | 10.1559; 9.6338; 26.2933 90; 111.841; 90 | 2387.88 | Matthias D. Mertens; Markus Pietsch; Gregor Schnakenburg; Michael Gütschow Regioselective Sulfonylation and N- to O-Sulfonyl Migration of Quinazolin-4(3H)-ones and Analogous Thienopyrimidin-4(3H)-ones Journal of Organic Chemistry, 2013, 78, 8966-8979 |
4028586 | CIF | C22 H30 N2 O2 | P 1 21/n 1 | 8.638; 11.502; 9.89 90; 101.376; 90 | 963.31 | Hirohiko Houjou; Hajime Shingai; Keisuke Yagi; Isao Yoshikawa; Koji Araki Mutual Interference between Intramolecular Proton Transfer Sites through the Adjoining π-Conjugated System in Schiff Bases of Double-Headed, Fused Salicylaldehydes Journal of Organic Chemistry, 2013, 78, 9021-9031 |
4028587 | CIF | C28 H42 N2 O2 | C 1 2/c 1 | 49.85; 4.657; 10.848 90; 99.408; 90 | 2485 | Hirohiko Houjou; Hajime Shingai; Keisuke Yagi; Isao Yoshikawa; Koji Araki Mutual Interference between Intramolecular Proton Transfer Sites through the Adjoining π-Conjugated System in Schiff Bases of Double-Headed, Fused Salicylaldehydes Journal of Organic Chemistry, 2013, 78, 9021-9031 |
4028588 | CIF | C26 H22 N2 O2 | P -1 | 9.168; 10.975; 11.722 65.579; 70.746; 70.183 | 985.28 | Hirohiko Houjou; Hajime Shingai; Keisuke Yagi; Isao Yoshikawa; Koji Araki Mutual Interference between Intramolecular Proton Transfer Sites through the Adjoining π-Conjugated System in Schiff Bases of Double-Headed, Fused Salicylaldehydes Journal of Organic Chemistry, 2013, 78, 9021-9031 |
4028589 | CIF | C19 H24 O7 | P 21 21 21 | 6.0534; 9.3596; 31.6166 90; 90; 90 | 1791.31 | Stephen Hanessian; Benjamin R. Schroeder; Bradley L. Merner; Bin Chen; Eric E. Swayze; Punit P. Seth Synthesis of cis- and trans-α-l-[4.3.0]Bicyclo-DNA Monomers for Antisense Technology: Methods for the Diastereoselective Formation of Bicyclic Nucleosides Journal of Organic Chemistry, 2013, 78, 9051-9063 |
4028590 | CIF | C19 H30 N2 O6 Si | P 21 21 21 | 7.6328; 14.1459; 41.464 90; 90; 90 | 4477 | Stephen Hanessian; Jernej Wagger; Bradley L. Merner; Robert D. Giacometti; Michael E. Østergaard; Eric E. Swayze; Punit P. Seth A constrained Tricyclic Nucleic Acid Analogue of α-l-LNA: Investigating the Effects of Dual Conformational Restriction on Duplex Thermal Stability Journal of Organic Chemistry, 2013, 78, 9064-9075 |
4028591 | CIF | C14 H18 N2 O6 | P 21 21 21 | 6.4711; 9.5163; 27.7291 90; 90; 90 | 1707.58 | Stephen Hanessian; Jernej Wagger; Bradley L. Merner; Robert D. Giacometti; Michael E. Østergaard; Eric E. Swayze; Punit P. Seth A constrained Tricyclic Nucleic Acid Analogue of α-l-LNA: Investigating the Effects of Dual Conformational Restriction on Duplex Thermal Stability Journal of Organic Chemistry, 2013, 78, 9064-9075 |
4028592 | CIF | C41 H46 O8 | P 1 21 1 | 5.9908; 21.9862; 13.158 90; 94.8749; 90 | 1726.84 | Ananda Kumar Kanduluru; Prabal Banerjee; John A Beutler; Philip L Fuchs A Convergent Total Synthesis of the Potent Cephalostatin/Ritterazine Hybrid -25-epiRitterostatin GN1N Journal of Organic Chemistry, 2013, 78, 9085-9092 |
4028593 | CIF | C48 H52 O10 | P 1 21 1 | 11.2106; 6.3133; 28.577 90; 96.8071; 90 | 2008.3 | Ananda Kumar Kanduluru; Prabal Banerjee; John A Beutler; Philip L Fuchs A Convergent Total Synthesis of the Potent Cephalostatin/Ritterazine Hybrid -25-epiRitterostatin GN1N Journal of Organic Chemistry, 2013, 78, 9085-9092 |
4028594 | CIF | C22 H17 N3 O3 | P -1 | 8.561; 9.81; 11.971 111; 101.05; 98.38 | 895.6 | Belen Batanero; Fructuoso Barba; Avelino Martin One-Pot Formation of 1,3,4-Oxadiazol-2(3H)-ones and Dibenzo[c,e]azepines by Concomitant Cathodic Reduction of Diazonium Salts and Phenanthrenequinones Journal of Organic Chemistry, 2013, 78, 9477-9481 |
4028595 | CIF | C21 H16 Cl3 N5 O3 | P 1 21/c 1 | 10.3682; 20.31; 10.8183 90; 103.339; 90 | 2216.6 | Belen Batanero; Fructuoso Barba; Avelino Martin One-Pot Formation of 1,3,4-Oxadiazol-2(3H)-ones and Dibenzo[c,e]azepines by Concomitant Cathodic Reduction of Diazonium Salts and Phenanthrenequinones Journal of Organic Chemistry, 2013, 78, 9477-9481 |
4028596 | CIF | C25 H25 N3 O3 | P 1 21/n 1 | 15.162; 8.812; 16.235 90; 95.4; 90 | 2159.5 | Belen Batanero; Fructuoso Barba; Avelino Martin One-Pot Formation of 1,3,4-Oxadiazol-2(3H)-ones and Dibenzo[c,e]azepines by Concomitant Cathodic Reduction of Diazonium Salts and Phenanthrenequinones Journal of Organic Chemistry, 2013, 78, 9477-9481 |
4028597 | CIF | C17 H12 F N O3 | P 1 21 1 | 3.827; 19.9545; 8.9557 90; 90.672; 90 | 683.86 | Shugao Zhu; Luling Wu; Xian Huang Gold-Catalyzed Cyclization of 3-(2'-Azidoaryl)-1-arylpropargyl Carbonates or 3-Aryl-1-(2'-azidoaryl)propargyl Carbonates to Produce Quinolines Journal of Organic Chemistry, 2013, 78, 9120-9126 |
4028598 | CIF | C15 H10 F N O | P 1 21/c 1 | 11.74; 7.1758; 13.2748 90; 92.215; 90 | 1117.49 | Shugao Zhu; Luling Wu; Xian Huang Gold-Catalyzed Cyclization of 3-(2'-Azidoaryl)-1-arylpropargyl Carbonates or 3-Aryl-1-(2'-azidoaryl)propargyl Carbonates to Produce Quinolines Journal of Organic Chemistry, 2013, 78, 9120-9126 |
4028599 | CIF | C19 H28 N2 O5 | P 21 21 21 | 6.03; 7.997; 39.32 90; 90; 90 | 1896 | Bettina Bakonyi; Markus Furegati; Christian Kramer; Luigi La Vecchia; Flavio Ossola Synthesis of All Four Stereoisomers of 3-(tert-Butoxycarbonyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid Journal of Organic Chemistry, 2013, 78, 9328-9339 |
4028600 | CIF | C45 H44 N3 Pd | P 1 21/c 1 | 10.3442; 29.4631; 11.8597 90; 105.406; 90 | 3484.63 | Timothy D. Lash; Ashley M. Toney; Kylie M. Castans; Gregory M. Ferrence Synthesis of Benziporphyrins and Heterobenziporphyrins and an Assessment of the Diatropic Characteristics of the Protonated Species Journal of Organic Chemistry, 2013, 78, 9143-9152 |
4028601 | CIF | C21 H21 N O4 | P 21 21 21 | 6.4739; 15.5769; 18.5242 90; 90; 90 | 1868 | Benito Alcaide; Pedro Almendros; Teresa Martínez del Campo; M. Rosario Torres Synthesis of Fused-β-Lactams through Selective Gold-Catalyzed Oxycyclization of Dioxolane-Tethered Enynes Journal of Organic Chemistry, 2013, 78, 8956-8965 |
4028602 | CIF | C24 H35 N5 O6 | P 1 21 1 | 7.5027; 20.0377; 8.6994 90; 104.153; 90 | 1268.14 | Olga I. Shmatova; Valentine G. Nenajdenko Synthesis of Tetrazole-Derived Organocatalysts via Azido-Ugi Reaction with Cyclic Ketimines Journal of Organic Chemistry, 2013, 78, 9214-9222 |
4028603 | CIF | C16 H16 Br F3 O2 | P 1 21 1 | 11.462; 5.423; 12.416 90; 101.315; 90 | 756.8 | Alyn T. Davies; James E. Taylor; James Douglas; Christopher J. Collett; Louis C. Morrill; Charlene Fallan; Alexandra M. Z. Slawin; Gwydion Churchill; Andrew D. Smith Stereospecific Asymmetric N-Heterocyclic Carbene (NHC)-Catalyzed Redox Synthesis of Trifluoromethyl Dihydropyranones and Mechanistic Insights Journal of Organic Chemistry, 2013, 78, 9243-9257 |
4028604 | CIF | C14 H20 F N O S | P 1 21 1 | 9.411; 6.155; 12.59 90; 104.26; 90 | 706.8 | Óscar Pablo; David Guijarro; Miguel Yus Synthesis of Nitrogenated Heterocycles by Asymmetric Transfer Hydrogenation of N-(tert-Butylsulfinyl)haloimines Journal of Organic Chemistry, 2013, 78, 9181-9189 |
4028605 | CIF | C16 H25 N O S | P 21 21 21 | 9.0663; 10.2171; 17.358 90; 90; 90 | 1607.9 | Óscar Pablo; David Guijarro; Miguel Yus Synthesis of Nitrogenated Heterocycles by Asymmetric Transfer Hydrogenation of N-(tert-Butylsulfinyl)haloimines Journal of Organic Chemistry, 2013, 78, 9181-9189 |
4028606 | CIF | C18 H18 N6 S2 | P b c a | 16.0473; 8.2489; 28.1693 90; 90; 90 | 3728.8 | Andréanne Bolduc; Abelaziz Al Ouahabi; Charlotte Mallet; W. G. Skene Insight into the Isoelectronic Character of Azomethines and Vinylenes Using Representative Models: A Spectroscopic and Electrochemical Study Journal of Organic Chemistry, 2013, 78, 9258-9269 |
4028607 | CIF | C24 H29 N O5 | P 21 21 21 | 5.3357; 14.5791; 27.62 90; 90; 90 | 2148.6 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028608 | CIF | C24 H29 N O5 | P 21 21 21 | 5.9321; 16.378; 22.766 90; 90; 90 | 2211.9 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028609 | CIF | C25 H31 N O5 | P 21 21 21 | 5.6081; 17.574; 23.186 90; 90; 90 | 2285.1 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028610 | CIF | C25 H31 N O5 | P 21 21 21 | 5.9143; 16.418; 23.943 90; 90; 90 | 2324.9 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028611 | CIF | C25 H31 N O5 | P 21 21 21 | 5.94; 16.522; 23.753 90; 90; 90 | 2331 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028612 | CIF | C26 H33 N O5 | P 21 21 21 | 5.608; 17.552; 23.94 90; 90; 90 | 2356.5 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028613 | CIF | C26 H33 N O5 | P 1 21 1 | 16.429; 5.83; 25.749 90; 101.226; 90 | 2419.1 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028614 | CIF | C26 H31 N O6 | P 21 21 21 | 5.8548; 17.17; 22.895 90; 90; 90 | 2301.6 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028615 | CIF | C26 H31 N O6 | P 21 21 21 | 9.5257; 10.0665; 24.832 90; 90; 90 | 2381.2 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028616 | CIF | C38 H47 N O11 | P 1 | 8.585; 8.79; 12.585 89.579; 82.776; 67.638 | 870.5 | Hiroaki Shitara; Toshiki Shintani; Koichi Kodama; Takuji Hirose Solvent-Induced Reversed Stereoselectivity in Reciprocal Resolutions of Mandelic Acid and erythro-2-Amino-1,2-diphenylethanol Journal of Organic Chemistry, 2013, 78, 9309-9316 |
4028617 | CIF | C114 H136 O8 S4 | P -1 | 19.0813; 20.9562; 27.535 69.762; 81.598; 74.116 | 9920.1 | Hemant Gopee; Xiangfei Kong; Zhiqun He; Isabelle Chambrier; David L. Hughes; Graham J. Tizzard; Simon J. Coles; Andrew N. Cammidge Expanded Porphyrin-like Structures Based on Twinned Triphenylenes Journal of Organic Chemistry, 2013, 78, 9505-9511 |
4028618 | CIF | C126.66 H154.64 F8 N4 O10.66 | P -1 | 13.0439; 14.4112; 14.9721 85.365; 80.789; 89.884 | 2768.9 | Hemant Gopee; Xiangfei Kong; Zhiqun He; Isabelle Chambrier; David L. Hughes; Graham J. Tizzard; Simon J. Coles; Andrew N. Cammidge Expanded Porphyrin-like Structures Based on Twinned Triphenylenes Journal of Organic Chemistry, 2013, 78, 9505-9511 |
4028619 | CIF | C12 H20 N2 S3 | P 1 21/n 1 | 8.4971; 15.548; 22.387 90; 100.734; 90 | 2905.9 | Brandon Djukic; Alan J. Lough; Dwight S. Seferos A Highly Electron-Deficient Analogue of Aniline, Soluble Oligomers, and Their Redox Properties Journal of Organic Chemistry, 2013, 78, 9340-9344 |
4028620 | CIF | C15 H28 N2 O S | C 1 2/c 1 | 35.432; 13.899; 5.4329 90; 91.627; 90 | 2674.5 | Brandon Djukic; Alan J. Lough; Dwight S. Seferos A Highly Electron-Deficient Analogue of Aniline, Soluble Oligomers, and Their Redox Properties Journal of Organic Chemistry, 2013, 78, 9340-9344 |
4028621 | CIF | C19 H17 Cl N2 O | P 1 21/n 1 | 9.477; 8.93; 19.082 90; 92.506; 90 | 1613.4 | Bin Li; Jianfeng Ma; Weijia Xie; Haibin Song; Shansheng Xu; Baiquan Wang Ruthenium-Catalyzed Regioselective C2 Alkenylation of Indoles and Pyrroles via C-H Bond Functionalization Journal of Organic Chemistry, 2013, 78, 9345-9353 |
4028622 | CIF | C16 H18 N2 O2 | P -1 | 9.293; 9.394; 9.908 100.73; 114.079; 108.951 | 694.2 | Bin Li; Jianfeng Ma; Weijia Xie; Haibin Song; Shansheng Xu; Baiquan Wang Ruthenium-Catalyzed Regioselective C2 Alkenylation of Indoles and Pyrroles via C-H Bond Functionalization Journal of Organic Chemistry, 2013, 78, 9345-9353 |
4028623 | CIF | C20 H26 Br N3 O6 | P 1 21 1 | 6.0255; 16.0531; 11.7146 90; 90.119; 90 | 1133.13 | Mei-Xin Zhao; Hong-Lei Bi; Hao Zhou; Hui Yang; Min Shi Cinchona Alkaloid Squaramide Catalyzed Enantioselective Hydrazination/Cyclization Cascade Reaction of α-Isocyanoacetates and Azodicarboxylates: Synthesis of Optically Active 1,2,4-Triazolines Journal of Organic Chemistry, 2013, 78, 9377-9382 |
4028624 | CIF | C19 H18 Cl N3 O | C 1 2 1 | 16.8589; 5.7629; 17.1929 90; 97.666; 90 | 1655.47 | Takahiro Sawano; Keiyu Ou; Takahiro Nishimura; Tamio Hayashi Cobalt-Catalyzed Asymmetric Addition of Silylacetylenes to 1,1-Disubstituted Allenes Journal of Organic Chemistry, 2013, 78, 8986-8993 |
4028625 | CIF | C23 H19 N O6 | P 1 21/c 1 | 10.2955; 21.256; 8.892 90; 91.858; 90 | 1944.9 | Yu-Jin Li; Huan-Ming Huang; Hua-Qing Dong; Jian-Hong Jia; Liang Han; Qing Ye; Jian-Rong Gao The Synthesis of Benzo[f]isoindole-1,3-dicarboxylates via an I2-Induced 1,3-Dipolar Cycloaddition Reaction Journal of Organic Chemistry, 2013, 78, 9424-9430 |
4028626 | CIF | C26 H29 N O5 | P 21 21 21 | 6.079; 27.279; 41.157 90; 90; 90 | 6825 | Jennifer Ciesielski; Vincent Gandon; Alison J. Frontier Cascade Cyclizations of Acyclic and Macrocyclic Alkynones: Studies toward the Synthesis of Phomactin A Journal of Organic Chemistry, 2013, 78, 9541-9552 |
4028627 | CIF | C19 H17 N3 O | P 1 21/n 1 | 11.4553; 8.5264; 16.0262 90; 104.796; 90 | 1513.41 | Sandra Milosevic; Antonio Togni Enantioselective 1,3-Dipolar Cycloaddition of C,N-Cyclic Azomethine Imines to Unsaturated Nitriles Catalyzed by NiII-Pigiphos Journal of Organic Chemistry, 2013, 78, 9638-9646 |
4028628 | CIF | C19 H16 Br N3 O | P 65 | 19.3207; 19.3207; 8.1719 90; 90; 120 | 2641.8 | Sandra Milosevic; Antonio Togni Enantioselective 1,3-Dipolar Cycloaddition of C,N-Cyclic Azomethine Imines to Unsaturated Nitriles Catalyzed by NiII-Pigiphos Journal of Organic Chemistry, 2013, 78, 9638-9646 |
4028629 | CIF | C20 H18 N2 O4 | P 21 21 21 | 8.3131; 13.596; 15.136 90; 90; 90 | 1710.7 | Chih-Hau Chen; Gorakh S. Yellol; Cheng-Hsun Tsai; Prashant B. Dalvi; Chung-Ming Sun Diastereoselective Synthesis of Bridged Polycyclic Alkaloids via Tandem Acylation/Intramolecular Diels-Alder Reaction Journal of Organic Chemistry, 2013, 78, 9738-9747 |
4028630 | CIF | C23 H22 N2 O6 | P 1 21/n 1 | 11.0066; 10.7812; 17.4741 90; 96.936; 90 | 2058.4 | Chih-Hau Chen; Gorakh S. Yellol; Cheng-Hsun Tsai; Prashant B. Dalvi; Chung-Ming Sun Diastereoselective Synthesis of Bridged Polycyclic Alkaloids via Tandem Acylation/Intramolecular Diels-Alder Reaction Journal of Organic Chemistry, 2013, 78, 9738-9747 |
4028631 | CIF | C23 H19 N | P n a 21 | 17.627; 16.321; 5.5951 90; 90; 90 | 1609.7 | Estela Álvarez; Patricia García-García; Manuel A. Fernández-Rodríguez; Roberto Sanz Regioselective Synthesis of Elusive 4,9-Dihydro-1H-Carbazoles by Gold-Catalyzed Cycloisomerization of 3-Allenylmethylindoles Journal of Organic Chemistry, 2013, 78, 9758-9771 |
4028632 | CIF | C46 H76 N8 O11 | P 1 21 1 | 16.1213; 9.1571; 16.935 90; 98.899; 90 | 2469.9 | Norikazu Yamazaki; Yosuke Demizu; Yukiko Sato; Mitsunobu Doi; Masaaki Kurihara Helical Foldamer Containing a Combination of Cyclopentane-1,2-diamine and 2,2-Dimethylmalonic Acid Journal of Organic Chemistry, 2013, 78, 9991-9994 |
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