Crystallography Open Database

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1519656 CIFC25 H20 N2 O2P 1 21/c 113.373; 16.581; 8.8083
90; 93.638; 90		1949.2Lin, Chao; Zhen, Le; Cheng, Yong; Du, Hong-Jin; Zhao, Hui; Wen, Xiaoan; Kong, Ling-Yi; Xu, Qing-Long; Sun, Hongbin
Visible-light induced isoindoles formation to trigger intermolecular diels-alder reactions in the presence of air.
Organic letters, 2015, 17, 2684-2687
1519657 CIFC24 H28 Cl N O7P 1 21/n 110.5446; 9.5462; 24.575
90; 91.778; 90		2472.5Hu, Jiang-Lin; Wang, Lijia; Xu, Hao; Xie, Zuowei; Tang, Yong
Highly diastereoselective and enantioselective formal [4 + 3] cycloaddition of donor-acceptor cyclobutanes with nitrones.
Organic letters, 2015, 17, 2680-2683
1519658 CIFC28 H28 Br N O6P 21 21 2110.409; 15.4718; 16.588
90; 90; 90		2671.4Hu, Jiang-Lin; Wang, Lijia; Xu, Hao; Xie, Zuowei; Tang, Yong
Highly diastereoselective and enantioselective formal [4 + 3] cycloaddition of donor-acceptor cyclobutanes with nitrones.
Organic letters, 2015, 17, 2680-2683
1519694 CIFC14 H11 N O4 SP 1 21/c 15.7372; 21.0648; 10.9631
90; 94.428; 90		1321Singh, Rahul; Allam, Bharat Kumar; Singh, Neetu; Kumari, Kumkum; Singh, Satish Kumar; Singh, Krishna Nand
A Direct Metal-Free Decarboxylative Sulfono Functionalization (DSF) of Cinnamic Acids to α,β-Unsaturated Phenyl Sulfones.
Organic letters, 2015, 17, 2656-2659
1519695 CIFC23 H22 O2P 21 21 218.099; 13.445; 16.407
90; 90; 90		1786.6Mitra, Nirmal K.; Meudom, Rolande; Gorden, John D.; Merner, Bradley L.
A non-cross-coupling approach to arene-bridged macrocycles: synthesis, structure, and direct, regioselective functionalization of a cycloparaphenylene fragment.
Organic letters, 2015, 17, 2700-2703
1519696 CIFC13 H13 F OP 21 21 216.1061; 18.8064; 27.8827
90; 90; 90		3201.88Witten, Michael R.; Jacobsen, Eric N.
A Simple Primary Amine Catalyst for Enantioselective α-Hydroxylations and α-Fluorinations of Branched Aldehydes.
Organic letters, 2015, 17, 2772-2775
1519697 CIFC9 H10 Br F OP 1 21 18.013; 5.1662; 10.972
90; 93.376; 90		453.4Witten, Michael R.; Jacobsen, Eric N.
A Simple Primary Amine Catalyst for Enantioselective α-Hydroxylations and α-Fluorinations of Branched Aldehydes.
Organic letters, 2015, 17, 2772-2775
1519698 CIFC10 H13 F OP 21 21 215.5342; 11.1421; 14.6505
90; 90; 90		903.39Witten, Michael R.; Jacobsen, Eric N.
A Simple Primary Amine Catalyst for Enantioselective α-Hydroxylations and α-Fluorinations of Branched Aldehydes.
Organic letters, 2015, 17, 2772-2775
1519755 CIFC15 H16 O4P 1 21/c 17.4665; 21.583; 8.4033
90; 107.586; 90		1290.9Zhang, Xuxue; Dai, Wenpeng; Wu, Wei; Cao, Song
Copper-Catalyzed Coupling Cyclization of gem-Difluoroalkenes with Activated Methylene Carbonyl Compounds: Facile Domino Access to Polysubstituted Furans.
Organic letters, 2015, 17, 2708-2711
1519756 CIFC30 H42 O5P 1 21 17.3312; 12.6193; 14.4778
90; 98.847; 90		1323.47Zhao, Qian-Qian; Song, Qiu-Yan; Jiang, Kan; Li, Guang-Da; Wei, Wen-Jun; Li, Ya; Gao, Kun
Spirochensilides A and B, Two New Rearranged Triterpenoids from Abies chensiensis.
Organic letters, 2015, 17, 2760-2763
1519757 CIFC10 H7 Br Cl2 N2 OP b c a12.6226; 12.3709; 14.1124
90; 90; 90		2203.7Gurry, Michael; Sweeney, Martin; McArdle, Patrick; Aldabbagh, Fawaz
One-pot hydrogen peroxide and hydrohalic Acid induced ring closure and selective aromatic halogenation to give new ring-fused benzimidazoles.
Organic letters, 2015, 17, 2856-2859
1519758 CIFC12 H12 Br2 N2 OP 1 21/c 17.3945; 20.124; 17.43
90; 91.44; 90		2592.9Gurry, Michael; Sweeney, Martin; McArdle, Patrick; Aldabbagh, Fawaz
One-pot hydrogen peroxide and hydrohalic Acid induced ring closure and selective aromatic halogenation to give new ring-fused benzimidazoles.
Organic letters, 2015, 17, 2856-2859
1519759 CIFC11 H10 Br2 N2P 1 21/c 114.9133; 10.5056; 7.3297
90; 103.561; 90		1116.35Gurry, Michael; Sweeney, Martin; McArdle, Patrick; Aldabbagh, Fawaz
One-pot hydrogen peroxide and hydrohalic Acid induced ring closure and selective aromatic halogenation to give new ring-fused benzimidazoles.
Organic letters, 2015, 17, 2856-2859
1519760 CIFC11 H7 Cl2 F3 N2 O1.5P 1 21/c 17.501; 40.025; 16.7795
90; 94.664; 90		5021Gurry, Michael; Sweeney, Martin; McArdle, Patrick; Aldabbagh, Fawaz
One-pot hydrogen peroxide and hydrohalic Acid induced ring closure and selective aromatic halogenation to give new ring-fused benzimidazoles.
Organic letters, 2015, 17, 2856-2859
1519761 CIFC11 H9 Br2 F N2P b c a14.443; 7.5861; 21.306
90; 90; 90		2334.4Gurry, Michael; Sweeney, Martin; McArdle, Patrick; Aldabbagh, Fawaz
One-pot hydrogen peroxide and hydrohalic Acid induced ring closure and selective aromatic halogenation to give new ring-fused benzimidazoles.
Organic letters, 2015, 17, 2856-2859
1519848 CIFC12 H14 O3P 1 21/c 18.8887; 18.4179; 6.9957
90; 115.638; 90		1032.52Hassan, Ahmed H. E.; Lee, Jae Kyun; Pae, Ae Nim; Min, Sun-Joon; Cho, Yong Seo
Synthesis of the Tricyclic Ring Structure of Daphnanes via Intramolecular [4 + 3] Cycloaddition/SmI2-Pinacol Coupling.
Organic letters, 2015, 17, 2672-2675
1519849 CIFC12 H14 O3P 1 21/c 110.7308; 8.7467; 12.089
90; 109.485; 90		1069.68Hassan, Ahmed H. E.; Lee, Jae Kyun; Pae, Ae Nim; Min, Sun-Joon; Cho, Yong Seo
Synthesis of the Tricyclic Ring Structure of Daphnanes via Intramolecular [4 + 3] Cycloaddition/SmI2-Pinacol Coupling.
Organic letters, 2015, 17, 2672-2675
1519850 CIFC22 H16 Br N O2P 1 21/c 15.7399; 15.532; 20.365
90; 96.93; 90		1802.3Dhanasekaran, Sivasankaran; Kayet, Anirban; Suneja, Arun; Bisai, Vishnumaya; Singh, Vinod K.
Unified Approach to Isoindolinones and THIQs via Lewis Acid Catalyzed Domino Mukaiyama-Mannich Lactamization/Alkylations: Application in the Synthesis of (±)-Homolaudanosine.
Organic letters, 2015, 17, 2780-2783
1519851 CIFC16 H12 N4P 1 21/c 14.8624; 11.167; 23.437
90; 94.33; 90		1269Jia, Feng-Cheng; Xu, Cheng; Zhou, Zhi-Wen; Cai, Qun; Li, Deng-Kui; Wu, An-Xin
Consecutive Cycloaddition/SNAr/Reduction/Cyclization/Oxidation Sequences: A Copper-Catalyzed Multicomponent Synthesis of Fused N-Heterocycles.
Organic letters, 2015, 17, 2820-2823
1519923 CIFC21 H34 O3P 1 21 16.1791; 23.0423; 6.9392
90; 110.037; 90		928.21Hosseini, Abolfazl; Seidel, Daniel; Miska, Andreas; Schreiner, Peter R.
Fluoride-assisted activation of calcium carbide: a simple method for the ethynylation of aldehydes and ketones.
Organic letters, 2015, 17, 2808-2811
1519924 CIFC25 H21 Fe N3P 1 21/c 110.9392; 8.3314; 22.5089
90; 102.759; 90		2000.78Wei, Fang; Li, Haoyu; Song, Chuanling; Ma, Yudao; Zhou, Ling; Tung, Chen-Ho; Xu, Zhenghu
Cu/Pd-Catalyzed, Three-Component Click Reaction of Azide, Alkyne, and Aryl Halide: One-Pot Strategy toward Trisubstituted Triazoles.
Organic letters, 2015, 17, 2860-2863
1519998 CIFC20 H30 N0 O5P 21 21 217.0685; 15.143; 17.388
90; 90; 90		1861.2Annam, S Ch V Appa Rao; Ankireddy, Madhu; Sura, Madhu Babu; Ponnapalli, Mangala Gowri; Sarma, Akella V. S.; S, Jeelani Basha
Epimeric Excolides from the Stems of Excoecaria agallocha and Structural Revision of Rhizophorin A.
Organic letters, 2015, 17, 2840-2843
1519999 CIFC20 H28 O5P 1 21 19.4777; 7.3392; 13.4089
90; 91.432; 90		932.41Annam, S Ch V Appa Rao; Ankireddy, Madhu; Sura, Madhu Babu; Ponnapalli, Mangala Gowri; Sarma, Akella V. S.; S, Jeelani Basha
Epimeric Excolides from the Stems of Excoecaria agallocha and Structural Revision of Rhizophorin A.
Organic letters, 2015, 17, 2840-2843
1520000 CIFC29 H36 O8P 1 21/c 113.2416; 13.1779; 15.2428
90; 109.387; 90		2509Fukaya, Keisuke; Kodama, Keisuke; Tanaka, Yuta; Yamazaki, Hirohisa; Sugai, Tomoya; Yamaguchi, Yu; Watanabe, Ami; Oishi, Takeshi; Sato, Takaaki; Chida, Noritaka
Synthesis of Paclitaxel. 2. Construction of the ABCD Ring and Formal Synthesis.
Organic letters, 2015, 17, 2574-2577
1520001 CIFC54 H46 Co N2 P3P 1 21/n 114.376; 14.699; 21.34
90; 107.79; 90		4293.8Scheuermann, Margaret L.; Johnson, Elizabeth J.; Chirik, Paul J.
Alkene isomerization-hydroboration promoted by phosphine-ligated cobalt catalysts.
Organic letters, 2015, 17, 2716-2719
1520002 CIFC29 H38 O8P 1 21/n 19.3612; 19.6336; 14.1965
90; 101.762; 90		2554.4Fukaya, Keisuke; Tanaka, Yuta; Sato, Ayako C.; Kodama, Keisuke; Yamazaki, Hirohisa; Ishimoto, Takeru; Nozaki, Yasuyoshi; Iwaki, Yuki M.; Yuki, Yohei; Umei, Kentaro; Sugai, Tomoya; Yamaguchi, Yu; Watanabe, Ami; Oishi, Takeshi; Sato, Takaaki; Chida, Noritaka
Synthesis of Paclitaxel. 1. Synthesis of the ABC Ring of Paclitaxel by SmI2-Mediated Cyclization.
Organic letters, 2015, 17, 2570-2573
1520003 CIF
Paper		C42 H50 O10P -19.6397; 13.6008; 15.0461
83.6966; 77.488; 77.9768		1879.2Fukaya, Keisuke; Tanaka, Yuta; Sato, Ayako C.; Kodama, Keisuke; Yamazaki, Hirohisa; Ishimoto, Takeru; Nozaki, Yasuyoshi; Iwaki, Yuki M.; Yuki, Yohei; Umei, Kentaro; Sugai, Tomoya; Yamaguchi, Yu; Watanabe, Ami; Oishi, Takeshi; Sato, Takaaki; Chida, Noritaka
Synthesis of Paclitaxel. 1. Synthesis of the ABC Ring of Paclitaxel by SmI2-Mediated Cyclization.
Organic letters, 2015, 17, 2570-2573
1520004 CIFC30.25 H41 O8P -111.3343; 15.4666; 16.487
85.1124; 78.3773; 78.5231		2771.3Fukaya, Keisuke; Tanaka, Yuta; Sato, Ayako C.; Kodama, Keisuke; Yamazaki, Hirohisa; Ishimoto, Takeru; Nozaki, Yasuyoshi; Iwaki, Yuki M.; Yuki, Yohei; Umei, Kentaro; Sugai, Tomoya; Yamaguchi, Yu; Watanabe, Ami; Oishi, Takeshi; Sato, Takaaki; Chida, Noritaka
Synthesis of Paclitaxel. 1. Synthesis of the ABC Ring of Paclitaxel by SmI2-Mediated Cyclization.
Organic letters, 2015, 17, 2570-2573
1520005 CIFC15 H21 N O2P 1 21/c 18.5353; 10.6984; 15.609
90; 104.429; 90		1380.4Zhou, Wei; Ni, Shengyang; Mei, Haibo; Han, Jianlin; Pan, Yi
Hydroxyalkylation-initiated radical cyclization of N-allylbenzamide for direct construction of isoquinolinone.
Organic letters, 2015, 17, 2724-2727
1520068 CIFC32 H36 Br2 N4 O2P 1 21/c 110.037; 8.2451; 18.991
90; 101.279; 90		1541.3Zhu, Xiaxia; Du, Haifeng
A Highly Stereoselective Metal-Free Hydrogenation of Diimines for the Synthesis of Cis-Vicinal Diamines.
Organic letters, 2015, 17, 3106-3109
1520116 CIFC28 H19 NP -19.0455; 9.563; 11.529
103.716; 98.763; 98.986		938.1Liu, Xingyan; Li, Xiaoyu; Liu, Hu; Guo, Qiang; Lan, Jingbo; Wang, Ruilin; You, Jingsong
Aldehyde as a Traceless Directing Group for Rh(III)-Catalyzed C-H Activation: A Facile Access to Diverse Indolo[1,2-a]quinolines.
Organic letters, 2015, 17, 2936-2939
1520117 CIFC17.5 H18 F8 I O3.5 S2P -18.9435; 12.1892; 12.2642
63.163; 87.526; 77.6		1162.92Matsuzaki, Kohei; Okuyama, Kenta; Tokunaga, Etsuko; Saito, Norimichi; Shiro, Motoo; Shibata, Norio
Synthesis of Diaryliodonium Salts Having Pentafluorosulfanylarenes and Their Application to Electrophilic Pentafluorosulfanylarylation of C-, O-, N-, and S-Nucleophiles.
Organic letters, 2015, 17, 3038-3041
1520220 CIFC24 H19 NC 1 2/c 142.784; 6.0454; 31.552
90; 119.951; 90		7071Li, Xiangdong; Chen, Ming; Xie, Xin; Sun, Ning; Li, Shi; Liu, Yuanhong
Synthesis of Multiple-Substituted Pyrroles via Gold(I)-Catalyzed Hydroamination/Cyclization Cascade.
Organic letters, 2015, 17, 2984-2987
1520221 CIFC30 H23 NP 1 21/c 112.0216; 6.2012; 30.083
90; 101.315; 90		2199Li, Xiangdong; Chen, Ming; Xie, Xin; Sun, Ning; Li, Shi; Liu, Yuanhong
Synthesis of Multiple-Substituted Pyrroles via Gold(I)-Catalyzed Hydroamination/Cyclization Cascade.
Organic letters, 2015, 17, 2984-2987
1520222 CIFC23 H19 NC 1 2/c 129.558; 6.041; 19.696
90; 104.661; 90		3402.4Li, Xiangdong; Chen, Ming; Xie, Xin; Sun, Ning; Li, Shi; Liu, Yuanhong
Synthesis of Multiple-Substituted Pyrroles via Gold(I)-Catalyzed Hydroamination/Cyclization Cascade.
Organic letters, 2015, 17, 2984-2987
1520223 CIFC14 H16 Cl3 N O3P 3216.1172; 16.1172; 5.6393
90; 90; 120		1268.63Skvorcova, Marija; Grigorjeva, Liene; Jirgensons, Aigars
Tetrahydro-1,3-oxazepines via Intramolecular Amination of Cyclopropylmethyl Cation.
Organic letters, 2015, 17, 2902-2904
1520224 CIFC22 H22 N4 O2 SP 1 21 110.363; 9.318; 11.453
90; 112.7; 90		1020.3Wang, Linqing; Yang, Dongxu; Li, Dan; Wang, Rui
Catalytic Enantioselective Ring-Opening and Ring-Closing Reactions of 3-Isothiocyanato Oxindoles and N-(2-Picolinoyl)aziridines.
Organic letters, 2015, 17, 3004-3007
1520225 CIFC13 H21 N3 O3P 1 21/c 14.5905; 23.474; 13.2529
90; 91.746; 90		1427.4Martínez, Luís; Martorell, Gabriel; Sampedro, Ángel; Ballester, Pablo; Costa, Antoni; Rotger, Carmen
Hydrogen Bonded Squaramide-Based Foldable Module Induces Both β- and α-Turns in Hairpin Structures of α-Peptides in Water.
Organic letters, 2015, 17, 2980-2983
1520297 CIFC52 H60 Br N4 O18 S2C 1 2/c 126.6011; 19.037; 14.4208
90; 114.731; 90		6633Carrasco-Ruiz, Anayeli; Tiburcio, Jorge
Electrostatic Kinetic Barriers in the Threading/Dethreading Motion of a Rotaxane-like Complex.
Organic letters, 2015, 17, 1858-1861
1520298 CIFC52 H86 N4 O32 S2P 1 21/n 111.8381; 23.4128; 11.8991
90; 107.339; 90		3148.12Carrasco-Ruiz, Anayeli; Tiburcio, Jorge
Electrostatic Kinetic Barriers in the Threading/Dethreading Motion of a Rotaxane-like Complex.
Organic letters, 2015, 17, 1858-1861
1520299 CIFC22 H23 I O3P 21 21 215.7232; 10.8546; 32.913
90; 90; 90		2044.7Merad, Jérémy; Borkar, Prashant; Bouyon Yenda, Tracy; Roux, Christèle; Pons, Jean-Marc; Parrain, Jean-Luc; Chuzel, Olivier; Bressy, Cyril
Highly Enantioselective Acylation of Acyclic Meso 1,3-Diols through Synergistic Isothiourea-Catalyzed Desymmetrization/Chiroablative Kinetic Resolution.
Organic letters, 2015, 17, 2118-2121
1520300 CIFC36 H46 N4 O2P -17.1052; 14.1156; 16.3735
105.153; 91.858; 102.309		1541.85Meehan, Eileen; Li, Ruoshi; Zeller, Matthias; Brückner, Christian
Octaethyl-1,3-oxazinochlorin: A β-Octaethylchlorin Analogue Made by Pyrrole Expansion.
Organic letters, 2015, 17, 2210-2213
1520301 CIFC41 H58.333 N5 OP 1 21/c 126.0651; 15.2582; 9.5468
90; 96.584; 90		3771.8Meehan, Eileen; Li, Ruoshi; Zeller, Matthias; Brückner, Christian
Octaethyl-1,3-oxazinochlorin: A β-Octaethylchlorin Analogue Made by Pyrrole Expansion.
Organic letters, 2015, 17, 2210-2213
1520302 CIFC33 H31 Br2 N O6P 1 21/c 118.4779; 9.1189; 19.3437
90; 109.352; 90		3075.2Tang, Shaojian; Park, Jong Yeun; Yeagley, Andrew A.; Sabat, Michal; Chruma, Jason J.
Decarboxylative Generation of 2-Azaallyl Anions: 2-Iminoalcohols via a Decarboxylative Erlenmeyer Reaction.
Organic letters, 2015, 17, 2042-2045
1520303 CIFC13 H23 Cl N2 NiP 1 21/n 111.1164; 12.6843; 11.5897
90; 118.363; 90		1438.02Shields, Jason D.; Gray, Erin E.; Doyle, Abigail G.
A modular, air-stable nickel precatalyst.
Organic letters, 2015, 17, 2166-2169
1520304 CIFC66.33 H81.67 N2 O4 YbP 21 21 2115.592; 20.5827; 60.065
90; 90; 90		19276.4Zeng, Chao; Yuan, Dan; Zhao, Bei; Yao, Yingming
Highly Enantioselective Epoxidation of α,β-Unsaturated Ketones Catalyzed by Rare-Earth Amides [(Me3Si)2N]3RE(μ-Cl)Li(THF)3 with Phenoxy-Functionalized Chiral Prolinols.
Organic letters, 2015, 17, 2242-2245
1520305 CIFC6 H9 N O4C 1 2/c 116.4651; 6.6186; 14.9686
90; 109.033; 90		1542Roßbach, Jan; Harms, Klaus; Koert, Ulrich
α-Crotyl-α-difluoroboranyloxy-amides: Structure and Reactivity of Isolable Intermediates in Stereospecific α-Ketol Rearrangements.
Organic letters, 2015, 17, 3122-3125
1520306 CIFC12 H19 N O3P 1 21/c 111.0623; 9.4884; 11.6015
90; 90.961; 90		1217.56Roßbach, Jan; Harms, Klaus; Koert, Ulrich
α-Crotyl-α-difluoroboranyloxy-amides: Structure and Reactivity of Isolable Intermediates in Stereospecific α-Ketol Rearrangements.
Organic letters, 2015, 17, 3122-3125
1520307 CIFC10 H16 B F2 N O3P -19.5474; 11.4938; 11.5223
92.227; 96.964; 91.605		1253.45Roßbach, Jan; Harms, Klaus; Koert, Ulrich
α-Crotyl-α-difluoroboranyloxy-amides: Structure and Reactivity of Isolable Intermediates in Stereospecific α-Ketol Rearrangements.
Organic letters, 2015, 17, 3122-3125
1520308 CIFC12 H20 B F2 N O3P 1 21/n 17.8638; 14.0418; 12.6427
90; 91.6599; 90		1395.45Roßbach, Jan; Harms, Klaus; Koert, Ulrich
α-Crotyl-α-difluoroboranyloxy-amides: Structure and Reactivity of Isolable Intermediates in Stereospecific α-Ketol Rearrangements.
Organic letters, 2015, 17, 3122-3125

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