Crystallography Open Database

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1518151 CIFC18 H16 Br N O3P 21 21 215.9343; 11.372; 23.049
90; 90; 90
1555.5He, Ling; Zhao, Liang; Wang, De-Xian; Wang, Mei-Xiang
Catalytic asymmetric difunctionalization of stable tertiary enamides with salicylaldehydes: highly efficient, enantioselective, and diastereoselective synthesis of diverse 4-chromanol derivatives.
Organic letters, 2014, 16, 5972-5975
1518152 CIFC19.5 H19 Br N O3.5C 1 2 114.001; 10.574; 13.214
90; 110.89; 90
1827.7He, Ling; Zhao, Liang; Wang, De-Xian; Wang, Mei-Xiang
Catalytic asymmetric difunctionalization of stable tertiary enamides with salicylaldehydes: highly efficient, enantioselective, and diastereoselective synthesis of diverse 4-chromanol derivatives.
Organic letters, 2014, 16, 5972-5975
1518153 CIFC20 H22 Br N O3P 1 21 116.5841; 6.431; 18.0484
90; 104.578; 90
1862.93Zhan, Gu; He, Qing; Yuan, Xin; Chen, Ying-Chun
Asymmetric direct vinylogous Michael additions of allyl alkyl ketones to maleimides through dienamine catalysis.
Organic letters, 2014, 16, 6000-6003
1518156 CIFC154 H192 S18P -113.3862; 23.118; 26.137
77.272; 88.52; 86.926
7877.5Adachi, Kazuhiko; Hirao, Yasukazu; Matsumoto, Kouzou; Kubo, Takashi; Kurata, Hiroyuki
Synthesis of sexithiophene-bridged cage compound: a new class of three-dimensionally expanded oligothiophenes.
Organic letters, 2014, 16, 5870-5873
1518157 CIFC106 H136 S12P -114.1021; 14.456; 15.5321
100.882; 113.427; 110
2529.1Adachi, Kazuhiko; Hirao, Yasukazu; Matsumoto, Kouzou; Kubo, Takashi; Kurata, Hiroyuki
Synthesis of sexithiophene-bridged cage compound: a new class of three-dimensionally expanded oligothiophenes.
Organic letters, 2014, 16, 5870-5873
1518175 CIFC74 H64 F24 N8 O10 P4P -113.6675; 27.6576; 28.2284
62.073; 88.936; 86.633
9411.2Liu, Hua; Li, Xiao-Yan; Zhao, Xiao-Li; Liu, Yahu A.; Li, Jiu-Sheng; Jiang, Biao; Wen, Ke
[2]Pseudorotaxanes and [2]catenanes constructed by oxacalixcrowns/viologen molecular recognition motifs.
Organic letters, 2014, 16, 5894-5897
1518176 CIFC66 H62 F24 N8 O10 P4P 1 21/c 124.3811; 17.445; 20.4684
90; 91.25; 90
8703.7Liu, Hua; Li, Xiao-Yan; Zhao, Xiao-Li; Liu, Yahu A.; Li, Jiu-Sheng; Jiang, Biao; Wen, Ke
[2]Pseudorotaxanes and [2]catenanes constructed by oxacalixcrowns/viologen molecular recognition motifs.
Organic letters, 2014, 16, 5894-5897
1518177 CIFC51 H44 F12 N6 O13 P2P b c n16.4977; 18.1051; 19.5351
90; 90; 90
5835Liu, Hua; Li, Xiao-Yan; Zhao, Xiao-Li; Liu, Yahu A.; Li, Jiu-Sheng; Jiang, Biao; Wen, Ke
[2]Pseudorotaxanes and [2]catenanes constructed by oxacalixcrowns/viologen molecular recognition motifs.
Organic letters, 2014, 16, 5894-5897
1518178 CIFC22 H15 N O2P -18.4366; 8.812; 11.1014
83.374; 87.099; 87.095
817.91Wu, Jie; Lan, Jingbo; Guo, Siyuan; You, Jingsong
Pd-catalyzed C-H carbonylation of (hetero)arenes with formates and intramolecular dehydrogenative coupling: a shortcut to indolo[3,2-c]coumarins.
Organic letters, 2014, 16, 5862-5865
1518179 CIFC22 H17 N O2P 1 21/n 111.7149; 11.30687; 13.08437
90; 95.1593; 90
1726.12Wu, Jie; Lan, Jingbo; Guo, Siyuan; You, Jingsong
Pd-catalyzed C-H carbonylation of (hetero)arenes with formates and intramolecular dehydrogenative coupling: a shortcut to indolo[3,2-c]coumarins.
Organic letters, 2014, 16, 5862-5865
1518180 CIFC18 H21 Br2 N O3P 1 21/n 113.264; 9.5605; 14.416
90; 104.88; 90
1766.8Mantelingu, Kempegowda; Lin, Yingfu; Seidel, Daniel
Intramolecular [3 + 2]-cycloadditions of azomethine ylides derived from secondary amines via redox-neutral C-H functionalization.
Organic letters, 2014, 16, 5910-5913
1518181 CIFC17 H19 Br2 N O3C 1 2/c 110.5493; 15.5828; 21.01
90; 99.522; 90
3406.2Mantelingu, Kempegowda; Lin, Yingfu; Seidel, Daniel
Intramolecular [3 + 2]-cycloadditions of azomethine ylides derived from secondary amines via redox-neutral C-H functionalization.
Organic letters, 2014, 16, 5910-5913
1518182 CIFC28 H27 N O3P 1 21/n 111.9038; 9.3509; 20.79
90; 97.402; 90
2294.9Mantelingu, Kempegowda; Lin, Yingfu; Seidel, Daniel
Intramolecular [3 + 2]-cycloadditions of azomethine ylides derived from secondary amines via redox-neutral C-H functionalization.
Organic letters, 2014, 16, 5910-5913
1518183 CIFC22 H22 Br N O3P 1 21/c 117.7224; 12.6053; 8.4669
90; 100.641; 90
1858.9Mantelingu, Kempegowda; Lin, Yingfu; Seidel, Daniel
Intramolecular [3 + 2]-cycloadditions of azomethine ylides derived from secondary amines via redox-neutral C-H functionalization.
Organic letters, 2014, 16, 5910-5913
1518184 CIFC24 H27 O9.5P 21 21 214.1928; 17.7023; 10.7282
90; 90; 90
2695.4Luo, Jian-Guang; Wang, Xiao-Bing; Xu, Ya-Ming; U'Ren, Jana M; Arnold, A. Elizabeth; Kong, Ling-Yi; Gunatilaka, A. A. Leslie
Delitschiapyrone A, a pyrone-naphthalenone adduct bearing a new pentacyclic ring system from the leaf-associated fungus Delitschia sp. FL1581.
Organic letters, 2014, 16, 5944-5947
1518193 CIFC17 H14 F3 N O2P 1 21/c 115.116; 8.2473; 12.417
90; 104.84; 90
1496.3Han, Guifang; Wang, Qiang; Liu, Yuxiu; Wang, Qingmin
Copper-mediated α-trifluoromethylation of N-phenylcinnamamides coupled with dearomatization: access to trifluoromethylated 1-azaspiro[4.5]decanes.
Organic letters, 2014, 16, 5914-5917
1518194 CIFC22 H20 F3 N O4P 1 21/c 110.383; 11.016; 17.728
90; 90.68; 90
2027.6Han, Guifang; Wang, Qiang; Liu, Yuxiu; Wang, Qingmin
Copper-mediated α-trifluoromethylation of N-phenylcinnamamides coupled with dearomatization: access to trifluoromethylated 1-azaspiro[4.5]decanes.
Organic letters, 2014, 16, 5914-5917
1518195 CIFC16 H19 N O3P b c a37.202; 8.9299; 9.4735
90; 90; 90
3147.2Li, Pan; Zhao, Jingjing; Xia, Chungu; Li, Fuwei
Direct oxidative coupling of enamides and 1,3-dicarbonyl compounds: a facile and versatile approach to dihydrofurans, furans, pyrroles, and dicarbonyl enamides.
Organic letters, 2014, 16, 5992-5995
1518196 CIFC15 H17 F2 N O5P 1 21/c 110.3815; 8.8496; 16.7103
90; 99.942; 90
1512.16Wang, Lin; Wei, Xiao-Jing; Jia, Wen-Liang; Zhong, Jian-Ji; Wu, Li-Zhu; Liu, Qiang
Visible-light-driven difluoroacetamidation of unactive arenes and heteroarenes by direct C-H functionalization at room temperature.
Organic letters, 2014, 16, 5842-5845
1518238 CIFC11 H14 O2P 1 21/c 113.021; 5.756; 13.563
90; 96.16; 90
1010.7Wang, Yang; Ren, Wenlong; Li, Jingfu; Wang, Haining; Shi, Yian
Facile palladium-catalyzed hydrocarboxylation of olefins without external CO gas.
Organic letters, 2014, 16, 5960-5963
1518261 CIFC18 H16 Br N O2P n a 217.4367; 10.056; 20.4018
90; 90; 90
1525.72Dhanasekaran, Sivasankaran; Bisai, Vishnumaya; Unhale, Rajshekhar A.; Suneja, Arun; Singh, Vinod K.
A General Catalytic Route to Isoindolinones and Tetrahydroisoquinolines: Application in the Synthesis of (±)-Crispine A.
Organic letters, 2014, 16, 6068
1518262 CIFC28 H37 N O4 S SiP -18.086; 8.8985; 20.084
89.551; 83.782; 84.105
1429Feng, Chao; Feng, Daming; Luo, Yang; Loh, Teck-Peng
Rhodium(III)-catalyzed olefinic C-H alkynylation of acrylamides using tosyl-imide as directing group.
Organic letters, 2014, 16, 5956-5959
1518263 CIFC14 H9 F3 O SP -18.1372; 8.8688; 9.2448
85.665; 71.248; 78.759
619.577Kwiatkowski, Piotr; Cholewiak, Agnieszka; Kasztelan, Adrian
Efficient and highly enantioselective construction of trifluoromethylated quaternary stereogenic centers via high-pressure mediated organocatalytic conjugate addition of nitromethane to β,β-disubstituted enones.
Organic letters, 2014, 16, 5930-5933
1518264 CIFC15 H12 F3 N O3 SP 21 21 219.6417; 10.208; 14.8652
90; 90; 90
1463.07Kwiatkowski, Piotr; Cholewiak, Agnieszka; Kasztelan, Adrian
Efficient and highly enantioselective construction of trifluoromethylated quaternary stereogenic centers via high-pressure mediated organocatalytic conjugate addition of nitromethane to β,β-disubstituted enones.
Organic letters, 2014, 16, 5930-5933
1518265 CIFC14 H11 F3 N2 O3 SP 21 21 219.1017; 10.9849; 14.3201
90; 90; 90
1431.74Kwiatkowski, Piotr; Cholewiak, Agnieszka; Kasztelan, Adrian
Efficient and highly enantioselective construction of trifluoromethylated quaternary stereogenic centers via high-pressure mediated organocatalytic conjugate addition of nitromethane to β,β-disubstituted enones.
Organic letters, 2014, 16, 5930-5933
1518266 CIFC26 H22 N2 O3P 1 21/n 19.6275; 22.502; 20.134
90; 103.262; 90
4245.5Li, Deng Yuan; Chen, Hao Jie; Liu, Pei Nian
Rhodium-Catalyzed Oxidative Annulation of Hydrazines with Alkynes Using a Nitrobenzene Oxidant.
Organic letters, 2014, 16, 6176
1518267 CIFC22 H18 N2 OP 1 21/c 113.4742; 9.3259; 14.3879
90; 96.755; 90
1795.4Li, Deng Yuan; Chen, Hao Jie; Liu, Pei Nian
Rhodium-Catalyzed Oxidative Annulation of Hydrazines with Alkynes Using a Nitrobenzene Oxidant.
Organic letters, 2014, 16, 6176
1518268 CIFC22 H16 Br2 N2P 1 21/n 112.729; 8.6285; 17.199
90; 99.28; 90
1864.3Wen, Jia-Jie; Tang, Hai-Tao; Xiong, Kai; Ding, Zong-Cang; Zhan, Zhuang-Ping
Synthesis of polysubstituted pyrazoles by a platinum-catalyzed sigmatropic rearrangement/cyclization cascade.
Organic letters, 2014, 16, 5940-5943
1518269 CIFC9 H6 Br N OP 1 21 19.584; 4.1885; 11.089
90; 93.215; 90
444.4Chen, Wenwen; Wang, Bo; Liu, Nan; Huang, Dayun; Wang, Xinyan; Hu, Yuefei
Tandem Synthesis of 3-Halo-5-Substituted Isoxazoles from 1-Copper(I) Alkynes and Dihaloformaldoximes.
Organic letters, 2014, 16, 6140
1518270 CIFC17 H18 Br F3 N2 O5P 21 21 213.3503; 26.402; 11.0275
90; 90; 90
3886.9Li, Lei; Guo, Jing-Yao; Liu, Xing-Guo; Chen, Su; Wang, Yong; Tan, Bin; Liu, Xin-Yuan
Amide groups switch selectivity: C-H trifluoromethylation of α,β-unsaturated amides and subsequent asymmetric transformation.
Organic letters, 2014, 16, 6032-6035
1518271 CIFC8 H8 F3 N O3P 1 21/c 18.9671; 5.4454; 19.6033
90; 96.926; 90
950.23Li, Lei; Guo, Jing-Yao; Liu, Xing-Guo; Chen, Su; Wang, Yong; Tan, Bin; Liu, Xin-Yuan
Amide groups switch selectivity: C-H trifluoromethylation of α,β-unsaturated amides and subsequent asymmetric transformation.
Organic letters, 2014, 16, 6032-6035
1518272 CIFC22 H27 N O2 SP -18.531; 11.497; 20.128
85.723; 89.4; 85.923
1963.7Cai, Pei-Jun; Wang, Yi; Liu, Cheng-Hang; Yu, Zhi-Xiang
Gold(I)-catalyzed polycyclization of linear dienediynes to seven-membered ring-containing polycycles via tandem cyclopropanation/Cope rearrangement/C-H activation.
Organic letters, 2014, 16, 5898-5901
1518273 CIFC19 H31 N O5 S SiP 1 21 16.3758; 7.2968; 23.1833
90; 90.148; 90
1078.55Kern, Nicolas; Felten, Anne-Sophie; Weibel, Jean-Marc; Pale, Patrick; Blanc, Aurélien
Robust Synthesis of N-Sulfonylazetidine Building Blocks via Ring Contraction of α-Bromo N-Sulfonylpyrrolidinones.
Organic letters, 2014, 16, 6104
1518274 CIFC18 H28 Br N O4 S SiP 1 21 17.0702; 12.6435; 12.345
90; 95.852; 90
1097.79Kern, Nicolas; Felten, Anne-Sophie; Weibel, Jean-Marc; Pale, Patrick; Blanc, Aurélien
Robust Synthesis of N-Sulfonylazetidine Building Blocks via Ring Contraction of α-Bromo N-Sulfonylpyrrolidinones.
Organic letters, 2014, 16, 6104
1518287 CIFC32 H27 N OP 1 21/c 112.1929; 8.855; 22.6406
90; 93.615; 90
2439.6Gangadhararao, G.; Uruvakilli, Anasuyamma; Swamy, K. C. Kumara
Brønsted Acid Mediated Alkenylation and Copper-Catalyzed Aerobic Oxidative Ring Expansion/Intramolecular Electrophilic Substitution of Indoles with Propargyl Alcohols: A Novel One-Pot Approach to Cyclopenta[c]quinolines.
Organic letters, 2014, 16, 6060
1518288 CIFC32 H25 N OP 1 21/c 111.424; 9.4223; 21.475
90; 99.68; 90
2278.7Gangadhararao, G.; Uruvakilli, Anasuyamma; Swamy, K. C. Kumara
Brønsted Acid Mediated Alkenylation and Copper-Catalyzed Aerobic Oxidative Ring Expansion/Intramolecular Electrophilic Substitution of Indoles with Propargyl Alcohols: A Novel One-Pot Approach to Cyclopenta[c]quinolines.
Organic letters, 2014, 16, 6060
1518289 CIFC32 H27 NP b c a14.348; 16.969; 19.737
90; 90; 90
4805.4Gangadhararao, G.; Uruvakilli, Anasuyamma; Swamy, K. C. Kumara
Brønsted Acid Mediated Alkenylation and Copper-Catalyzed Aerobic Oxidative Ring Expansion/Intramolecular Electrophilic Substitution of Indoles with Propargyl Alcohols: A Novel One-Pot Approach to Cyclopenta[c]quinolines.
Organic letters, 2014, 16, 6060
1518290 CIFC29 H27 N3 O5P -18.472; 10.696; 14.252
96.111; 90.184; 94.806
1279.5Wang, Bo; Lu, Chengxi; Zhang, Shu-Yu; He, Gang; Nack, William A.; Chen, Gong
Palladium-Catalyzed Stereoretentive Olefination of Unactivated C(sp(3))-H Bonds with Vinyl Iodides at Room Temperature: Synthesis of β-Vinyl α-Amino Acids.
Organic letters, 2014, 16, 6260
1518291 CIFC26 H21 N3 O4C 1 2/c 115.44; 21.826; 13.714
90; 110.809; 90
4320Wang, Bo; Lu, Chengxi; Zhang, Shu-Yu; He, Gang; Nack, William A.; Chen, Gong
Palladium-Catalyzed Stereoretentive Olefination of Unactivated C(sp(3))-H Bonds with Vinyl Iodides at Room Temperature: Synthesis of β-Vinyl α-Amino Acids.
Organic letters, 2014, 16, 6260
1518292 CIFC15 H24 O2P 1 21 19.1715; 6.5653; 11.0048
90; 92.975; 90
661.75Meng, Ling-Hong; Li, Xiao-Ming; Liu, Yang; Wang, Bin-Gui
Penicibilaenes A and B, Sesquiterpenes with a Tricyclo[6.3.1.0(1,5)]dodecane Skeleton from the Marine Isolate of Penicillium bilaiae MA-267.
Organic letters, 2014, 16, 6052
1518293 CIFC17 H26 O3P 1 21 16.9819; 7.4115; 15.405
90; 93.279; 90
795.85Meng, Ling-Hong; Li, Xiao-Ming; Liu, Yang; Wang, Bin-Gui
Penicibilaenes A and B, Sesquiterpenes with a Tricyclo[6.3.1.0(1,5)]dodecane Skeleton from the Marine Isolate of Penicillium bilaiae MA-267.
Organic letters, 2014, 16, 6052
1518294 CIFC22 H28 N2 O4P 1 21/n 17.564; 23.309; 12.081
90; 100.459; 90
2094.6Dutta, Uttam; Maity, Soham; Kancherla, Rajesh; Maiti, Debabrata
Aerobic oxynitration of alkynes with (t)BuONO and TEMPO.
Organic letters, 2014, 16, 6302-6305
1518295 CIFC18 H23 N3 O3C 1 2/c 121.841; 13.887; 11.976
90; 93.43; 90
3625.9Dutta, Uttam; Maity, Soham; Kancherla, Rajesh; Maiti, Debabrata
Aerobic oxynitration of alkynes with (t)BuONO and TEMPO.
Organic letters, 2014, 16, 6302-6305
1518296 CIFC24 H38 Cl N3 O4 SiP 21 21 219.2055; 13.5568; 23.141
90; 90; 90
2887.93Liu, Bin; Liu, Tong-Yu; Luo, Shi-Wei; Gong, Liu-Zhu
Asymmetric Hetero-Diels-Alder Reaction of Diazenes Catalyzed by Chiral Silver Phosphate: Water Participates in the Catalysis and Stereocontrol.
Organic letters, 2014, 16, 6164
1518297 CIFC21 H14 B F2 N3P -16.3291; 11.9237; 12.5356
64.953; 82.314; 87.201
849.32Luo, Liang; Wu, Di; Li, Wei; Zhang, Shuai; Ma, Yuanhong; Yan, Su; You, Jingsong
Regioselective Decarboxylative Direct C-H Arylation of Boron Dipyrromethenes (BODIPYs) at 2,6-Positions: A Facile Access to a Diversity-Oriented BODIPY Library.
Organic letters, 2014, 16, 6080
1518298 CIFC29 H18 B F7 N2 O2P -110.1332; 10.6774; 13.4051
113.01; 92.431; 102.849
1288Luo, Liang; Wu, Di; Li, Wei; Zhang, Shuai; Ma, Yuanhong; Yan, Su; You, Jingsong
Regioselective Decarboxylative Direct C-H Arylation of Boron Dipyrromethenes (BODIPYs) at 2,6-Positions: A Facile Access to a Diversity-Oriented BODIPY Library.
Organic letters, 2014, 16, 6080
1518299 CIFC22 H28 O8P 1 21 19.7368; 10.0377; 10.8538
90; 98.496; 90
1049.2Yun, Young Sook; Fukaya, Haruhiko; Nakane, Takahisa; Takano, Akihito; Takahashi, Shigeru; Takahashi, Yuji; Inoue, Hideshi
A New Bis-seco-abietane Diterpenoid from Hyptis crenata Pohl ex Benth.
Organic letters, 2014, 16, 6188
1518300 CIFC18 H17 N O2 SP 1 21/c 112.8499; 10.5117; 12.0432
90; 109.182; 90
1536.41Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju
One-Pot Access to Sulfonylmethyl Arylpyrroles via the Domino Aerobic Wacker-Type Aminocyclization/1,4-Sulfonyl Migration.
Organic letters, 2014, 16, 6252
1518301 CIFC18 H16 F N O2 SP -18.85; 9.016; 10.514
111.443; 92.219; 94.247
776.8Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju
One-Pot Access to Sulfonylmethyl Arylpyrroles via the Domino Aerobic Wacker-Type Aminocyclization/1,4-Sulfonyl Migration.
Organic letters, 2014, 16, 6252
1518302 CIFC19 H16 F3 N O2 SP -18.617; 9.533; 11.024
82.313; 85.656; 79.88
882.2Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju
One-Pot Access to Sulfonylmethyl Arylpyrroles via the Domino Aerobic Wacker-Type Aminocyclization/1,4-Sulfonyl Migration.
Organic letters, 2014, 16, 6252

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