Crystallography Open Database

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Searching journal of publication like 'Organic Chemistry Frontiers' volume of publication is 4

COD ID: 1553497
CIF file Formula: - C19 H17 N O4 -
Comments: Dai, Jie; Ren, Wenlong; Chang, Wenju; Zhang, Ping; Shi, Yian An effective route to β2-amino acid derivatives via Pd-catalyzed regioselective hydrocarboxylation of 1,2-disubstituted enimides Organic Chemistry Frontiers 4(2) (2017) 297
Space group: P -1
Cell volume: 817.8
Cell parameters: 8.125; 9.328; 11.408; 90.91; 96.19; 107.69;  

COD ID: 1553519
CIF file Formula: - C36 H32 F2 N2 O2 -
Comments: Zhu, Zi-Qi; Yin, Lei; Wang, Yang; Shen, Yang; Li, Can; Mei, Guang-Jian; Shi, Feng Diastereo- and enantioselective construction of biologically important pyrrolo[1,2-a]indole scaffolds via catalytic asymmetric [3 + 2] cyclodimerizations of 3-alkyl-2-vinylindoles Organic Chemistry Frontiers 4(1) (2017) 57
Space group: P 21 21 21
Cell volume: 2896.78
Cell parameters: 11.5593; 14.0068; 17.8914; 90; 90; 90;  

COD ID: 1553520
CIF file Formula: - C44 H50 N2 -
Comments: Zhu, Zi-Qi; Yin, Lei; Wang, Yang; Shen, Yang; Li, Can; Mei, Guang-Jian; Shi, Feng Diastereo- and enantioselective construction of biologically important pyrrolo[1,2-a]indole scaffolds via catalytic asymmetric [3 + 2] cyclodimerizations of 3-alkyl-2-vinylindoles Organic Chemistry Frontiers 4(1) (2017) 57
Space group: P 1 21/c 1
Cell volume: 3575
Cell parameters: 19.661; 10.71; 17.118; 90; 97.306; 90;  

COD ID: 1553521
CIF file Formula: - C16 H18 O3 S -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P -1
Cell volume: 717.55
Cell parameters: 6.9478; 9.1969; 11.8012; 82.206; 81.643; 75.22;  

COD ID: 1553522
CIF file Formula: - C15 H16 O2 S -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P 1 21/n 1
Cell volume: 1331.76
Cell parameters: 7.68603; 23.9176; 7.76261; 90; 111.053; 90;  

COD ID: 1553523
CIF file Formula: - C14 H11 N S -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P 1 21/n 1
Cell volume: 1142.71
Cell parameters: 5.7042; 25.743; 7.8069; 90; 94.59; 90;  

COD ID: 1553524
CIF file Formula: - C15 H14 O S -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P 1 21/n 1
Cell volume: 1223.85
Cell parameters: 5.7958; 25.4544; 8.3123; 90; 93.626; 90;  

COD ID: 1553525
CIF file Formula: - C15 H14 O2 S -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P 1 21/n 1
Cell volume: 1279.8
Cell parameters: 5.611; 25.6833; 8.991; 90; 98.982; 90;  

COD ID: 1553526
CIF file Formula: - C14 H11 N O S -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P 1 21/n 1
Cell volume: 1183.53
Cell parameters: 5.67633; 26.8781; 7.7875; 90; 95.042; 90;  

COD ID: 1553527
CIF file Formula: - C14 H8 N2 S2 -
Comments: Wang, Yang; Zhang, Xiaofeng; Liu, Haixiong; Chen, Hui; Huang, Deguang Nickel-catalyzed direct formation of the C–S bonds of aryl sulfides from arylsulfonyl chlorides and aryl iodides using Mn as a reducing agent Organic Chemistry Frontiers 4(1) (2017) 31
Space group: P -1
Cell volume: 1263.68
Cell parameters: 7.8232; 11.6428; 14.5818; 84.863; 83.654; 73.557;  

COD ID: 1553530
CIF file Formula: - C35 H53 N O3 -
Comments: Li, Zheng-Yu; Qi, Feng-Ming; Zhi, De-Juan; Hu, Qiao-Ling; Liu, Ying-Hong; Zhang, Zhan-Xin; Fei, Dong-Qing A novel spirocyclic triterpenoid and a new taraxerane triterpenoid from Teucrium viscidum Organic Chemistry Frontiers 4(1) (2017) 42
Space group: P 1 21 1
Cell volume: 1564.44
Cell parameters: 7.455; 11.3624; 18.4877; 90; 92.585; 90;  

COD ID: 1553531
CIF file Formula: - C30 H50 O3 -
Comments: Li, Zheng-Yu; Qi, Feng-Ming; Zhi, De-Juan; Hu, Qiao-Ling; Liu, Ying-Hong; Zhang, Zhan-Xin; Fei, Dong-Qing A novel spirocyclic triterpenoid and a new taraxerane triterpenoid from Teucrium viscidum Organic Chemistry Frontiers 4(1) (2017) 42
Space group: P 21 21 21
Cell volume: 2684.78
Cell parameters: 6.52391; 12.9427; 31.7963; 90; 90; 90;  

COD ID: 1553543
CIF file Formula: - C22 H21 N O2 -
Comments: Yu, Wenlong; Zhang, Wei; Liu, Yue; Liu, Zhanxiang; Zhang, Yuhong Cobalt(iii)-catalyzed cross-coupling of enamides with allyl acetates/maleimides Organic Chemistry Frontiers 4(1) (2017) 77
Space group: P 1 21/n 1
Cell volume: 1845.7
Cell parameters: 7.348; 22.781; 11.236; 90; 101.092; 90;  

COD ID: 1553544
CIF file Formula: - C15 H16 N2 O3 -
Comments: Yu, Wenlong; Zhang, Wei; Liu, Yue; Liu, Zhanxiang; Zhang, Yuhong Cobalt(iii)-catalyzed cross-coupling of enamides with allyl acetates/maleimides Organic Chemistry Frontiers 4(1) (2017) 77
Space group: P 1 21/n 1
Cell volume: 1387.3
Cell parameters: 9.3103; 4.8793; 30.741; 90; 96.596; 90;  

COD ID: 1553545
CIF file Formula: - C25 H21 N O2 S -
Comments: Gong, Xinxing; Li, Guangming; Wu, Jie Synthesis of polycyclic sultams via a palladium-catalyzed reaction of 1-bromo-2-(cyclopropylidenemethyl)benzenes with 2-alkynylbenzenesulfonamides Organic Chemistry Frontiers 4(1) (2017) 14
Space group: R 3 c :H
Cell volume: 10970
Cell parameters: 33.922; 33.922; 11.008; 90; 90; 120;  

COD ID: 1553547
CIF file Formula: - C18 H12 Br2 -
Comments: Wilbuer, J.; Grenz, D. C.; Schnakenburg, G.; Esser, B. Donor- and acceptor-functionalized dibenzo[a,e]pentalenes: modulation of the electronic band gap Organic Chemistry Frontiers 4(5) (2017) 658
Space group: P 1 21/n 1
Cell volume: 700.59
Cell parameters: 5.3248; 17.2473; 7.6729; 90; 96.167; 90;  

COD ID: 1553548
CIF file Formula: - C20 H16 Br2 -
Comments: Wilbuer, J.; Grenz, D. C.; Schnakenburg, G.; Esser, B. Donor- and acceptor-functionalized dibenzo[a,e]pentalenes: modulation of the electronic band gap Organic Chemistry Frontiers 4(5) (2017) 658
Space group: P 1 21/c 1
Cell volume: 810.2
Cell parameters: 6.6723; 8.653; 15.099; 90; 111.66; 90;  

COD ID: 1553549
CIF file Formula: - C28 H16 Br2 -
Comments: Wilbuer, J.; Grenz, D. C.; Schnakenburg, G.; Esser, B. Donor- and acceptor-functionalized dibenzo[a,e]pentalenes: modulation of the electronic band gap Organic Chemistry Frontiers 4(5) (2017) 658
Space group: C 1 2/c 1
Cell volume: 2030.2
Cell parameters: 21.802; 4.9336; 18.875; 90; 90.188; 90;  

COD ID: 1553550
CIF file Formula: - C36 H32 Br2 -
Comments: Wilbuer, J.; Grenz, D. C.; Schnakenburg, G.; Esser, B. Donor- and acceptor-functionalized dibenzo[a,e]pentalenes: modulation of the electronic band gap Organic Chemistry Frontiers 4(5) (2017) 658
Space group: P -1
Cell volume: 1381.44
Cell parameters: 10.0648; 11.6684; 12.2462; 77.981; 86.017; 79.287;  

COD ID: 1553551
CIF file Formula: - C34 H28 Br2 -
Comments: Wilbuer, J.; Grenz, D. C.; Schnakenburg, G.; Esser, B. Donor- and acceptor-functionalized dibenzo[a,e]pentalenes: modulation of the electronic band gap Organic Chemistry Frontiers 4(5) (2017) 658
Space group: P 1 21/n 1
Cell volume: 1315.92
Cell parameters: 11.131; 10.249; 11.763; 90; 101.301; 90;  

COD ID: 1553552
CIF file Formula: - C50 H38 -
Comments: Wilbuer, J.; Grenz, D. C.; Schnakenburg, G.; Esser, B. Donor- and acceptor-functionalized dibenzo[a,e]pentalenes: modulation of the electronic band gap Organic Chemistry Frontiers 4(5) (2017) 658
Space group: P -1
Cell volume: 1889.2
Cell parameters: 10.8252; 13.5794; 14.2122; 114.377; 91.316; 95.604;  

COD ID: 1553554
CIF file Formula: - C18 H15 I O Se -
Comments: Pistoia, Renan P.; Roehrs, Juliano A.; Back, Davi F.; Zeni, Gilson Iodine-mediated regioselective 5-endo-dig electrophilic cyclization reaction of selenoenynes: synthesis of selenophene derivatives Organic Chemistry Frontiers 4(2) (2017) 277
Space group: C 1 2/c 1
Cell volume: 3293
Cell parameters: 20.3; 5.882; 27.651; 90; 94.075; 90;  

COD ID: 1553555
CIF file Formula: - C20 H19 I O Se -
Comments: Pistoia, Renan P.; Roehrs, Juliano A.; Back, Davi F.; Zeni, Gilson Iodine-mediated regioselective 5-endo-dig electrophilic cyclization reaction of selenoenynes: synthesis of selenophene derivatives Organic Chemistry Frontiers 4(2) (2017) 277
Space group: P 1 2/c 1
Cell volume: 1846.87
Cell parameters: 19.0809; 5.7136; 17.2112; 90; 100.175; 90;  

COD ID: 1553556
CIF file Formula: - C29 H25 Cl N2 O8 S -
Comments: He, Fu-Sheng; Li, Cong-Shan; Deng, Hua; Zheng, Xing; Yang, Zhong-Tao; Deng, Wei-Ping The facile and stereoselective synthesis of pyrrolidine β-amino acids via copper(i)-catalyzed asymmetric 1,3-dipolar cycloaddition Organic Chemistry Frontiers 4(1) (2017) 52
Space group: P 1 21 1
Cell volume: 1455.5
Cell parameters: 11.4186; 9.7011; 13.152; 90; 92.473; 90;  

COD ID: 1553557
CIF file Formula: - C25 H18 O2 -
Comments: Sreenivasulu, Chinnabattigalla; Gopi Krishna Reddy, A.; Satyanarayana, G. Oxidative annulations triggered by a simple Lewis acid: facile synthesis of benzofurans Organic Chemistry Frontiers 4(6) (2017) 972
Space group: P n 21 a
Cell volume: 1824.88
Cell parameters: 14.3717; 5.917; 21.4597; 90; 90; 90;  

COD ID: 1553558
CIF file Formula: - C20 H14 O -
Comments: Sreenivasulu, Chinnabattigalla; Gopi Krishna Reddy, A.; Satyanarayana, G. Oxidative annulations triggered by a simple Lewis acid: facile synthesis of benzofurans Organic Chemistry Frontiers 4(6) (2017) 972
Space group: P 21 21 21
Cell volume: 1403.16
Cell parameters: 7.9447; 10.3826; 17.0108; 90; 90; 90;  

COD ID: 1553559
CIF file Formula: - C27 H31 N O7 S3 -
Comments: Chen, Fei; Zhou, Neng-Neng; Zhan, Jun-Long; Han, Bing; Yu, Wei tert-Butyl nitrite-mediated vicinal sulfoximation of alkenes with sulfinic acids: a highly efficient approach toward α-sulfonyl ketoximes Organic Chemistry Frontiers 4(1) (2017) 135
Space group: P 1 21/c 1
Cell volume: 2801.6
Cell parameters: 21.226; 8.2493; 16.985; 90; 109.61; 90;  

COD ID: 1553560
CIF file Formula: - C15 H21 N O3 S -
Comments: Chen, Fei; Zhou, Neng-Neng; Zhan, Jun-Long; Han, Bing; Yu, Wei tert-Butyl nitrite-mediated vicinal sulfoximation of alkenes with sulfinic acids: a highly efficient approach toward α-sulfonyl ketoximes Organic Chemistry Frontiers 4(1) (2017) 135
Space group: C 1 2/c 1
Cell volume: 3055
Cell parameters: 25.961; 5.793; 22.2512; 90; 114.088; 90;  

COD ID: 1553561
CIF file Formula: - C18 H16 F3 N O2 S2 -
Comments: Chen, Min-Tao; Tang, Xiang-Ying; Shi, Min A facile approach for the trifluoromethylthiolation of methylenecyclopropanes Organic Chemistry Frontiers 4(1) (2017) 86
Space group: P -1
Cell volume: 927.9
Cell parameters: 6.52; 8.149; 18.175; 102.278; 95.21; 97.731;  

COD ID: 1553562
CIF file Formula: - C17 H15 N O2 -
Comments: Rajaguru, Kandasamy; Mariappan, Arumugam; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai Divergent reactivity of α-azidochalcones with metal β-diketonates: tunable synthesis of substituted pyrroles and indoles Organic Chemistry Frontiers 4(1) (2017) 124
Space group: P -1
Cell volume: 2629.2
Cell parameters: 13.451; 14.313; 15.248; 86.714; 63.827; 90.014;  

COD ID: 1553563
CIF file Formula: - C26 H20 Cl N O3 -
Comments: Rajaguru, Kandasamy; Mariappan, Arumugam; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai Divergent reactivity of α-azidochalcones with metal β-diketonates: tunable synthesis of substituted pyrroles and indoles Organic Chemistry Frontiers 4(1) (2017) 124
Space group: P -1
Cell volume: 1026.5
Cell parameters: 7.3875; 11.6702; 13.4944; 64.647; 82.911; 77.69;  

COD ID: 1553564
CIF file Formula: - C23 H24 N2 O6 S -
Comments: Rajaguru, Kandasamy; Mariappan, Arumugam; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai Divergent reactivity of α-azidochalcones with metal β-diketonates: tunable synthesis of substituted pyrroles and indoles Organic Chemistry Frontiers 4(1) (2017) 124
Space group: P -1
Cell volume: 1079.97
Cell parameters: 8.5455; 12.047; 12.1501; 60.733; 81.883; 87.112;  

COD ID: 1553565
CIF file Formula: - C44 H52 N4 S4 -
Comments: Xia, Debin; Keerthi, Ashok; An, Cunbin; Baumgarten, Martin Synthesis of a quinoidal dithieno[2,3-d;2′,3′-d]benzo[2,1-b;3,4-b′]-dithiophene based open-shell singlet biradicaloid Organic Chemistry Frontiers 4(1) (2017) 18
Space group: P -1
Cell volume: 2023.6
Cell parameters: 9.3265; 9.7095; 23.593; 78.225; 84.998; 75.52;  

COD ID: 1553566
CIF file Formula: - C20 H21 N O8 -
Comments: Zhang, Li; Zhang, Beichen; Jiang, Teng; Lu, Tao; Zhou, Qingfa Synthesis of tricyclic 3-hydroxyisoindolin-1-ones via triethylamine-catalyzed domino reactions of electron-deficient alkynes with phthalimidomalonate derivatives Organic Chemistry Frontiers 4(1) (2017) 119
Space group: P 1 21/c 1
Cell volume: 2017.8
Cell parameters: 8.101; 19.041; 13.693; 90; 107.19; 90;  

COD ID: 1553567
CIF file Formula: - C22 H16 Cl N O2 -
Comments: Zhu, Chao-Qun; Deng, Zhuo-Fei; Zhang, Yahong; Wang, You-Qing Synthesis of 4-substituted 3-(2-hydroxyphenyl)-quinolines through an unexpected iron(iii) chloride promoted reaction of cyclic imine dibenzo[b,f][1,4]oxazepines with alkynes Organic Chemistry Frontiers 4(2) (2017) 196
Space group: P 1 21/n 1
Cell volume: 1779.4
Cell parameters: 11.366; 11.305; 14.788; 90; 110.536; 90;  

COD ID: 1553568
CIF file Formula: - C33 H30 N4 O3 -
Comments: Cheng, Cang; Lu, Xuehe; Ge, Luo; Chen, Jie; Cao, Weiguo; Wu, Xiaoyu; Zhao, Gang Effective asymmetric vinylogous Mannich reaction of isatin imines with α,α-dicyanoolefins in the presence of a simple chiral amide phosphonium bifunctional phase transfer catalyst Organic Chemistry Frontiers 4(1) (2017) 101
Space group: P 1 21 1
Cell volume: 1397.9
Cell parameters: 8.902; 13.209; 12.059; 90; 99.65; 90;  

COD ID: 1553569
CIF file Formula: - C31 H27 Br N4 O3 -
Comments: Cheng, Cang; Lu, Xuehe; Ge, Luo; Chen, Jie; Cao, Weiguo; Wu, Xiaoyu; Zhao, Gang Effective asymmetric vinylogous Mannich reaction of isatin imines with α,α-dicyanoolefins in the presence of a simple chiral amide phosphonium bifunctional phase transfer catalyst Organic Chemistry Frontiers 4(1) (2017) 101
Space group: P 21 21 21
Cell volume: 2901
Cell parameters: 9.662; 12.286; 24.441; 90; 90; 90;  

COD ID: 1553570
CIF file Formula: - C25 H23 N O3 -
Comments: Xu, Meng-Meng; Wang, Hai-Qing; Wan, Ying; He, Guofeng; Yan, Jingjing; Zhang, Shu; Wang, Shu-Liang; Shi, Feng Catalytic asymmetric substitution of ortho-hydroxybenzyl alcohols with tetronic acid-derived enamines: enantioselective synthesis of tetronic acid-derived diarylmethanes Organic Chemistry Frontiers 4(3) (2017) 358
Space group: P 41
Cell volume: 2073.13
Cell parameters: 8.4091; 8.4091; 29.3175; 90; 90; 90;  

COD ID: 1553571
CIF file Formula: - C15 H17 Cl N2 O3 -
Comments: Peng, Xiao-Jiao; Ho, Yee Ann; Wang, Zhi-Peng; Shao, Pan-Lin; Zhao, Yu; He, Yun Formal [3 + 2] cycloaddition of α-unsubstituted isocyanoacetates and methyleneindolinones: enantioselective synthesis of spirooxindoles Organic Chemistry Frontiers 4(1) (2017) 81
Space group: P 21 21 21
Cell volume: 1488.92
Cell parameters: 7.2915; 12.7983; 15.9552; 90; 90; 90;  

COD ID: 1553572
CIF file Formula: - C15 H11 Cl F3 N3 O3 -
Comments: Hao, Xin-Qi; Wang, Cong; Liu, Shuang-Liang; Wang, Xiao; Wang, Li; Gong, Jun-Fang; Song, Mao-Ping Cobalt(ii)/(imidazoline–oxazoline)-catalyzed enantioselective Michael addition of 2-acetyl azaarenes to β-CF3-β-disubstituted nitroalkenes Organic Chemistry Frontiers 4(2) (2017) 308
Space group: P 21 21 21
Cell volume: 1533.5
Cell parameters: 7.74798; 9.1129; 21.719; 90; 90; 90;  

COD ID: 1553573
CIF file Formula: - C14 H13 N3 O S -
Comments: Chen, Jichao; Wang, Tianyu; Wang, Tong; Lin, Aijun; Yao, Hequan; Xu, Jinyi Copper-catalyzed C5-selective thio/selenocyanation of 8-aminoquinolines Organic Chemistry Frontiers 4(1) (2017) 130
Space group: P -1
Cell volume: 667.9
Cell parameters: 7.68; 8.494; 11.449; 85.96; 77.314; 66.467;  

COD ID: 1553574
CIF file Formula: - C19 H23 Br N O3 P -
Comments: Wang, Xubin; Wang, Xiaoming; Han, Zhaobin; Wang, Zheng; Ding, Kuiling Palladium-catalyzed asymmetric allylic amination: enantioselective synthesis of chiral α-methylene substituted β-aminophosphonates Organic Chemistry Frontiers 4(2) (2017) 271
Space group: P 21 21 2
Cell volume: 2034.1
Cell parameters: 9.8916; 26.4389; 7.7778; 90; 90; 90;  

COD ID: 1553575
CIF file Formula: - C153.47 H187.47 Cl4.41 N2 Si8 -
Comments: Ushiyama, Ayako; Hiroto, Satoru; Yuasa, Junpei; Kawai, Tsuyoshi; Shinokubo, Hiroshi Synthesis of a figure-eight azahelicene dimer with high emission and CPL properties Organic Chemistry Frontiers 4(5) (2017) 664
Space group: P 41 21 2
Cell volume: 29105.4
Cell parameters: 21.2715; 21.2715; 64.3247; 90; 90; 90;  

COD ID: 1553576
CIF file Formula: - C21 H21 Cl F N O2 -
Comments: Li, Jianxiao; Hu, Weigao; Li, Chunsheng; Yang, Shaorong; Wu, Wanqing; Jiang, Huanfeng Palladium-catalyzed cascade reaction of haloalkynes with unactivated alkenes for assembly of functionalized oxetanes Organic Chemistry Frontiers 4(3) (2017) 373
Space group: P 1 21/c 1
Cell volume: 1861.42
Cell parameters: 9.4639; 21.8249; 9.3192; 90; 104.752; 90;  

COD ID: 1553577
CIF file Formula: - C15 H15 Br O2 -
Comments: Li, Jing; Li, Zequan; Zhang, Xun; Xu, Bing; Shi, Yian Catalytic enantioselective bromohydroxylation of aryl olefins with flexible functionalities Organic Chemistry Frontiers 4(6) (2017) 1084
Space group: P 1 21 1
Cell volume: 639.7
Cell parameters: 7.813; 5.321; 15.394; 90; 91.594; 90;  

COD ID: 1553578
CIF file Formula: - C11 H14 Br F O2 -
Comments: Li, Jing; Li, Zequan; Zhang, Xun; Xu, Bing; Shi, Yian Catalytic enantioselective bromohydroxylation of aryl olefins with flexible functionalities Organic Chemistry Frontiers 4(6) (2017) 1084
Space group: P 21 21 21
Cell volume: 3559
Cell parameters: 5.651; 16.364; 38.4918; 90; 90; 90;  

COD ID: 1553579
CIF file Formula: - C17 H12 B F2 N5 O -
Comments: Barbon, Stephanie M.; Novoa, Samantha; Bender, Desiree; Groom, Hilary; Luyt, Leonard G.; Gilroy, Joe B. Copper-assisted azide‒alkyne cycloaddition chemistry as a tool for the production of emissive boron difluoride 3-cyanoformazanates Organic Chemistry Frontiers 4(2) (2017) 178
Space group: C 1 2/c 1
Cell volume: 1595.5
Cell parameters: 10.248; 14.634; 11.146; 90; 107.352; 90;  

COD ID: 1553580
CIF file Formula: - C16 H10 Br2 Cl F3 -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: P -1
Cell volume: 1635.33
Cell parameters: 7.3184; 13.4865; 17.4149; 101.672; 94.139; 101.918;  

COD ID: 1553581
CIF file Formula: - C20 H20 Br F3 O -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: P -1
Cell volume: 905.55
Cell parameters: 7.8481; 10.5581; 12.2042; 75.472; 72.741; 72.301;  

COD ID: 1553582
CIF file Formula: - C20 H20 Br F3 O2 -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: P -1
Cell volume: 923.7
Cell parameters: 8.3533; 9.4941; 12.1934; 100.216; 97.306; 100.289;  

COD ID: 1553583
CIF file Formula: - C18 H15 Br2 F3 -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: P b c a
Cell volume: 3233.72
Cell parameters: 16.4974; 6.84171; 28.6498; 90; 90; 90;  

COD ID: 1553584
CIF file Formula: - C16 H11 Br2 F3 -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: P -1
Cell volume: 1487.32
Cell parameters: 7.1399; 9.7404; 22.8361; 97.673; 97.146; 106.455;  

COD ID: 1553585
CIF file Formula: - C17 H12 Br F3 -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: C 1 2/c 1
Cell volume: 2771
Cell parameters: 22.8229; 7.4881; 16.5828; 90; 102.102; 90;  

COD ID: 1553586
CIF file Formula: - C19 H17 Br Cl F3 -
Comments: Kazakova, Anna N.; Iakovenko, Roman O.; Boyarskaya, Irina A.; Ivanov, Alexander Yu.; Avdontceva, Margarita S.; Zolotarev, Andrei A.; Panikorovsky, Taras L.; Starova, Galina L.; Nenajdenko, Valentine G.; Vasilyev, Aleksander V. Brominated CF3-allyl alcohols as multicentered electrophiles in TfOH promoted reactions with arenes Organic Chemistry Frontiers 4(2) (2017) 255
Space group: P 1 21/c 1
Cell volume: 1779.36
Cell parameters: 8.2233; 22.8182; 10.0565; 90; 109.447; 90;  

COD ID: 1553587
CIF file Formula: - C12 H11 I N2 O2 -
Comments: He, Xin; Xu, Yi-zhu; Kong, Ling-xuan; Wu, Huan-huan; Ji, De-zhong; Wang, Zhi-bin; Xu, Yun-gen; Zhu, Qi-hua Copper(i) and N-fluorobenzenesulfonimide-mediated direct regioselective halogenation of 8-amidoquinolines on the C5 position Organic Chemistry Frontiers 4(6) (2017) 1046
Space group: C m c e
Cell volume: 2441.2
Cell parameters: 6.9379; 19.798; 17.773; 90; 90; 90;  

COD ID: 1553588
CIF file Formula: - C46 H66 Cl2 -
Comments: Prenzel, Dominik; Kirschbaum, Rolf W.; Chalifoux, Wesley A.; McDonald, Robert; Ferguson, Michael J.; Drewello, Thomas; Tykwinski, Rik R. Polymerization of acetylene: polyynes, but not carbyne Organic Chemistry Frontiers 4(5) (2017) 668
Space group: P 1 21/n 1
Cell volume: 4366
Cell parameters: 10.4263; 10.2668; 40.789; 90; 90.6212; 90;  

COD ID: 1553589
CIF file Formula: - C47 H64 -
Comments: Prenzel, Dominik; Kirschbaum, Rolf W.; Chalifoux, Wesley A.; McDonald, Robert; Ferguson, Michael J.; Drewello, Thomas; Tykwinski, Rik R. Polymerization of acetylene: polyynes, but not carbyne Organic Chemistry Frontiers 4(5) (2017) 668
Space group: P -1
Cell volume: 2038.2
Cell parameters: 10.3367; 10.4631; 19.275; 88.5549; 78.0127; 88.5903;  

COD ID: 1553590
CIF file Formula: - C49 H64 -
Comments: Prenzel, Dominik; Kirschbaum, Rolf W.; Chalifoux, Wesley A.; McDonald, Robert; Ferguson, Michael J.; Drewello, Thomas; Tykwinski, Rik R. Polymerization of acetylene: polyynes, but not carbyne Organic Chemistry Frontiers 4(5) (2017) 668
Space group: P 3 1 c
Cell volume: 2103.3
Cell parameters: 14.154; 14.154; 12.123; 90; 90; 120;  

COD ID: 1553591
CIF file Formula: - C20 H13 F7 N2 O -
Comments: Xu, Jun; Qiao, Li; Ying, Beibei; Zhu, Xiaolei; Shen, Chao; Zhang, Pengfei Transition-metal-free direct perfluoroalkylation of quinoline amides at C5 position through radical cross-coupling under mild conditions Organic Chemistry Frontiers 4(6) (2017) 1116
Space group: P 1 21/c 1
Cell volume: 1881.8
Cell parameters: 7.858; 26.656; 8.984; 90; 90.001; 90;  

COD ID: 1553592
CIF file Formula: - C44 H58 N2 Se2 Si4 -
Comments: Xiong, Xiaodong; Deng, Chun-Lin; Li, Zhiming; Peng, Xiao-Shui; Wong, Henry N. C. Quasi-planar diazadithio and diazodiseleno[8]circulenes: synthesis, structures and properties Organic Chemistry Frontiers 4(5) (2017) 682
Space group: P 1 21/n 1
Cell volume: 4533.33
Cell parameters: 14.2771; 14.228; 22.6224; 90; 99.427; 90;  

COD ID: 1553593
CIF file Formula: - C44 H58 N2 S2 Si4 -
Comments: Xiong, Xiaodong; Deng, Chun-Lin; Li, Zhiming; Peng, Xiao-Shui; Wong, Henry N. C. Quasi-planar diazadithio and diazodiseleno[8]circulenes: synthesis, structures and properties Organic Chemistry Frontiers 4(5) (2017) 682
Space group: P 1 21/n 1
Cell volume: 4472.7
Cell parameters: 14.2494; 14.1245; 22.4876; 90; 98.8; 90;  

COD ID: 1553594
CIF file Formula: - C32 H22 Br8 N2 -
Comments: Xiong, Xiaodong; Deng, Chun-Lin; Li, Zhiming; Peng, Xiao-Shui; Wong, Henry N. C. Quasi-planar diazadithio and diazodiseleno[8]circulenes: synthesis, structures and properties Organic Chemistry Frontiers 4(5) (2017) 682
Space group: P -1
Cell volume: 1628.82
Cell parameters: 10.8503; 12.4427; 12.9897; 100.306; 91.28; 108.652;  

COD ID: 1553595
CIF file Formula: - C50 H52 N14 O4 -
Comments: Zhang, Qian; Wang, Mei-Xiang Synthesis of hydroxylated azacalix[1]arene[3]pyridines from hydrolysis of high valent arylcopper complexes and conversion to a double azacalix[1]arene[3]pyridine host molecule Organic Chemistry Frontiers 4(2) (2017) 283
Space group: P 1 21/c 1
Cell volume: 5365.2
Cell parameters: 9.842; 21.609; 25.234; 90; 91.32; 90;  

COD ID: 1553596
CIF file Formula: - C54.83 H62.12 Cl1.76 N16.83 O2 -
Comments: Zhang, Qian; Wang, Mei-Xiang Synthesis of hydroxylated azacalix[1]arene[3]pyridines from hydrolysis of high valent arylcopper complexes and conversion to a double azacalix[1]arene[3]pyridine host molecule Organic Chemistry Frontiers 4(2) (2017) 283
Space group: C 1 2/c 1
Cell volume: 5219.2
Cell parameters: 28.402; 9.816; 18.722; 90; 90.7; 90;  

COD ID: 1553597
CIF file Formula: - C54 H60 N16 O2 -
Comments: Zhang, Qian; Wang, Mei-Xiang Synthesis of hydroxylated azacalix[1]arene[3]pyridines from hydrolysis of high valent arylcopper complexes and conversion to a double azacalix[1]arene[3]pyridine host molecule Organic Chemistry Frontiers 4(2) (2017) 283
Space group: P -1
Cell volume: 2475.53
Cell parameters: 9.6636; 15.1098; 18.1939; 69.768; 84.466; 84.513;  

COD ID: 1553598
CIF file Formula: - C40 H24 S2 -
Comments: Lo, Yuan-Chih; Ting, Hao-Chun; Li, Ya-Ze; Li, Yi-Hua; Liu, Shun-Wei; Huang, Kuo-Wei; Wong, Ken-Tsung The synthesis, structure, and properties of 5,6,11,12-tetraarylindeno[1,2-b]fluorenes and their applications as donors for organic photovoltaic devices Organic Chemistry Frontiers 4(5) (2017) 675
Space group: P -1
Cell volume: 697.78
Cell parameters: 7.5051; 8.6296; 11.6509; 73.729; 77.669; 77.532;  

COD ID: 1553599
CIF file Formula: - C46 H32 -
Comments: Lo, Yuan-Chih; Ting, Hao-Chun; Li, Ya-Ze; Li, Yi-Hua; Liu, Shun-Wei; Huang, Kuo-Wei; Wong, Ken-Tsung The synthesis, structure, and properties of 5,6,11,12-tetraarylindeno[1,2-b]fluorenes and their applications as donors for organic photovoltaic devices Organic Chemistry Frontiers 4(5) (2017) 675
Space group: P n a 21
Cell volume: 3129.94
Cell parameters: 16.8864; 7.4906; 24.7447; 90; 90; 90;  

COD ID: 1553600
CIF file Formula: - C44 H28 -
Comments: Lo, Yuan-Chih; Ting, Hao-Chun; Li, Ya-Ze; Li, Yi-Hua; Liu, Shun-Wei; Huang, Kuo-Wei; Wong, Ken-Tsung The synthesis, structure, and properties of 5,6,11,12-tetraarylindeno[1,2-b]fluorenes and their applications as donors for organic photovoltaic devices Organic Chemistry Frontiers 4(5) (2017) 675
Space group: P -1
Cell volume: 715.94
Cell parameters: 7.597; 8.9994; 11.0344; 78.931; 75.805; 83.409;  

COD ID: 1553601
CIF file Formula: - C26 H22 N4 O5 S -
Comments: Chen, Dianpeng; Xing, Gangdong; Yao, Jinzhong; Zhou, Hongwei Applicable β-sulfonium carbanions: facile construction of thiophene derivatives Organic Chemistry Frontiers 4(6) (2017) 1042
Space group: C 1 2/c 1
Cell volume: 4951.7
Cell parameters: 26.478; 8.1615; 23.0582; 90; 96.411; 90;  

COD ID: 1553602
CIF file Formula: - C12 H9 N O S3 -
Comments: Chen, Qiao; Lei, Yingjie; Wang, Yanfang; Wang, Chao; Wang, Yanan; Xu, Zhaoqing; Wang, Huan; Wang, Rui Direct thiocyanation of ketene dithioacetals under transition-metal-free conditions Organic Chemistry Frontiers 4(3) (2017) 369
Space group: P b c n
Cell volume: 2540.92
Cell parameters: 7.9629; 16.9905; 18.7808; 90; 90; 90;  

COD ID: 1553603
CIF file Formula: - C71 H46 B F24 Ir N O P -
Comments: Wang, Qian; Zhang, Zongpeng; Chen, Caiyou; Yang, Hailong; Han, Zhengyu; Dong, Xiu-Qin; Zhang, Xumu Iridium catalysts with modular axial-unfixed biphenyl phosphine‒oxazoline ligands: asymmetric hydrogenation of α,β-unsaturated carboxylic acids Organic Chemistry Frontiers 4(4) (2017) 627
Space group: P 21 21 21
Cell volume: 6848
Cell parameters: 12.2302; 15.3106; 36.571; 90; 90; 90;  

COD ID: 1553604
CIF file Formula: - C26 H16 Cu N4 O8 -
Comments: Baur, Andreas; Bustin, Katelyn A.; Aguilera, Ellen; Petersen, Jeffrey L.; Hoover, Jessica M. Copper and silver benzoate and aryl complexes and their implications for oxidative decarboxylative coupling reactions Organic Chemistry Frontiers 4(4) (2017) 519
Space group: P 1 21/c 1
Cell volume: 2275.19
Cell parameters: 11.1134; 21.1702; 9.8578; 90; 101.189; 90;  

COD ID: 1553605
CIF file Formula: - C16 H11 N O3 -
Comments: Fang, Xinxin; Gao, Shang; Wu, Zijun; Yao, Hequan; Lin, Aijun Pd(ii)-Catalyzed oxidative dearomatization of indoles: substrate-controlled synthesis of indolines and indolones Organic Chemistry Frontiers 4(2) (2017) 292
Space group: P 1 21/c 1
Cell volume: 1297.3
Cell parameters: 8.269; 9.296; 16.904; 90; 93.281; 90;  

COD ID: 1553606
CIF file Formula: - C22 H15 N O2 -
Comments: Fang, Xinxin; Gao, Shang; Wu, Zijun; Yao, Hequan; Lin, Aijun Pd(ii)-Catalyzed oxidative dearomatization of indoles: substrate-controlled synthesis of indolines and indolones Organic Chemistry Frontiers 4(2) (2017) 292
Space group: P b c a
Cell volume: 3317
Cell parameters: 8.874; 13.733; 27.215; 90; 90; 90;  

COD ID: 1553607
CIF file Formula: - C19 H12 N2 O4 -
Comments: Li, Yingying; Gao, Mingchun; Liu, Bingxin; Xu, Bin Copper nitrate-mediated chemo- and regioselective annulation from two different alkynes: a direct route to isoxazoles Organic Chemistry Frontiers 4(3) (2017) 445
Space group: P -1
Cell volume: 778
Cell parameters: 8.066; 8.242; 12.157; 92.727; 102.604; 98.233;  

COD ID: 1553608
CIF file Formula: - C26 H31 F2 N O3 -
Comments: Xu, Jian; Song, Qiuling Synthesis of fully-substituted 1,2,3-triazoles via copper(i)-catalyzed three-component coupling of sulfoximines, alkynes and azides Organic Chemistry Frontiers 4(6) (2017) 938
Space group: P -1
Cell volume: 1213.5
Cell parameters: 9.4574; 9.9936; 14.0156; 89.023; 76.071; 71.074;  

COD ID: 1553609
CIF file Formula: - C41 H40 O11 -
Comments: Lu, Kui; Yang, Ke; Jia, Xiaoliang; Gao, Xing; Zhao, Xia; Pan, Guojun; Ma, Yantao; Huang, Qiyao; Yu, Peng Total synthesis of I3,II8-biapigenin and ridiculuflavone A Organic Chemistry Frontiers 4(4) (2017) 578
Space group: P -1
Cell volume: 1996.5
Cell parameters: 9.7469; 13.1171; 17.5212; 70.806; 75.292; 73.524;  

COD ID: 1553610
CIF file Formula: - C43 H46 O11 -
Comments: Lu, Kui; Yang, Ke; Jia, Xiaoliang; Gao, Xing; Zhao, Xia; Pan, Guojun; Ma, Yantao; Huang, Qiyao; Yu, Peng Total synthesis of I3,II8-biapigenin and ridiculuflavone A Organic Chemistry Frontiers 4(4) (2017) 578
Space group: P -1
Cell volume: 3832
Cell parameters: 15.1534; 15.8118; 17.7296; 68.774; 76.898; 79.352;  

COD ID: 1553611
CIF file Formula: - C31 H23 Cl0 N O4 -
Comments: Xu, Junyu; Cao, Jing; Fang, Chao; Lu, Tao; Du, Ding Organocatalytic C‒C bond activation of cyclopropenones for ring-opening formal [3 + 2] cycloaddition with isatins Organic Chemistry Frontiers 4(4) (2017) 560
Space group: P 21 21 21
Cell volume: 2467.2
Cell parameters: 9.9046; 10.4946; 23.736; 90; 90; 90;  

COD ID: 1553612
CIF file Formula: - C30 H21 N O3 -
Comments: Xu, Junyu; Cao, Jing; Fang, Chao; Lu, Tao; Du, Ding Organocatalytic C–C bond activation of cyclopropenones for ring-opening formal [3 + 2] cycloaddition with isatins Organic Chemistry Frontiers 4(4) (2017) 560
Space group: P 1 21/n 1
Cell volume: 2313.9
Cell parameters: 9.263; 16.211; 15.413; 90; 91.21; 90;  

COD ID: 1553613
CIF file Formula: - C38.5 H33 Cl O3 -
Comments: Zhang, Yuexia; Wu, Xingxing; Hao, Lin; Wong, Zeng Rong; Lauw, Sherman J. L.; Yang, Song; Webster, Richard D.; Chi, Yonggui Robin Trimerization of enones under air enabled by NHC/NaOtBu via a SET radical pathway Organic Chemistry Frontiers 4(3) (2017) 467
Space group: P -1
Cell volume: 3037.8
Cell parameters: 12.3342; 12.422; 20.4886; 94.35; 97.642; 100.981;  

COD ID: 1553614
CIF file Formula: - C13 H12 N2 O -
Comments: Guo, Wei-Si; Wang, Yuan-Chao; Dou, Qian; Wen, Li-Rong; Li, Ming A copper-catalyzed arylation/nucleophilic addition/fragmentation/C–S bond formation cascade: synthesis of bis(arylthio)imines Organic Chemistry Frontiers 4(4) (2017) 510
Space group: P n a 21
Cell volume: 1109.2
Cell parameters: 9.077; 10.4; 11.75; 90; 90; 90;  

COD ID: 1553615
CIF file Formula: - C23 H19 N O2 S2 -
Comments: Guo, Wei-Si; Wang, Yuan-Chao; Dou, Qian; Wen, Li-Rong; Li, Ming A copper-catalyzed arylation/nucleophilic addition/fragmentation/C–S bond formation cascade: synthesis of bis(arylthio)imines Organic Chemistry Frontiers 4(4) (2017) 510
Space group: P 21 21 21
Cell volume: 2108.8
Cell parameters: 8.189; 14.782; 17.421; 90; 90; 90;  

COD ID: 1553616
CIF file Formula: - C22 H24 S4 Si2 -
Comments: Li, Lu; Li, Bingbing; Li, Chunli; Ma, Zhiying; Xu, Li; Wang, Hua Selective deprotonation of tetra[3,4]thienylene in the presence of n-BuLi Organic Chemistry Frontiers 4(6) (2017) 1019
Space group: P 1 21/c 1
Cell volume: 2433.3
Cell parameters: 10.5479; 16.6; 13.9079; 90; 92.242; 90;  

COD ID: 1553617
CIF file Formula: - C44 H72 Li4 O4 S4 Si4 -
Comments: Li, Lu; Li, Bingbing; Li, Chunli; Ma, Zhiying; Xu, Li; Wang, Hua Selective deprotonation of tetra[3,4]thienylene in the presence of n-BuLi Organic Chemistry Frontiers 4(6) (2017) 1019
Space group: I 41/a :2
Cell volume: 5929.6
Cell parameters: 20.763; 20.763; 13.7545; 90; 90; 90;  

COD ID: 1553618
CIF file Formula: - C17 H17 N O4 -
Comments: Chen, Hui; Lin, Cong; Xiong, Chunhua; Liu, Zhanxiang; Zhang, Yuhong One-pot synthesis of fluorescent 2,4-dialkenylindoles by rhodium-catalyzed dual C–H functionalization Organic Chemistry Frontiers 4(3) (2017) 455
Space group: P -1
Cell volume: 739.28
Cell parameters: 5.7832; 10.4921; 12.3215; 90.576; 97.913; 93.157;  

COD ID: 1553619
CIF file Formula: - C21 H17 F O -
Comments: Cao, Tongxiang; Chen, Kai; Zhu, Shifa An efficient approach to generate aryl carbenes: gold-catalyzed sequential activation of 1,6-diynes Organic Chemistry Frontiers 4(3) (2017) 450
Space group: P 1 21/c 1
Cell volume: 1592.8
Cell parameters: 13.585; 12.569; 9.741; 90; 106.741; 90;  

COD ID: 1553620
CIF file Formula: - C23 H26 O -
Comments: Cao, Tongxiang; Chen, Kai; Zhu, Shifa An efficient approach to generate aryl carbenes: gold-catalyzed sequential activation of 1,6-diynes Organic Chemistry Frontiers 4(3) (2017) 450
Space group: P 1 21/c 1
Cell volume: 1721.3
Cell parameters: 12.3103; 20.299; 6.9248; 90; 95.884; 90;  

COD ID: 1553621
CIF file Formula: - C60 H28 F20 N6 O2 -
Comments: Almeida, José; Aguiar, António; Leite, Andreia; Silva, André M. N.; Cunha-Silva, Luís; de Castro, Baltazar; Rangel, Maria; Barone, Giampaolo; Tomé, Augusto C.; Silva, Ana M. G. 1,3-Dipolar cycloadditions with meso-tetraarylchlorins ‒ site selectivity and mixed bisadducts Organic Chemistry Frontiers 4(4) (2017) 534
Space group: P -1
Cell volume: 2560.5
Cell parameters: 12.4994; 13.1859; 16.0253; 102.651; 95.439; 92.29;  

COD ID: 1553622
CIF file Formula: - C23 H30 N4 O2 Si -
Comments: Morozova, Maria A.; Yusubov, Mekhman S.; Kratochvil, Bohumil; Eigner, Václav; Bondarev, Alexander A.; Yoshimura, Akira; Saito, Akio; Zhdankin, Viktor V.; Trusova, Marina E.; Postnikov, Pavel S. Regioselective Zn(OAc)2-catalyzed azide–alkyne cycloaddition in water: the green click-chemistry Organic Chemistry Frontiers 4(6) (2017) 978
Space group: P b c a
Cell volume: 4793.9
Cell parameters: 15.6516; 14.7041; 20.8303; 90; 90; 90;  

COD ID: 1553623
CIF file Formula: - C20 H21 N5 O2 Si -
Comments: Morozova, Maria A.; Yusubov, Mekhman S.; Kratochvil, Bohumil; Eigner, Václav; Bondarev, Alexander A.; Yoshimura, Akira; Saito, Akio; Zhdankin, Viktor V.; Trusova, Marina E.; Postnikov, Pavel S. Regioselective Zn(OAc)2-catalyzed azide–alkyne cycloaddition in water: the green click-chemistry Organic Chemistry Frontiers 4(6) (2017) 978
Space group: P -1
Cell volume: 1138.27
Cell parameters: 9.4684; 10.4692; 12.771; 96.2634; 95.7478; 113.644;  

COD ID: 1553624
CIF file Formula: - C14 H8 Br3 N3 -
Comments: Morozova, Maria A.; Yusubov, Mekhman S.; Kratochvil, Bohumil; Eigner, Václav; Bondarev, Alexander A.; Yoshimura, Akira; Saito, Akio; Zhdankin, Viktor V.; Trusova, Marina E.; Postnikov, Pavel S. Regioselective Zn(OAc)2-catalyzed azide–alkyne cycloaddition in water: the green click-chemistry Organic Chemistry Frontiers 4(6) (2017) 978
Space group: P 1 21/n 1
Cell volume: 2997.7
Cell parameters: 16.2913; 10.0932; 19.7897; 90; 112.895; 90;  

COD ID: 1553625
CIF file Formula: - C21 H34 N4 O2 Si -
Comments: Morozova, Maria A.; Yusubov, Mekhman S.; Kratochvil, Bohumil; Eigner, Václav; Bondarev, Alexander A.; Yoshimura, Akira; Saito, Akio; Zhdankin, Viktor V.; Trusova, Marina E.; Postnikov, Pavel S. Regioselective Zn(OAc)2-catalyzed azide–alkyne cycloaddition in water: the green click-chemistry Organic Chemistry Frontiers 4(6) (2017) 978
Space group: P b c a
Cell volume: 4641.9
Cell parameters: 8.9462; 11.9145; 43.549; 90; 90; 90;  

COD ID: 1553626
CIF file Formula: - C25 H20 O4 -
Comments: Mao, Wenbin; Zhu, Chen Efficient synthesis of multiply substituted butenolides from keto acids and terminal alkynes promoted by combined acids Organic Chemistry Frontiers 4(6) (2017) 1029
Space group: P 1 21/c 1
Cell volume: 1960.46
Cell parameters: 11.9761; 15.4866; 11.0055; 90; 106.167; 90;  

COD ID: 1553627
CIF file Formula: - C35 H18 Fe O4 -
Comments: Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers 4(5) (2017) 699
Space group: P -1
Cell volume: 1267.66
Cell parameters: 8.8576; 9.515; 15.8743; 79.571; 74.479; 86.413;  

COD ID: 1553628
CIF file Formula: - C32 H18 O -
Comments: Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers 4(5) (2017) 699
Space group: P 1 21/n 1
Cell volume: 2089.3
Cell parameters: 12.737; 10.827; 15.738; 90; 105.708; 90;  

COD ID: 1553629
CIF file Formula: - C51 H29 Cl3 O4 -
Comments: Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers 4(5) (2017) 699
Space group: P 21 21 21
Cell volume: 3773.3
Cell parameters: 10.5417; 14.8356; 24.1274; 90; 90; 90;  

COD ID: 1553630
CIF file Formula: - C51 H30 Cl2 O -
Comments: Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers 4(5) (2017) 699
Space group: P 1 21/n 1
Cell volume: 3677.21
Cell parameters: 12.3541; 20.5251; 15.593; 90; 111.562; 90;  

COD ID: 1553631
CIF file Formula: - C51 H30 Cl2 -
Comments: Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers 4(5) (2017) 699
Space group: P 1 21/n 1
Cell volume: 3622.59
Cell parameters: 12.2233; 20.4397; 15.612; 90; 111.759; 90;  

COD ID: 1553632
CIF file Formula: - C20 H19 Br N2 O5 S -
Comments: Yu, Lu; Cheng, Yuyu; Qi, Fei; Li, Rou; Li, Pengfei Organocatalytic regioselective, diastereoselective, and enantioselective annulation of cyclic 1-azadienes with γ-nitro ketones via 3,4-cyclization Organic Chemistry Frontiers 4(7) (2017) 1336
Space group: P 21 21 21
Cell volume: 2054.3
Cell parameters: 8.8208; 12.857; 18.1141; 90; 90; 90;  

COD ID: 1553633
CIF file Formula: - C29 H25 N3 -
Comments: Zhao, Fen; Liu, Yaowen; Yang, Shu; Xie, Kai; Jiang, Yubo Pd-catalyzed selective N(3)-ortho C–H arylation of 1,4-disubstituted 1,2,3-triazoles Organic Chemistry Frontiers 4(6) (2017) 1112
Space group: P -1
Cell volume: 1151.8
Cell parameters: 5.768; 9.924; 20.463; 100.063; 91.086; 92.46;  

COD ID: 1553634
CIF file Formula: - C21 H15 Br2 N O2 -
Comments: Qiu, Guanyinsheng; Li, Yuewen; Ma, Lele; Zhou, Hongwei KBr/K2S2O8-mediated dibromohydration of N-(2-alkynylaryl)acetamide Organic Chemistry Frontiers 4(6) (2017) 1069
Space group: P 1 21/n 1
Cell volume: 1813.2
Cell parameters: 16.003; 7.036; 16.456; 90; 101.876; 90;  

COD ID: 1553635
CIF file Formula: - C33 H31 N O3 -
Comments: Liu, Feng; Tian, Jiaxin; Liu, Yong; Tao, Chuangan; Zhu, Hao; Zhang, Aina; Xu, Dongfang; Zhao, Baoguo Decarboxylative Umpolung of conjugated enals to β-carbanions for intramolecular nucleophilic addition to an aldehyde Organic Chemistry Frontiers 4(8) (2017) 1586
Space group: P 1 21/n 1
Cell volume: 2636
Cell parameters: 15.552; 9.109; 20; 90; 111.508; 90;  

COD ID: 1553636
CIF file Formula: - C25 H20 N2 O2 S -
Comments: Lin, Ye; Liu, Lei; Du, Da-Ming Squaramide-catalyzed asymmetric Michael/cyclization cascade reaction of 3-isothiocyanato oxindoles with chalcones for synthesis of pyrrolidinyl spirooxindoles Organic Chemistry Frontiers 4(7) (2017) 1229
Space group: P 21 21 21
Cell volume: 2072
Cell parameters: 7.7445; 13.971; 19.15; 90; 90; 90;  

COD ID: 1553637
CIF file Formula: - C16 H21 N3 O5 -
Comments: Deng, Tao; Thota, Ganesh Kumar; Li, Yi; Kang, Qiang Enantioselective conjugate addition of hydroxylamines to α,β-unsaturated 2-acyl imidazoles catalyzed by a chiral-at-metal Rh(iii) complex Organic Chemistry Frontiers 4(4) (2017) 573
Space group: P 21 21 21
Cell volume: 3441.7
Cell parameters: 8.4855; 15.887; 25.5299; 90; 90; 90;  

COD ID: 1553638
CIF file Formula: - C36 H40 N2 O4 -
Comments: Purc, Anna; Koszarna, Beata; Iachina, Irina; Friese, Daniel H.; Tasior, Mariusz; Sobczyk, Krzysztof; Pędziński, Tomasz; Brewer, Jonathan; Gryko, Daniel T. The impact of interplay between electronic and steric effects on the synthesis and the linear and non-linear optical properties of diketopyrrolopyrrole bearing benzofuran moieties Organic Chemistry Frontiers 4(5) (2017) 724
Space group: P 1 21/c 1
Cell volume: 1592.8
Cell parameters: 11.882; 6.1567; 22.083; 90; 99.617; 90;  

COD ID: 1553639
CIF file Formula: - C32 H38 N2 O2 S3 -
Comments: Chen, Wangqiao; Nakano, Masahiro; Takimiya, Kazuo; Zhang, Qichun Selective thionation of naphtho[2,3-b]thiophene diimide: tuning of the optoelectronic properties and packing structure Organic Chemistry Frontiers 4(5) (2017) 704
Space group: P 1 21/c 1
Cell volume: 2964
Cell parameters: 20.477; 5.2589; 28.0402; 90; 101.007; 90;  

COD ID: 1553724
CIF file Formula: - C22 H23 Cl N2 O0 Ru -
Comments: Li, Gang; Lv, Xulu; Guo, Kexiao; Wang, Ya; Yang, Suling; Yu, Liuyang; Yu, Yantang; Wang, Junjie Ruthenium-catalyzed meta-selective C‒H sulfonation of azoarenes with arylsulfonyl chlorides Organic Chemistry Frontiers 4(6) (2017) 1145
Space group: P -1
Cell volume: 2060.7
Cell parameters: 10.445; 14.347; 14.407; 82.53; 85.3; 74.55;  

COD ID: 1553725
CIF file Formula: - C18 H13 Cl N2 O2 S -
Comments: Li, Gang; Lv, Xulu; Guo, Kexiao; Wang, Ya; Yang, Suling; Yu, Liuyang; Yu, Yantang; Wang, Junjie Ruthenium-catalyzed meta-selective C–H sulfonation of azoarenes with arylsulfonyl chlorides Organic Chemistry Frontiers 4(6) (2017) 1145
Space group: C 1 2/c 1
Cell volume: 3292.6
Cell parameters: 34.644; 7.0976; 13.544; 90; 98.63; 90;  

COD ID: 1553726
CIF file Formula: - C16 H15 N O7 -
Comments: Wang, Junliang; Li, Jianneng; Shen, Xianwang; Dong, Cong; Lin, Jun; Wei, Kun Asymmetric total synthesis of (−)-δ-lycorane Organic Chemistry Frontiers 4(6) (2017) 1149
Space group: P 21 21 21
Cell volume: 2866
Cell parameters: 11.4884; 11.9792; 20.8251; 90; 90; 90;  

COD ID: 1553727
CIF file Formula: - C60 H46 N4.5 -
Comments: Kimura, Yosuke; Kawajiri, Ikumi; Ueki, Masanori; Morimoto, Takayuki; Nishida, Jun-ichi; Ikeda, Hiroshi; Tanaka, Mirai; Kawase, Takeshi A new fluorophore displaying remarkable solvatofluorochromism and solid-state light emission, and serving as a turn-on fluorescent sensor for cyanide ions Organic Chemistry Frontiers 4(5) (2017) 743
Space group: P -1
Cell volume: 4517.3
Cell parameters: 13.8813; 14.4392; 23.5317; 95.8618; 105.365; 91.4814;  

COD ID: 1553728
CIF file Formula: - C11 H16 F3 N O2 S2 -
Comments: Zhang, He; Leng, Xuebing; Wan, Xiaolong; Shen, Qilong (1S)-(−)-N-Trifluoromethylthio-2,10-camphorsultam and its derivatives: easily available, optically pure reagents for asymmetric trifluoromethylthiolation Organic Chemistry Frontiers 4(6) (2017) 1051
Space group: C 1 2 1
Cell volume: 1367.5
Cell parameters: 11.5; 10.46; 11.413; 90; 95.06; 90;  

COD ID: 1553729
CIF file Formula: - C19 H10 F4 O2 S -
Comments: Zhang, He; Leng, Xuebing; Wan, Xiaolong; Shen, Qilong (1S)-(−)-N-Trifluoromethylthio-2,10-camphorsultam and its derivatives: easily available, optically pure reagents for asymmetric trifluoromethylthiolation Organic Chemistry Frontiers 4(6) (2017) 1051
Space group: P 21 21 21
Cell volume: 1674.1
Cell parameters: 6.6977; 8.1914; 30.513; 90; 90; 90;  

COD ID: 1553730
CIF file Formula: - C15 H15 F3 O5 S -
Comments: Zhang, He; Leng, Xuebing; Wan, Xiaolong; Shen, Qilong (1S)-(−)-N-Trifluoromethylthio-2,10-camphorsultam and its derivatives: easily available, optically pure reagents for asymmetric trifluoromethylthiolation Organic Chemistry Frontiers 4(6) (2017) 1051
Space group: P 21 21 21
Cell volume: 1595.6
Cell parameters: 7.5426; 13.2312; 15.9887; 90; 90; 90;  

COD ID: 1553731
CIF file Formula: - C17 H11 F3 N2 O S -
Comments: Zhang, He; Leng, Xuebing; Wan, Xiaolong; Shen, Qilong (1S)-(−)-N-Trifluoromethylthio-2,10-camphorsultam and its derivatives: easily available, optically pure reagents for asymmetric trifluoromethylthiolation Organic Chemistry Frontiers 4(6) (2017) 1051
Space group: P 21 21 21
Cell volume: 1594.1
Cell parameters: 8.5502; 11.0835; 16.8212; 90; 90; 90;  

COD ID: 1553732
CIF file Formula: - C11 H14 Cl2 F3 N O2 S2 -
Comments: Zhang, He; Leng, Xuebing; Wan, Xiaolong; Shen, Qilong (1S)-(−)-N-Trifluoromethylthio-2,10-camphorsultam and its derivatives: easily available, optically pure reagents for asymmetric trifluoromethylthiolation Organic Chemistry Frontiers 4(6) (2017) 1051
Space group: P 1 21 1
Cell volume: 749
Cell parameters: 7.7869; 10.8732; 8.8809; 90; 95.062; 90;  

COD ID: 1553733
CIF file Formula: - C13 H20 F3 N O4 S2 -
Comments: Zhang, He; Leng, Xuebing; Wan, Xiaolong; Shen, Qilong (1S)-(−)-N-Trifluoromethylthio-2,10-camphorsultam and its derivatives: easily available, optically pure reagents for asymmetric trifluoromethylthiolation Organic Chemistry Frontiers 4(6) (2017) 1051
Space group: P 1 21 1
Cell volume: 1594.5
Cell parameters: 12.4266; 8.8229; 15.107; 90; 105.7; 90;  

COD ID: 1553734
CIF file Formula: - C101 H110 N4 Ni P Pt0.5 -
Comments: Fukui, Norihito; Jiang, Hua-Wei; Osuka, Atsuhiro meso-to-meso PtII-bridged NiII-porphyrin dimers Organic Chemistry Frontiers 4(5) (2017) 767
Space group: P -1
Cell volume: 4317.2
Cell parameters: 15.566; 15.831; 17.7553; 80.813; 89.907; 88.251;  

COD ID: 1553735
CIF file Formula: - C162 H174 Cl10 N8 Ni2 Pt -
Comments: Fukui, Norihito; Jiang, Hua-Wei; Osuka, Atsuhiro meso-to-meso PtII-bridged NiII-porphyrin dimers Organic Chemistry Frontiers 4(5) (2017) 767
Space group: P -1
Cell volume: 7365
Cell parameters: 16.142; 21.227; 22.446; 106.1; 92.132; 93.364;  

COD ID: 1553736
CIF file Formula: - C76 H38 Br N O8 -
Comments: Xu, Dan; Li, Yanbang; Lou, Ning; Gan, Liangbing Synthesis of homoazafullerene [C59N(CH2)]R and azahomoazafullerene [C59N(NH)]R Organic Chemistry Frontiers 4(5) (2017) 750
Space group: P 1 21/n 1
Cell volume: 5293.4
Cell parameters: 13.8397; 24.2642; 16.7166; 90; 109.444; 90;  

COD ID: 1553737
CIF file Formula: - C76 H39 N O9 -
Comments: Xu, Dan; Li, Yanbang; Lou, Ning; Gan, Liangbing Synthesis of homoazafullerene [C59N(CH2)]R and azahomoazafullerene [C59N(NH)]R Organic Chemistry Frontiers 4(5) (2017) 750
Space group: P n a 21
Cell volume: 4859.2
Cell parameters: 21.489; 10.179; 22.215; 90; 90; 90;  

COD ID: 1553738
CIF file Formula: - C17 H13 Br N2 O4 S -
Comments: Pal, Kuntal; Volla, Chandra M. R. Rhodium-catalyzed denitrogenative transannulation of 1,2,3-triazolyl-carbamates: efficient access to 4-aminooxazolidinones Organic Chemistry Frontiers 4(7) (2017) 1380
Space group: P 1 21/c 1
Cell volume: 1767.4
Cell parameters: 17.5147; 7.024; 15.73; 90; 114.033; 90;  

COD ID: 1553741
CIF file Formula: - C19 H22 O3 -
Comments: Chang, Wenju; Dai, Jie; Li, Jingfu; Shi, Yuan; Ren, Wenlong; Shi, Yian A facile approach to ketones via Pd-catalyzed sequential carbonylation of olefins with formic acid Organic Chemistry Frontiers 4(6) (2017) 1074
Space group: C 1 2/c 1
Cell volume: 3296.3
Cell parameters: 28.543; 7.309; 16.361; 90; 105.04; 90;  

COD ID: 1553742
CIF file Formula: - C11 H8 N O2 S -
Comments: Ammon, Felix; Sauer, Stephanie Theresia; Lippert, Rainer; Lungerich, Dominik; Reger, David; Hampel, Frank; Jux, Norbert Unexpected formation of [5]helicenes from hexaarylbenzenes containing pyrrole moieties Organic Chemistry Frontiers 4(5) (2017) 861
Space group: P 1 21/c 1
Cell volume: 998.3
Cell parameters: 5.69674; 8.92923; 19.6982; 90; 94.927; 90;  

COD ID: 1553743
CIF file Formula: - C67.5 H66 Cl3 N O2 S -
Comments: Ammon, Felix; Sauer, Stephanie Theresia; Lippert, Rainer; Lungerich, Dominik; Reger, David; Hampel, Frank; Jux, Norbert Unexpected formation of [5]helicenes from hexaarylbenzenes containing pyrrole moieties Organic Chemistry Frontiers 4(5) (2017) 861
Space group: P -1
Cell volume: 2814.2
Cell parameters: 14.0225; 15.4902; 15.6494; 109.303; 105.791; 106.459;  

COD ID: 1553744
CIF file Formula: - C84 H108 Si4 -
Comments: Bettinger, Holger F.; Einholz, Ralf; Göttler, Andreas; Junge, Marc; Sättele, Marie-Sophie; Schnepf, Andreas; Schrenk, Claudio; Schundelmeier, Simon; Speiser, Bernd 6,6′,11,11′-Tetra((triisopropylsilyl)ethynyl)-anti-[2.2](1,4)tetracenophane: a covalently coupled tetracene dimer and its structural, electrochemical, and photophysical characterization Organic Chemistry Frontiers 4(5) (2017) 853
Space group: P -1
Cell volume: 1868.8
Cell parameters: 8.2685; 13.793; 17.645; 72.588; 88.716; 77.009;  

COD ID: 1553745
CIF file Formula: - C14 H14 N2 O2 S -
Comments: Wang, Bin; Xu, Tong; Zhu, Lei; Lan, Yu; Wang, Jingdong; Lu, Ning; Wei, Zhonglin; Lin, Yingjie; Duan, Haifeng Highly enantioselective nitro-Mannich reaction of ketimines under phase-transfer catalysis Organic Chemistry Frontiers 4(7) (2017) 1266
Space group: P -1
Cell volume: 672.8
Cell parameters: 6.121; 8.835; 13.265; 83.14; 79.6; 72.93;  

COD ID: 1553746
CIF file Formula: - C15 H17 N3 O4 S -
Comments: Wang, Bin; Xu, Tong; Zhu, Lei; Lan, Yu; Wang, Jingdong; Lu, Ning; Wei, Zhonglin; Lin, Yingjie; Duan, Haifeng Highly enantioselective nitro-Mannich reaction of ketimines under phase-transfer catalysis Organic Chemistry Frontiers 4(7) (2017) 1266
Space group: P 1 21 1
Cell volume: 781.2
Cell parameters: 8.6132; 7.4744; 12.867; 90; 109.429; 90;  

COD ID: 1553747
CIF file Formula: - C30 H24 -
Comments: Takai, Atsuro; Freas, Dylan J.; Suzuki, Toshikane; Sugimoto, Manabu; Labuta, Jan; Haruki, Rie; Kumai, Reiji; Adachi, Shin-ichi; Sakai, Hayato; Hasobe, Taku; Matsushita, Yoshitaka; Takeuchi, Masayuki The effect of a highly twisted CC double bond on the electronic structures of 9,9′-bifluorenylidene derivatives in the ground and excited states Organic Chemistry Frontiers 4(5) (2017) 650
Space group: C 1 c 1
Cell volume: 8024.4
Cell parameters: 21.7066; 21.7067; 20.1949; 90; 122.509; 90;  

COD ID: 1553748
CIF file Formula: - C15 H13 N O4 S2 -
Comments: Zhou, Kaida; Xia, Hongguang; Wu, Jie Generation of benzosultams via a radical process with the insertion of sulfur dioxide Organic Chemistry Frontiers 4(6) (2017) 1121
Space group: P -1
Cell volume: 713.6
Cell parameters: 7.6834; 8.0281; 12.554; 85.471; 73.42; 74.044;  

COD ID: 1553749
CIF file Formula: - C15 H13 N O4 S2 -
Comments: Zhou, Kaida; Xia, Hongguang; Wu, Jie Generation of benzosultams via a radical process with the insertion of sulfur dioxide Organic Chemistry Frontiers 4(6) (2017) 1121
Space group: P 1 21/c 1
Cell volume: 1517
Cell parameters: 8.151; 8.239; 22.94; 90; 100.06; 90;  

COD ID: 1553750
CIF file Formula: - C26 H31 N3 O6 -
Comments: Guo, Jing; Lin, Zi-Hui; Chen, Kai-Bin; Xie, Ying; Chan, Albert S. C.; Weng, Jiang; Lu, Gui Asymmetric amination of 2-substituted indolin-3-ones catalyzed by natural cinchona alkaloids Organic Chemistry Frontiers 4(7) (2017) 1400
Space group: P 1
Cell volume: 626.45
Cell parameters: 9.0047; 9.2247; 9.4826; 109.875; 108.593; 107.103;  

COD ID: 1553751
CIF file Formula: - C54 H48 O8 -
Comments: Hirao, Yasukazu; Konishi, Akihito; Kubo, Takashi Anthroxyl-based biradical: toward the construction of highly stable multi-spin systems Organic Chemistry Frontiers 4(5) (2017) 828
Space group: P -1
Cell volume: 1066.8
Cell parameters: 8.9558; 9.4432; 13.6247; 92.926; 95.287; 111;  

COD ID: 1553752
CIF file Formula: - C66 H72 O6 -
Comments: Hirao, Yasukazu; Konishi, Akihito; Kubo, Takashi Anthroxyl-based biradical: toward the construction of highly stable multi-spin systems Organic Chemistry Frontiers 4(5) (2017) 828
Space group: P 1 21/n 1
Cell volume: 2734.08
Cell parameters: 11.8673; 14.8352; 15.9367; 90; 102.976; 90;  

COD ID: 1553753
CIF file Formula: - C41 H27 O -
Comments: Ip, Ho-Wang; Chow, Hak-Fun; Kuck, Dietmar Electronic and steric effects on the three-fold Scholl-type cycloheptatriene ring formation around a tribenzotriquinacene core Organic Chemistry Frontiers 4(5) (2017) 817
Space group: C 1 2/c 1
Cell volume: 6388.6
Cell parameters: 23.6823; 14.1831; 19.4393; 90; 101.921; 90;  

COD ID: 1553754
CIF file Formula: - C18 H16 N2 O2 -
Comments: Selvaraju, Manikandan; Wang, Ying-Lien; Sun, Chung-Ming Ruthenium(ii)-catalyzed C–H alkenylation/annulation cascade for the rapid synthesis of benzoimidazoisoindoles Organic Chemistry Frontiers 4(7) (2017) 1358
Space group: P 1 21/c 1
Cell volume: 1448.78
Cell parameters: 12.4244; 8.0614; 14.7164; 90; 100.607; 90;  

COD ID: 1553755
CIF file Formula: - C7.75 H7.75 F7.75 N7.75 O7.75 S7.75 -
Comments: Pouambeka, Tony Wheellyam; Zhang, Ge; Zheng, Guang-Fan; Xu, Guo-Xing; Zhang, Qian; Xiong, Tao; Zhang, Qian Copper-catalyzed oxidative amidation of α,β-unsaturated ketones via selective C‒H or C‒C bond cleavage Organic Chemistry Frontiers 4(7) (2017) 1420
Space group: P 21 21 21
Cell volume: 2675
Cell parameters: 8.086; 14.196; 23.304; 90; 90; 90;  

COD ID: 1553756
CIF file Formula: - C27 H21 N O2 S2 -
Comments: Shi, Qing; Li, Pinhua; Zhang, Yan; Wang, Lei Visible light-induced tandem oxidative cyclization of 2-alkynylanilines with disulfides (diselenides) to 3-sulfenyl- and 3-selenylindoles under transition metal-free and photocatalyst-free conditions Organic Chemistry Frontiers 4(7) (2017) 1322
Space group: P 21 21 21
Cell volume: 2281.3
Cell parameters: 5.9608; 18.7773; 20.3817; 90; 90; 90;  

COD ID: 1553757
CIF file Formula: - C16 H12 Cl N O -
Comments: Zhang, Zhiguo; Zhang, Yongchao; Huang, Guoqing; Zhang, Guisheng Organoiodine reagent-promoted intermolecular oxidative amination: synthesis of cyclopropyl spirooxindoles Organic Chemistry Frontiers 4(7) (2017) 1372
Space group: P 1 21/c 1
Cell volume: 1326.66
Cell parameters: 9.0611; 7.1551; 20.5051; 90; 93.684; 90;  

COD ID: 1553758
CIF file Formula: - C17 H18 Br F3 N2 O6 -
Comments: Liu, Qiang; Zhao, Kun; Zhi, Ying; Raabe, Gerhard; Enders, Dieter Squaramide-catalyzed domino Michael/aza-Henry [3 + 2] cycloaddition: asymmetric synthesis of functionalized 5-trifluoromethyl and 3-nitro substituted pyrrolidines Organic Chemistry Frontiers 4(7) (2017) 1416
Space group: P 21 21 21
Cell volume: 1983.19
Cell parameters: 8.3955; 14.09; 16.7651; 90; 90; 90;  

COD ID: 1553759
CIF file Formula: - C23 H22 Br Cl2 N3 O5 -
Comments: Chen, Dong-Zhen; Xiao, Wen-Jing; Chen, Jia-Rong Synthesis of spiropyrazoline oxindoles by a formal [4 + 1] annulation reaction between 3-bromooxindoles and in situ-derived 1,2-diaza-1,3-dienes Organic Chemistry Frontiers 4(7) (2017) 1289
Space group: P 1 21/n 1
Cell volume: 2447.6
Cell parameters: 9.593; 15.307; 16.705; 90; 93.785; 90;  

COD ID: 1553760
CIF file Formula: - C20 H17 Br Cl3 N3 O3 -
Comments: Chen, Dong-Zhen; Xiao, Wen-Jing; Chen, Jia-Rong Synthesis of spiropyrazoline oxindoles by a formal [4 + 1] annulation reaction between 3-bromooxindoles and in situ-derived 1,2-diaza-1,3-dienes Organic Chemistry Frontiers 4(7) (2017) 1289
Space group: P -1
Cell volume: 1078
Cell parameters: 6.299; 11.774; 14.904; 99.608; 94.163; 96.363;  

COD ID: 1553761
CIF file Formula: - C17 H16 O -
Comments: Zhang, Bo-Sheng; Hua, Hui-Liang; Gao, Lu-Yao; Liu, Ce; Qiu, Yi-Feng; Zhou, Ping-Xin; Zhou, Zhao-Zhao; Zhao, Jia-Hui; Liang, Yong-Min Palladium-catalyzed arene C–H activation/ketone C–H functionalization reaction: route to spirodihydroindenones Organic Chemistry Frontiers 4(7) (2017) 1376
Space group: P 21 21 21
Cell volume: 1270.79
Cell parameters: 7.738; 11.656; 14.0895; 90; 90; 90;  

COD ID: 1553762
CIF file Formula: - C24 H19 N O2 S -
Comments: Zhang, Pengbo; Gao, Yuzhen; Chen, Su; Tang, Guo; Zhao, Yufen Direct synthesis of 2-sulfonated 9H-pyrrolo[1,2-a]indoles via NaI-catalyzed cascade radical addition/cyclization/isomerization Organic Chemistry Frontiers 4(7) (2017) 1350
Space group: C 1 2/c 1
Cell volume: 3760.9
Cell parameters: 16.382; 18.322; 14.538; 90; 120.472; 90;  

COD ID: 1553763
CIF file Formula: - C14 H12 N2 O3 -
Comments: Hong, Longcheng; Ahles, Sebastian; Strauss, Marcel A.; Logemann, Christian; Wegner, Hermann A. Synthesis of 2,3-diaza-anthraquinones via the bidentate Lewis acid catalysed inverse electron-demand Diels–Alder (IEDDA) reaction Organic Chemistry Frontiers 4(5) (2017) 871
Space group: P -1
Cell volume: 577.75
Cell parameters: 7.1026; 7.8866; 11.4159; 92.777; 92.263; 114.968;  

COD ID: 1553764
CIF file Formula: - C25 H22 F I2 N O2 S -
Comments: Wang, Qiang; Jiang, Bo; Yu, Liu-Zhu; Wei, Yin; Shi, Min Iron-catalyzed or iodine-induced intramolecular halocyclization of N-vinyl-tethered methylenecyclopropanes: facile access to halogenated 1,2-dihydroquinolines Organic Chemistry Frontiers 4(7) (2017) 1294
Space group: P -1
Cell volume: 1233.4
Cell parameters: 8.7048; 10.5461; 13.9946; 82.33; 79.359; 79.1;  

COD ID: 1553765
CIF file Formula: - C25 H24 Cl N O2 S -
Comments: Wang, Qiang; Jiang, Bo; Yu, Liu-Zhu; Wei, Yin; Shi, Min Iron-catalyzed or iodine-induced intramolecular halocyclization of N-vinyl-tethered methylenecyclopropanes: facile access to halogenated 1,2-dihydroquinolines Organic Chemistry Frontiers 4(7) (2017) 1294
Space group: P 1 21/c 1
Cell volume: 4434
Cell parameters: 13.2671; 18.296; 19.283; 90; 108.684; 90;  

COD ID: 1553766
CIF file Formula: - C18 H17 N S3 -
Comments: Schneeweis, Arno; Neidlinger, Andreas; Reiss, Guido J.; Frank, Walter; Heinze, Katja; Müller, Thomas J. J. Radical cation and dication of a 4H-dithieno[2,3-b:3′,2′-e][1,4]-thiazine Organic Chemistry Frontiers 4(5) (2017) 839
Space group: P -1
Cell volume: 1690.6
Cell parameters: 12.112; 13.064; 13.586; 113.51; 114.37; 96.715;  

COD ID: 1553767
CIF file Formula: - C26 H20 F3 N O -
Comments: An, Yuanyuan; Zhang, Jun; Xia, Hongguang; Wu, Jie Radical cyclization of benzene-tethered 1,7-enynes with aryldiazonium tetrafluoroborates: a facile route to benzo[j]phenanthridines Organic Chemistry Frontiers 4(7) (2017) 1318
Space group: P -1
Cell volume: 1010.5
Cell parameters: 9.3089; 10.692; 10.826; 98.78; 90.325; 108.111;  

COD ID: 1553768
CIF file Formula: - C22 H26 F2 N2 O2 -
Comments: Liu, Kai; Sui, Lin-Chao; Jin, Qiao; Li, Deng-Yuan; Liu, Pei-Nian CuBr-mediated radical cascade difluoroacetamidation of acrylamides using α,α-difluoro-α-(TMS)-acetamides Organic Chemistry Frontiers 4(8) (2017) 1606
Space group: P 1 21/c 1
Cell volume: 2001.9
Cell parameters: 8.7598; 25.852; 8.8958; 90; 96.431; 90;  

COD ID: 1553769
CIF file Formula: - C16 H11 F N2 O -
Comments: Ding, Junshuai; Zhang, Yingchao; Li, Jizhen Nickel-catalyzed selective C-5 fluorination of 8-aminoquinolines with NFSI Organic Chemistry Frontiers 4(8) (2017) 1528
Space group: P 1 21/c 1
Cell volume: 1250.7
Cell parameters: 21.229; 3.919; 15.628; 90; 105.861; 90;  

COD ID: 1553770
CIF file Formula: - C20 H12 Cl3 N O0 -
Comments: Li, Jianxiao; An, Yanni; Li, Jiawei; Yang, Shaorong; Wu, Wanqing; Jiang, Huanfeng Palladium-catalyzed C‒S bond activation and functionalization of 3-sulfenylindoles and related electron-rich heteroarenes Organic Chemistry Frontiers 4(8) (2017) 1590
Space group: P 1 21/n 1
Cell volume: 1654.94
Cell parameters: 11.93574; 7.18231; 19.3705; 90; 94.7142; 90;  

COD ID: 1553771
CIF file Formula: - C34 H52 Cl4 N16 O2 -
Comments: Liang, Dong-Dong; Wang, Mei-Xiang Synthesis and conformational structure of hydrazo-bridged homo calix[2]pyridine[2]triazines Organic Chemistry Frontiers 4(7) (2017) 1425
Space group: P -1
Cell volume: 2152
Cell parameters: 9.8942; 11.644; 20.487; 87.078; 78.302; 68.651;  

COD ID: 1553772
CIF file Formula: - C5.33 H10 Cl0.67 Co0.33 N2.67 O4 -
Comments: Liang, Dong-Dong; Wang, Mei-Xiang Synthesis and conformational structure of hydrazo-bridged homo calix[2]pyridine[2]triazines Organic Chemistry Frontiers 4(7) (2017) 1425
Space group: P 1 21/c 1
Cell volume: 2688.09
Cell parameters: 11.9766; 19.3355; 12.7804; 90; 114.734; 90;  

COD ID: 1553773
CIF file Formula: - C27 H41 N16 O3.5 S1.5 -
Comments: Liang, Dong-Dong; Wang, Mei-Xiang Synthesis and conformational structure of hydrazo-bridged homo calix[2]pyridine[2]triazines Organic Chemistry Frontiers 4(7) (2017) 1425
Space group: P -1
Cell volume: 4854
Cell parameters: 13.18; 19.895; 20.59; 108.27; 107.63; 90.48;  

COD ID: 1553774
CIF file Formula: - C20 H23 B F2 N2 O2 -
Comments: Kubota, Yasuhiro; Tsukamoto, Masahiro; Ohnishi, Katsuhiro; Jin, Jiye; Funabiki, Kazumasa; Matsui, Masaki Synthesis and fluorescence properties of novel squarylium–boron complexes Organic Chemistry Frontiers 4(8) (2017) 1522
Space group: P -1
Cell volume: 987.6
Cell parameters: 9.003; 10.762; 11.631; 73.19; 69.99; 72.45;  

COD ID: 1553775
CIF file Formula: - C21 H17 Cl F3 N3 -
Comments: Xie, En; Rahman, Abdul; Lin, Xufeng Asymmetric synthesis of CF3- and indole-containing tetrahydro-β-carbolines via chiral spirocyclic phosphoric acid-catalyzed aza-Friedel–Crafts reaction Organic Chemistry Frontiers 4(7) (2017) 1407
Space group: P 1 21 1
Cell volume: 933
Cell parameters: 8.6045; 11.4959; 10.3691; 90; 114.544; 90;  

COD ID: 1553776
CIF file Formula: - C22 H17 I N2 -
Comments: Liu, Cheng-Kou; Yang, Zhao; Zeng, Yu; Guo, Kai; Fang, Zheng; Li, Bo Sodium nitrite-promoted aerobic oxidative coupling of aryl methyl ketones with ammonium under metal-free conditions: a facile access to polysubstitution imidazoles Organic Chemistry Frontiers 4(8) (2017) 1508
Space group: P 1 21/n 1
Cell volume: 1878.6
Cell parameters: 10.326; 9.584; 19.601; 90; 104.43; 90;  

COD ID: 1553777
CIF file Formula: - C10 H12 O2 S -
Comments: Meng, Ke; Xia, Jingzhao; Wang, Yanzhao; Zhang, Xinghua; Yang, Guoqiang; Zhang, Wanbin Ir/BiphPHOX-catalyzed asymmetric hydrogenation of 3-substituted 2,5-dihydropyrroles and 2,5-dihydrothiophene 1,1-dioxides Organic Chemistry Frontiers 4(8) (2017) 1601
Space group: P 21 21 21
Cell volume: 953.3
Cell parameters: 5.7817; 8.2558; 19.972; 90; 90; 90;  

COD ID: 1553778
CIF file Formula: - C17 H19 N O2 S -
Comments: Meng, Ke; Xia, Jingzhao; Wang, Yanzhao; Zhang, Xinghua; Yang, Guoqiang; Zhang, Wanbin Ir/BiphPHOX-catalyzed asymmetric hydrogenation of 3-substituted 2,5-dihydropyrroles and 2,5-dihydrothiophene 1,1-dioxides Organic Chemistry Frontiers 4(8) (2017) 1601
Space group: P 1 21 1
Cell volume: 772.2
Cell parameters: 11.3637; 6.0455; 11.3636; 90; 98.45; 90;  

COD ID: 1553779
CIF file Formula: - C21 H16 N2 O3 -
Comments: Tang, Hai-Tao; Zeng, Jia-Hao; Chen, Jun-Jia; Zhou, Yun-Bing; Li, Ren-Hao; Zhan, Zhuang-Ping Synthesis of pyrazolo[5,1-a]isoquinolines through copper-catalyzed regioselective bicyclization of N-propargylic sulfonylhydrazones Organic Chemistry Frontiers 4(8) (2017) 1513
Space group: P c a 21
Cell volume: 1695.2
Cell parameters: 11.0348; 21.2718; 7.2221; 90; 90; 90;  

COD ID: 1553780
CIF file Formula: - C19 H11 Cl F3 N O -
Comments: Mishra, Kalpana; Singh, Jay Bahadur; Gupta, Tanu; Singh, Radhey M. TBAB-catalyzed cascade reactions: facile synthesis of 1-trifluoromethyl-3-alkylidene-1,3-dihydrofuro[3,4-b]quinolines via 5-exo-dig cyclization of o-arylalkynylquinoline aldehydes Organic Chemistry Frontiers 4(10) (2017) 1926
Space group: C 1 2/c 1
Cell volume: 3166
Cell parameters: 17.5265; 18.9585; 11.1154; 90; 120.995; 90;  

COD ID: 1553781
CIF file Formula: - C2 H4 N4 O -
Comments: Wan, Huabin; Li, Hongmin; Xu, Jian; Wu, Zhuang; Liu, Qifan; Chu, Xianxu; Abe, Manabu; Bégué, Didier; Zeng, Xiaoqing N-Methylcarbamoyl azide: spectroscopy, X-ray structure and decomposition via methylcarbamoyl nitrene Organic Chemistry Frontiers 4(9) (2017) 1839
Space group: P n m a
Cell volume: 459.38
Cell parameters: 5.0951; 6.0539; 14.8931; 90; 90; 90;  

COD ID: 1553782
CIF file Formula: - C21 H18 F2 O4 -
Comments: Li, Yuewen; Lu, Yiye; Mao, Runyu; Li, Zhiming; Wu, Jie A photoinduced reaction of perfluoroalkyl halides with 1,3-diarylprop-2-yn-1-ones catalyzed by DABSO Organic Chemistry Frontiers 4(9) (2017) 1745
Space group: P n a 21
Cell volume: 1828.3
Cell parameters: 12.326; 11.032; 13.445; 90; 90; 90;  

COD ID: 1553783
CIF file Formula: - C22 H18 Br4 N2 -
Comments: Huang, Zhe; Zhan, Ming; Zhang, Shaoguang; Luo, Qian; Zhang, Wen-Xiong; Xi, Zhenfeng Synthesis of dibromo- and tetrabromo-bipyrrolines and their corresponding 2,6-diazasemibullvalene derivatives Organic Chemistry Frontiers 4(9) (2017) 1785
Space group: P b c a
Cell volume: 4299.2
Cell parameters: 10.7971; 15.2395; 26.1285; 90; 90; 90;  

COD ID: 1553784
CIF file Formula: - C18 H26 Br2 N2 -
Comments: Huang, Zhe; Zhan, Ming; Zhang, Shaoguang; Luo, Qian; Zhang, Wen-Xiong; Xi, Zhenfeng Synthesis of dibromo- and tetrabromo-bipyrrolines and their corresponding 2,6-diazasemibullvalene derivatives Organic Chemistry Frontiers 4(9) (2017) 1785
Space group: P 1 21/c 1
Cell volume: 1916.3
Cell parameters: 6.6642; 19.8278; 14.8224; 90; 101.924; 90;  

COD ID: 1553785
CIF file Formula: - C26 H25 F3 N O S -
Comments: Liu, Bing; Zhang, Zhan-Ming; Xu, Bing; Xu, Shan; Wu, Hai-Hong; Liu, Yuanyuan; Zhang, Junliang Cu(i)-catalyzed Michael addition of ketiminoesters to β-trifluoromethyl β,β-disubstituted enones: rapid access to 1-pyrrolines bearing a quaternary all-carbon stereocenter Organic Chemistry Frontiers 4(9) (2017) 1772
Space group: P 21 21 2
Cell volume: 2560.4
Cell parameters: 23.66; 10.2673; 10.5398; 90; 90; 90;  

COD ID: 1553786
CIF file Formula: - C27 H23 Cl F3 N O3 -
Comments: Liu, Bing; Zhang, Zhan-Ming; Xu, Bing; Xu, Shan; Wu, Hai-Hong; Liu, Yuanyuan; Zhang, Junliang Cu(i)-catalyzed Michael addition of ketiminoesters to β-trifluoromethyl β,β-disubstituted enones: rapid access to 1-pyrrolines bearing a quaternary all-carbon stereocenter Organic Chemistry Frontiers 4(9) (2017) 1772
Space group: P 21 21 21
Cell volume: 2468.64
Cell parameters: 8.5817; 10.4128; 27.6259; 90; 90; 90;  

COD ID: 1553787
CIF file Formula: - C15 H16 F3 N O2 S -
Comments: Liu, Bing; Zhang, Zhan-Ming; Xu, Bing; Xu, Shan; Wu, Hai-Hong; Liu, Yuanyuan; Zhang, Junliang Cu(i)-catalyzed Michael addition of ketiminoesters to β-trifluoromethyl β,β-disubstituted enones: rapid access to 1-pyrrolines bearing a quaternary all-carbon stereocenter Organic Chemistry Frontiers 4(9) (2017) 1772
Space group: P 21 21 21
Cell volume: 1588.16
Cell parameters: 6.2282; 7.0351; 36.2461; 90; 90; 90;  

COD ID: 1553788
CIF file Formula: - C28 H21 N2 O2 P -
Comments: Qiao, Huijie; Sun, Suyan; Zhang, Yue; Zhu, Hongmei; Yu, Xiaomeng; Yang, Fan; Wu, Yusheng; Li, Zhongxian; Wu, Yangjie Merging photoredox catalysis with transition metal catalysis: site-selective C4 or C5-H phosphonation of 8-aminoquinoline amides Organic Chemistry Frontiers 4(10) (2017) 1981
Space group: P 1 21/c 1
Cell volume: 2263.48
Cell parameters: 12.9056; 8.981; 20.4045; 90; 106.848; 90;  

COD ID: 1553789
CIF file Formula: - C28 H21 N2 O2 P -
Comments: Qiao, Huijie; Sun, Suyan; Zhang, Yue; Zhu, Hongmei; Yu, Xiaomeng; Yang, Fan; Wu, Yusheng; Li, Zhongxian; Wu, Yangjie Merging photoredox catalysis with transition metal catalysis: site-selective C4 or C5-H phosphonation of 8-aminoquinoline amides Organic Chemistry Frontiers 4(10) (2017) 1981
Space group: P 1 21/n 1
Cell volume: 2520.22
Cell parameters: 14.3374; 9.71; 18.7718; 90; 105.341; 90;  

COD ID: 1553790
CIF file Formula: - C29 H23 N2 O3 P -
Comments: Qiao, Huijie; Sun, Suyan; Zhang, Yue; Zhu, Hongmei; Yu, Xiaomeng; Yang, Fan; Wu, Yusheng; Li, Zhongxian; Wu, Yangjie Merging photoredox catalysis with transition metal catalysis: site-selective C4 or C5-H phosphonation of 8-aminoquinoline amides Organic Chemistry Frontiers 4(10) (2017) 1981
Space group: P -1
Cell volume: 1213.1
Cell parameters: 9.5853; 9.8739; 14.7007; 103.11; 94.035; 114.371;  

COD ID: 1553791
CIF file Formula: - C28 H21 N2 O2 P -
Comments: Qiao, Huijie; Sun, Suyan; Zhang, Yue; Zhu, Hongmei; Yu, Xiaomeng; Yang, Fan; Wu, Yusheng; Li, Zhongxian; Wu, Yangjie Merging photoredox catalysis with transition metal catalysis: site-selective C4 or C5-H phosphonation of 8-aminoquinoline amides Organic Chemistry Frontiers 4(10) (2017) 1981
Space group: P 1 21/c 1
Cell volume: 2233.68
Cell parameters: 11.9961; 8.631; 21.6563; 90; 95.014; 90;  

COD ID: 1553792
CIF file Formula: - C33 H27 O2 P -
Comments: Li, Bin; Zhang, Mingkai; Huang, Xulun; Gu, Zhenhua Synthesis of 2,3-dihydro-1H-phosphindole-1-oxides via the t-BuLi-mediated rearrangement of vinyl bromides and phosphine oxides Organic Chemistry Frontiers 4(9) (2017) 1854
Space group: P 21 21 21
Cell volume: 2491.99
Cell parameters: 9.0757; 10.4623; 26.2445; 90; 90; 90;  

COD ID: 1553793
CIF file Formula: - C32 H25 O P -
Comments: Li, Bin; Zhang, Mingkai; Huang, Xulun; Gu, Zhenhua Synthesis of 2,3-dihydro-1H-phosphindole-1-oxides via the t-BuLi-mediated rearrangement of vinyl bromides and phosphine oxides Organic Chemistry Frontiers 4(9) (2017) 1854
Space group: P 1 21/c 1
Cell volume: 2367.66
Cell parameters: 12.3885; 18.8197; 10.4583; 90; 103.828; 90;  

COD ID: 1553794
CIF file Formula: - C28 H33 B O4 -
Comments: Hsieh, Jen-Chieh; Hong, Ya-Chun; Yang, Chun-Ming; Mannathan, Subramaniyan; Cheng, Chien-Hong Nickel-catalyzed highly chemo- and stereoselective borylative cyclization of 1,6-enynes with bis(pinacolato)diboron Organic Chemistry Frontiers 4(8) (2017) 1615
Space group: P -1
Cell volume: 1200.58
Cell parameters: 10.0442; 10.4197; 11.9542; 84.471; 84.954; 75.059;  

COD ID: 1553795
CIF file Formula: - C19 H19 Br O6 -
Comments: Hao, Xiaoyu; Lin, Lili; Tan, Fei; Ge, Shulin; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of chromans via the Friedel–Crafts alkylation–hemiketalization catalysed by an N,N′-dioxide scandium(iii) complex Organic Chemistry Frontiers 4(8) (2017) 1647
Space group: P 21 21 2
Cell volume: 1816.91
Cell parameters: 22.0623; 14.5144; 5.67392; 90; 90; 90;  

COD ID: 1553796
CIF file Formula: - C21 H18 Br N O3 -
Comments: De Munck, Lode; Sukowski, Verena; Vila, Carlos; Muñoz, M. Carmen; Pedro, José R. Catalytic enantioselective aza-Reformatsky reaction with seven-membered cyclic imines dibenzo[b,f][1,4]oxazepines Organic Chemistry Frontiers 4(8) (2017) 1624
Space group: P 1 21 1
Cell volume: 943.81
Cell parameters: 10.4368; 6.0294; 15.7294; 90; 107.537; 90;  

COD ID: 1553797
CIF file Formula: - C20 H13 F N2 O -
Comments: Ren, Xuhong; Wang, Qiyang; Yu, Wenjia; Zhan, Xiaoyu; Yao, Yishan; Qin, Bingjie; Dong, Mingxin; He, Xinhua Photoredox catalytic intramolecular imine C–H bond functionalization using ligand free Cu(ii) salts Organic Chemistry Frontiers 4(10) (2017) 2022
Space group: P 1 21/n 1
Cell volume: 1551.57
Cell parameters: 9.17425; 7.88736; 21.7312; 90; 99.3556; 90;  

COD ID: 1553798
CIF file Formula: - C7 H9 N7 O9 -
Comments: Hou, Tianjiao; Zhang, Jian; Wang, Chenjiao; Luo, Jun A facile method to construct a 2,4,9-triazaadamantane skeleton and synthesize nitramine derivatives Organic Chemistry Frontiers 4(9) (2017) 1819
Space group: C 1 c 1
Cell volume: 1210.1
Cell parameters: 7.6272; 13.3952; 11.846; 90; 90.87; 90;  

COD ID: 1553799
CIF file Formula: - C21 H40 O3 Si -
Comments: Tugny, Coralie; Khaled, Omar; Derat, Etienne; Goddard, Jean-Philippe; Mouriès-Mansuy, Virginie; Fensterbank, Louis Gold(i)-catalyzed access to neomerane skeletons Organic Chemistry Frontiers 4(10) (2017) 1906
Space group: P 1 21/c 1
Cell volume: 2176.24
Cell parameters: 15.7593; 6.7689; 21.0839; 90; 104.622; 90;  

COD ID: 1553800
CIF file Formula: - C22 H26 N4 O6 -
Comments: Tugny, Coralie; Khaled, Omar; Derat, Etienne; Goddard, Jean-Philippe; Mouriès-Mansuy, Virginie; Fensterbank, Louis Gold(i)-catalyzed access to neomerane skeletons Organic Chemistry Frontiers 4(10) (2017) 1906
Space group: P -1
Cell volume: 1076.8
Cell parameters: 8.7959; 10.4916; 13.2932; 70.468; 74.252; 71.371;  

COD ID: 1553801
CIF file Formula: - C22 H26 N4 O6 -
Comments: Tugny, Coralie; Khaled, Omar; Derat, Etienne; Goddard, Jean-Philippe; Mouriès-Mansuy, Virginie; Fensterbank, Louis Gold(i)-catalyzed access to neomerane skeletons Organic Chemistry Frontiers 4(10) (2017) 1906
Space group: P 1 21/n 1
Cell volume: 2173.37
Cell parameters: 15.8792; 7.383; 18.5839; 90; 94.011; 90;  

COD ID: 1553802
CIF file Formula: - C22 H26 N4 O6 -
Comments: Tugny, Coralie; Khaled, Omar; Derat, Etienne; Goddard, Jean-Philippe; Mouriès-Mansuy, Virginie; Fensterbank, Louis Gold(i)-catalyzed access to neomerane skeletons Organic Chemistry Frontiers 4(10) (2017) 1906
Space group: P 1 21/c 1
Cell volume: 4553.1
Cell parameters: 19.2372; 19.7853; 12.577; 90; 107.983; 90;  

COD ID: 1553803
CIF file Formula: - C21 H38 O3 Si -
Comments: Tugny, Coralie; Khaled, Omar; Derat, Etienne; Goddard, Jean-Philippe; Mouriès-Mansuy, Virginie; Fensterbank, Louis Gold(i)-catalyzed access to neomerane skeletons Organic Chemistry Frontiers 4(10) (2017) 1906
Space group: P 1 21/n 1
Cell volume: 2181.03
Cell parameters: 15.0743; 6.8149; 21.2545; 90; 92.709; 90;  

COD ID: 1553804
CIF file Formula: - C28 H29 I O4 S -
Comments: Miao, Maozhong; Xu, Huaping; Luo, Yi; Jin, Mengchao; Chen, Zhengkai; Xu, Jianfeng; Ren, Hongjun A modular approach to highly functionalized 3-sulfonylfurans via conjugate addition of 3-cyclopropylideneprop-2-en-1-ones with sodium sulfinates and sequential 5-endo-trig iodocyclization Organic Chemistry Frontiers 4(9) (2017) 1824
Space group: P 1 21/n 1
Cell volume: 2607.6
Cell parameters: 12.0087; 17.7464; 12.6045; 90; 103.892; 90;  

COD ID: 1553805
CIF file Formula: - C22 H20 O3 -
Comments: Shi, Xiaonan; He, Yan; Zhang, Xinying; Fan, Xuesen Selective syntheses of diversely substituted 2-hydroxy-4′-hydroxybenzophenones through [4 + 2] or [3 + 3] annulation of penta-3,4-dien-2-ones with 3-formylchromones Organic Chemistry Frontiers 4(10) (2017) 1967
Space group: P -1
Cell volume: 885.4
Cell parameters: 9.8395; 10.7013; 10.8636; 114.335; 94.477; 116.312;  

COD ID: 1553806
CIF file Formula: - C22 H19 N O5 S -
Comments: Xie, Lei; Ma, Hongli; Li, Jiaqi; Yu, Yuan; Qin, Zhaohai; Fu, Bin Ni(ii)-Catalyzed enantioselective Mukaiyama–Mannich reaction between silyl enol ethers and cyclic N-sulfonyl α-ketiminoesters Organic Chemistry Frontiers 4(9) (2017) 1858
Space group: P 21 21 21
Cell volume: 1949.99
Cell parameters: 8.8173; 14.3926; 15.3659; 90; 90; 90;  

COD ID: 1553807
CIF file Formula: - C21 H23 N O5 S -
Comments: Xie, Lei; Ma, Hongli; Li, Jiaqi; Yu, Yuan; Qin, Zhaohai; Fu, Bin Ni(ii)-Catalyzed enantioselective Mukaiyama–Mannich reaction between silyl enol ethers and cyclic N-sulfonyl α-ketiminoesters Organic Chemistry Frontiers 4(9) (2017) 1858
Space group: P 1 21 1
Cell volume: 959.52
Cell parameters: 8.2203; 9.1263; 13.0906; 90; 102.302; 90;  

COD ID: 1553808
CIF file Formula: - C62 H102 Cl8 N26 O21 Zn2 -
Comments: Qu, Yun-Xia; Lin, Rui-Lian; Zhang, Yun-Qian; Zhou, Kai-Zhi; Zhou, Qing-Di; Zhu, Qian-Jiang; Tao, Zhu; Ma, Pei-Hua; Liu, Jing-Xin; Wei, Gang Endo/exo binding of alkyl and aryl diammonium ions by cyclopentanocucurbit[6]uril Organic Chemistry Frontiers 4(9) (2017) 1799
Space group: C 1 2/c 1
Cell volume: 8533.3
Cell parameters: 29.3492; 12.5025; 25.3876; 90; 113.65; 90;  

COD ID: 1553809
CIF file Formula: - C60 H68 Cl8 N26 O28 Zn2 -
Comments: Qu, Yun-Xia; Lin, Rui-Lian; Zhang, Yun-Qian; Zhou, Kai-Zhi; Zhou, Qing-Di; Zhu, Qian-Jiang; Tao, Zhu; Ma, Pei-Hua; Liu, Jing-Xin; Wei, Gang Endo/exo binding of alkyl and aryl diammonium ions by cyclopentanocucurbit[6]uril Organic Chemistry Frontiers 4(9) (2017) 1799
Space group: C 1 2/c 1
Cell volume: 8694
Cell parameters: 27.52; 17.25; 18.358; 90; 94.006; 90;  

COD ID: 1553810
CIF file Formula: - C58 H94 Cl6 N26 O22 Zn2 -
Comments: Qu, Yun-Xia; Lin, Rui-Lian; Zhang, Yun-Qian; Zhou, Kai-Zhi; Zhou, Qing-Di; Zhu, Qian-Jiang; Tao, Zhu; Ma, Pei-Hua; Liu, Jing-Xin; Wei, Gang Endo/exo binding of alkyl and aryl diammonium ions by cyclopentanocucurbit[6]uril Organic Chemistry Frontiers 4(9) (2017) 1799
Space group: P -1
Cell volume: 1947.4
Cell parameters: 12.2894; 12.4667; 14.986; 73.289; 84.747; 62.451;  

COD ID: 1553811
CIF file Formula: - C60 H112 Cl10 N26 O28 Zn2 -
Comments: Qu, Yun-Xia; Lin, Rui-Lian; Zhang, Yun-Qian; Zhou, Kai-Zhi; Zhou, Qing-Di; Zhu, Qian-Jiang; Tao, Zhu; Ma, Pei-Hua; Liu, Jing-Xin; Wei, Gang Endo/exo binding of alkyl and aryl diammonium ions by cyclopentanocucurbit[6]uril Organic Chemistry Frontiers 4(9) (2017) 1799
Space group: P -1
Cell volume: 2233
Cell parameters: 12.298; 12.903; 15.662; 75.259; 70.211; 76.684;  

COD ID: 1553812
CIF file Formula: - C62 H108 Cl10 N26 O28 Zn2 -
Comments: Qu, Yun-Xia; Lin, Rui-Lian; Zhang, Yun-Qian; Zhou, Kai-Zhi; Zhou, Qing-Di; Zhu, Qian-Jiang; Tao, Zhu; Ma, Pei-Hua; Liu, Jing-Xin; Wei, Gang Endo/exo binding of alkyl and aryl diammonium ions by cyclopentanocucurbit[6]uril Organic Chemistry Frontiers 4(9) (2017) 1799
Space group: P -1
Cell volume: 2219.6
Cell parameters: 12.315; 12.875; 15.525; 75.131; 70.361; 77.82;  

COD ID: 1553813
CIF file Formula: - C21 H21 Br N2 O2 -
Comments: Yan, Hao; Li, Xincheng; Wang, Chunxiang; Wan, Boshun Silver-catalyzed cyclization of nitrones with 2-azetine: a radical approach to 2,3-disubstituted quinolines Organic Chemistry Frontiers 4(9) (2017) 1833
Space group: P -1
Cell volume: 993
Cell parameters: 5.095; 12.261; 17; 73.395; 81.56; 78.69;  

COD ID: 1553814
CIF file Formula: - C22 H26 N2 O4 -
Comments: Yan, Hao; Li, Xincheng; Wang, Chunxiang; Wan, Boshun Silver-catalyzed cyclization of nitrones with 2-azetine: a radical approach to 2,3-disubstituted quinolines Organic Chemistry Frontiers 4(9) (2017) 1833
Space group: P -1
Cell volume: 1043.1
Cell parameters: 6.1408; 10.54; 16.567; 87.399; 81.181; 79.922;  

COD ID: 1553815
CIF file Formula: - C23 H23 Cl O7 -
Comments: Yao, Qian; Lin, Lili; Zhang, Hang; Yu, Han; Xiong, Qian; Liu, Xiaohua; Feng, Xiaoming The asymmetric synthesis of multisubstituted diquinanes via the domino reaction of electron-deficient enynes Organic Chemistry Frontiers 4(10) (2017) 2012
Space group: P 21 21 21
Cell volume: 2237.7
Cell parameters: 6.82668; 9.4989; 34.5079; 90; 90; 90;  

COD ID: 1553816
CIF file Formula: - C19 H17 N O3 S -
Comments: De Nisi, A.; Sierra, S.; Ferrara, M.; Monari, M.; Bandini, M. TBAF catalyzed one-pot synthesis of allenyl-indoles Organic Chemistry Frontiers 4(9) (2017) 1849
Space group: P 1 21/n 1
Cell volume: 1583.46
Cell parameters: 7.8333; 8.7742; 23.1441; 90; 95.475; 90;  

COD ID: 1553817
CIF file Formula: - C20 H16 F3 N O3 S -
Comments: De Nisi, A.; Sierra, S.; Ferrara, M.; Monari, M.; Bandini, M. TBAF catalyzed one-pot synthesis of allenyl-indoles Organic Chemistry Frontiers 4(9) (2017) 1849
Space group: P 1
Cell volume: 1891.4
Cell parameters: 8.5679; 12.3701; 18.181; 83.843; 89.595; 80.871;  

COD ID: 1553818
CIF file Formula: - C15 H10 I2 O4 -
Comments: Tang, Yang; Yu, Qiong; Ma, Shengming Efficient trifluoromethylation via the cyclopropanation of allenes and subsequent C–C bond cleavage Organic Chemistry Frontiers 4(9) (2017) 1762
Space group: P 1 21/c 1
Cell volume: 1578.9
Cell parameters: 14.884; 4.3831; 27.39; 90; 117.921; 90;  

COD ID: 1553819
CIF file Formula: - C25 H26 F3 N O5 -
Comments: Tang, Yang; Yu, Qiong; Ma, Shengming Efficient trifluoromethylation via the cyclopropanation of allenes and subsequent C–C bond cleavage Organic Chemistry Frontiers 4(9) (2017) 1762
Space group: P 1 21/n 1
Cell volume: 2397.98
Cell parameters: 14.9433; 9.3141; 17.6377; 90; 102.36; 90;  

COD ID: 1553820
CIF file Formula: - C21 H24 F3 N O4 -
Comments: Tang, Yang; Yu, Qiong; Ma, Shengming Efficient trifluoromethylation via the cyclopropanation of allenes and subsequent C–C bond cleavage Organic Chemistry Frontiers 4(9) (2017) 1762
Space group: P 1 21/c 1
Cell volume: 2018.03
Cell parameters: 15.6855; 9.6366; 13.4345; 90; 96.4; 90;  

COD ID: 1553821
CIF file Formula: - C19 H21 F3 O5 -
Comments: Tang, Yang; Yu, Qiong; Ma, Shengming Efficient trifluoromethylation via the cyclopropanation of allenes and subsequent C–C bond cleavage Organic Chemistry Frontiers 4(9) (2017) 1762
Space group: P -1
Cell volume: 959.58
Cell parameters: 8.577; 11.253; 11.3999; 83.261; 69.715; 68.411;  

COD ID: 1553822
CIF file Formula: - C19 H15 N3 O4 -
Comments: Krylov, Igor B.; Paveliev, Stanislav A.; Shelimov, Boris N.; Lokshin, Boris V.; Garbuzova, Irina A.; Tafeenko, Viktor A.; Chernyshev, Vladimir V.; Budnikov, Alexander S.; Nikishin, Gennady I.; Terent'ev, Alexander O. Selective cross-dehydrogenative C–O coupling of N-hydroxy compounds with pyrazolones. Introduction of the diacetyliminoxyl radical into the practice of organic synthesis Organic Chemistry Frontiers 4(10) (2017) 1947
Space group: P c a 21
Cell volume: 3364.12
Cell parameters: 16.2553; 8.3116; 24.8996; 90; 90; 90;  

COD ID: 1553823
CIF file Formula: - C24 H21 F2 O3 P -
Comments: Zhang, Pengbo; Ying, Jianxi; Tang, Guo; Zhao, Yufen Phosphinodifluoroalkylation of alkynes using P(O)H compounds and ethyl difluoroiodoacetate Organic Chemistry Frontiers 4(10) (2017) 2054
Space group: C 1 2/c 1
Cell volume: 4259.3
Cell parameters: 25.317; 8.8649; 22.042; 90; 120.571; 90;  

COD ID: 1553824
CIF file Formula: - C26 H28 N2 O5 -
Comments: Yang, Minghua; Zhang, Shusheng; Zhang, Xiang; Wang, Haoyang; Zhang, Fang; Hou, Yuting; Su, Yue; Guo, Yinlong An unexpected acid-catalyzed decomposition reaction of cilnidipine and pranidipine to the decarboxylative bridged tricyclic products via cascade rearrangements Organic Chemistry Frontiers 4(11) (2017) 2163
Space group: P 1 21/n 1
Cell volume: 2343.5
Cell parameters: 7.75; 20.882; 14.5149; 90; 93.914; 90;  

COD ID: 1553825
CIF file Formula: - C18 H22 O5 -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel–Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: I 1 2/a 1
Cell volume: 3246.2
Cell parameters: 9.6871; 14.029; 23.8866; 90; 90.258; 90;  

COD ID: 1553826
CIF file Formula: - C20 H26 O6 -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel–Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: P 1 21/c 1
Cell volume: 3657.9
Cell parameters: 10.2811; 28.3515; 12.9191; 90; 103.741; 90;  

COD ID: 1553827
CIF file Formula: - C27 H33 N O7 S -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel–Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: C 1 2/c 1
Cell volume: 5021.3
Cell parameters: 22.151; 9.8005; 26.0531; 90; 117.401; 90;  

COD ID: 1553828
CIF file Formula: - C18 H22 O6 -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel–Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: P -1
Cell volume: 838
Cell parameters: 8.9279; 10.0249; 10.8557; 115.731; 104.925; 90.322;  

COD ID: 1553829
CIF file Formula: - C19 H23 O6 -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel‒Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: P 1 21/n 1
Cell volume: 1738.5
Cell parameters: 5.9908; 12.2284; 23.731; 90; 90; 90;  

COD ID: 1553830
CIF file Formula: - C27 H33 N O7 S -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel–Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: C 1 2/c 1
Cell volume: 5052.2
Cell parameters: 13.7047; 15.4463; 24.0895; 90; 97.806; 90;  

COD ID: 1553831
CIF file Formula: - C19 H24 O5 -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel‒Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: P -1
Cell volume: 870.7
Cell parameters: 8.981; 10.331; 10.885; 66.11; 71.31; 87.32;  

COD ID: 1553832
CIF file Formula: - C25 H29 N O7 S -
Comments: Sun, Haiyu; Xu, Shiyan; Xing, Zhimin; Liu, Lin; Feng, Shangbiao; Fang, Bowen; Xie, Xingang; She, Xuegong Rapid construction of complex tetracyclic frameworks via a gold(i)-catalyzed tandem 1,2-acyloxy migration/[3 + 2] cycloaddition/Friedel–Crafts type cyclization reaction of linear enynyl esters Organic Chemistry Frontiers 4(11) (2017) 2109
Space group: P -1
Cell volume: 1193.2
Cell parameters: 9.88; 10.9717; 12.836; 85.382; 71.391; 65.05;  

COD ID: 1553833
CIF file Formula: - C23 H19 Cl F3 N O5 -
Comments: Sun, Yao-Liang; Wei, Yin; Shi, Min Tunable regiodivergent phosphine-catalyzed [3 + 2] cycloaddition of alkynones and trifluoroacetyl phenylamides Organic Chemistry Frontiers 4(12) (2017) 2392
Space group: P -1
Cell volume: 1084.1
Cell parameters: 7.3052; 10.5757; 14.449; 88.853; 83.694; 77.708;  

COD ID: 1553834
CIF file Formula: - C19 H23 Cl F3 N O4 -
Comments: Sun, Yao-Liang; Wei, Yin; Shi, Min Tunable regiodivergent phosphine-catalyzed [3 + 2] cycloaddition of alkynones and trifluoroacetyl phenylamides Organic Chemistry Frontiers 4(12) (2017) 2392
Space group: P 1 21/n 1
Cell volume: 2066.8
Cell parameters: 11.287; 12.727; 14.808; 90; 103.68; 90;  

COD ID: 1553835
CIF file Formula: - C21 H17 Cl F3 N O3 -
Comments: Sun, Yao-Liang; Wei, Yin; Shi, Min Tunable regiodivergent phosphine-catalyzed [3 + 2] cycloaddition of alkynones and trifluoroacetyl phenylamides Organic Chemistry Frontiers 4(12) (2017) 2392
Space group: C 1 2/c 1
Cell volume: 3785.1
Cell parameters: 21.872; 7.604; 24.313; 90; 110.597; 90;  

COD ID: 1553836
CIF file Formula: - C16 H15 N O -
Comments: Zhang, Wei; Yu, Wenlong; Yan, Qiangqiang; Liu, Zhanxiang; Zhang, Yuhong Synthesis of substituted oxazoles via Pd-catalyzed tandem oxidative cyclization Organic Chemistry Frontiers 4(12) (2017) 2428
Space group: P 1 21 1
Cell volume: 1279
Cell parameters: 6.9086; 9.5831; 19.453; 90; 96.737; 90;  

COD ID: 1553837
CIF file Formula: - C25 H29 N O5 S -
Comments: Lv, Leiyang; Lu, Shenglin; Chen, Yuanjin; Li, Zhiping Diastereoselective building up polycyclic tetrahydrofurans via tandem annulation of 1,n-enynes with aliphatic acids Organic Chemistry Frontiers 4(11) (2017) 2147
Space group: P 1 21/c 1
Cell volume: 2221.19
Cell parameters: 11.7381; 13.2058; 14.4879; 90; 98.487; 90;  

COD ID: 1553838
CIF file Formula: - C29 H25 N O7 S -
Comments: Li, Shoulei; Zhang, Enge; Feng, Junjun; Li, Xin An enantioselective conjugate addition reaction of 3-substituted benzothiophen-2-ones and 2-phthalimidoacrylates Organic Chemistry Frontiers 4(12) (2017) 2301
Space group: P 21 21 21
Cell volume: 2638.4
Cell parameters: 8.0159; 15.545; 21.174; 90; 90; 90;  

COD ID: 1553839
CIF file Formula: - C15 H17 F N2 O2 -
Comments: Yang, Zi; Lin, Xing; Wang, Lianhui; Cui, Xiuling Facile synthesis of 1-aminoindoles via Rh(iii)-catalysed intramolecular three-component annulation Organic Chemistry Frontiers 4(11) (2017) 2179
Space group: P -1
Cell volume: 712.04
Cell parameters: 9.5214; 9.6784; 9.8861; 114.205; 92.568; 116.743;  

COD ID: 1553840
CIF file Formula: - C23 H22 Br N O4 S -
Comments: Wang, Weiyi; He, Qiuqin; Fan, Renhua PhI(OAc)2-mediated dialkoxylation of 4-aminostyrenes through a dearomatization process under metal-free conditions Organic Chemistry Frontiers 4(11) (2017) 2156
Space group: P 1 21/n 1
Cell volume: 2178
Cell parameters: 10.723; 9.856; 20.94; 90; 100.205; 90;  

COD ID: 1553841
CIF file Formula: - C17 H21 N O4 S -
Comments: Wang, Weiyi; He, Qiuqin; Fan, Renhua PhI(OAc)2-mediated dialkoxylation of 4-aminostyrenes through a dearomatization process under metal-free conditions Organic Chemistry Frontiers 4(11) (2017) 2156
Space group: P 1 21/n 1
Cell volume: 1719.1
Cell parameters: 13.746; 8.2548; 15.646; 90; 104.468; 90;  

COD ID: 1553842
CIF file Formula: - C40 H48 Cl2 N2 O2 Pd -
Comments: Chen, Fu-Min; Huang, Fei-Dong; Yao, Xue-Yi; Li, Tian; Liu, Feng-Shou Direct C‒H heteroarylation by an acenaphthyl-based α-diimine palladium complex: improvement of the reaction efficiency for bi(hetero)aryls under aerobic conditions Organic Chemistry Frontiers 4(12) (2017) 2336
Space group: P 1 21/n 1
Cell volume: 3843.5
Cell parameters: 11.7394; 19.838; 16.5546; 90; 94.489; 90;  

COD ID: 1553843
CIF file Formula: - C16 H15 N O4 -
Comments: Wu, Qiuju; Li, Chengcheng; Wang, Weihong; Wang, Hongling; Pan, Dingwu; Zheng, Pengcheng NHC-catalyzed enantioselective synthesis of dihydropyran-4-carbonitriles bearing all-carbon quaternary centers Organic Chemistry Frontiers 4(12) (2017) 2323
Space group: P 21 21 21
Cell volume: 1480.28
Cell parameters: 7.973; 12.9128; 14.3781; 90; 90; 90;  

COD ID: 1553844
CIF file Formula: - C20 H21 N O2 -
Comments: Wu, Shangze; Huang, Xin; Fu, Chunling; Ma, Shengming Asymmetric SN2′-type C–H functionalization of arenes with propargylic alcohols Organic Chemistry Frontiers 4(10) (2017) 2002
Space group: P 1 21/n 1
Cell volume: 1649.45
Cell parameters: 11.831; 8.4718; 16.4581; 90; 90.759; 90;  

COD ID: 1553845
CIF file Formula: - C24 H27 N O -
Comments: Wu, Shangze; Huang, Xin; Fu, Chunling; Ma, Shengming Asymmetric SN2′-type C–H functionalization of arenes with propargylic alcohols Organic Chemistry Frontiers 4(10) (2017) 2002
Space group: P -1
Cell volume: 1002.3
Cell parameters: 8.316; 10.229; 13.179; 69.905; 82.818; 72.23;  

COD ID: 1553846
CIF file Formula: - C17 H22 I N O2 -
Comments: Wu, Shangze; Huang, Xin; Fu, Chunling; Ma, Shengming Asymmetric SN2′-type C–H functionalization of arenes with propargylic alcohols Organic Chemistry Frontiers 4(10) (2017) 2002
Space group: P 1 21/n 1
Cell volume: 1728.1
Cell parameters: 11.781; 12.2621; 12.7517; 90; 110.261; 90;  

COD ID: 1553847
CIF file Formula: - C8 H6 Br F3 O S -
Comments: Zhang, Yunxiao; Wu, Dongping; Weng, Zhiqiang Synthesis of 1,2,2-trifluorovinyl sulphides and selenides from trifluorovinylation of organic thiocyanates and selenocyanates Organic Chemistry Frontiers 4(11) (2017) 2226
Space group: P 1 21/c 1
Cell volume: 999.5
Cell parameters: 20.993; 3.9406; 12.147; 90; 95.906; 90;  

COD ID: 1553848
CIF file Formula: - C26 H20 Br N O4 S -
Comments: Jin, Hongxing; Li, Erqing; Huang, You Divergent synthesis of hydropyridine derivatives via nitrogen-containing Lewis base mediated regioselective [4 + 2] cyclizations Organic Chemistry Frontiers 4(11) (2017) 2216
Space group: P -1
Cell volume: 1080.8
Cell parameters: 9.3385; 11.1134; 11.912; 69.983; 88.735; 69.443;  

COD ID: 1553849
CIF file Formula: - C26 H20 Br N O4 S -
Comments: Jin, Hongxing; Li, Erqing; Huang, You Divergent synthesis of hydropyridine derivatives via nitrogen-containing Lewis base mediated regioselective [4 + 2] cyclizations Organic Chemistry Frontiers 4(11) (2017) 2216
Space group: C 1 2/c 1
Cell volume: 4431
Cell parameters: 27.96; 10.908; 16.954; 90; 121.023; 90;  

COD ID: 1553850
CIF file Formula: - C18 H16 O4 S -
Comments: Zhao, Wei-Wei; Liu, Yan-Kai Enantio- and diastereoselective synthesis of tetrahydrofuro[2,3-b]furan-2(3H)-one derivatives and related oxygen heterocycles via an asymmetric organocatalytic cascade process Organic Chemistry Frontiers 4(12) (2017) 2358
Space group: P 21 21 21
Cell volume: 1584.6
Cell parameters: 9.7797; 10.9021; 14.8619; 90; 90; 90;  

COD ID: 1553851
CIF file Formula: - C100 H96 Cl6 N6 O10 -
Comments: Zhang, Yuehong; Wang, Chiming; Chen, Xin; Pan, Houhe; Qi, Dongdong; Wang, Kang; Jiang, Jianzhuang Novel, linear oligoisoindole compounds with a conjugated electronic structure Organic Chemistry Frontiers 4(12) (2017) 2364
Space group: P -1
Cell volume: 2217.36
Cell parameters: 9.8074; 13.2321; 17.7176; 100.836; 99.601; 93.264;  

COD ID: 1553852
CIF file Formula: - C88 H122 N2 O4 S2 -
Comments: Zhang, Yuehong; Wang, Chiming; Chen, Xin; Pan, Houhe; Qi, Dongdong; Wang, Kang; Jiang, Jianzhuang Novel, linear oligoisoindole compounds with a conjugated electronic structure Organic Chemistry Frontiers 4(12) (2017) 2364
Space group: P 1
Cell volume: 1970.23
Cell parameters: 8.9041; 14.0916; 16.2768; 104.121; 91.824; 94.954;  

COD ID: 1553853
CIF file Formula: - C202 H249 Cl14 N9 O15 -
Comments: Zhang, Yuehong; Wang, Chiming; Chen, Xin; Pan, Houhe; Qi, Dongdong; Wang, Kang; Jiang, Jianzhuang Novel, linear oligoisoindole compounds with a conjugated electronic structure Organic Chemistry Frontiers 4(12) (2017) 2364
Space group: P -1
Cell volume: 9875.8
Cell parameters: 18.0089; 19.4187; 29.7417; 90.357; 95.539; 107.328;  

COD ID: 1553854
CIF file Formula: - C132 H154 Cl12 N6 O8 -
Comments: Zhang, Yuehong; Wang, Chiming; Chen, Xin; Pan, Houhe; Qi, Dongdong; Wang, Kang; Jiang, Jianzhuang Novel, linear oligoisoindole compounds with a conjugated electronic structure Organic Chemistry Frontiers 4(12) (2017) 2364
Space group: P 1 21/c 1
Cell volume: 6434.8
Cell parameters: 9.9153; 27.367; 23.7531; 90; 93.29; 90;  

COD ID: 1553855
CIF file Formula: - C18 H16 Cl N O4 S -
Comments: Deng, Hua; He, Fu-Sheng; Li, Cong-Shan; Yang, Wu-Lin; Deng, Wei-Ping Enantioselective construction of tricyclic pyrrolidine-fused benzo[b]thiophene 1,1-dioxide derivatives via copper(i)-catalyzed asymmetric 1,3-dipolar cycloaddition Organic Chemistry Frontiers 4(12) (2017) 2343
Space group: P 21 21 21
Cell volume: 1706.5
Cell parameters: 5.1621; 16.3247; 20.251; 90; 90; 90;  

COD ID: 1553866
CIF file Formula: - C31 H36 N2 O4 -
Comments: Wu, Jia-Le; Wang, Jing-Yi; Wu, Ping; Mei, Guang-Jian; Shi, Feng Catalytic asymmetric C2-nucleophilic substitutions of C3-substituted indoles with ortho-hydroxybenzyl alcohols Organic Chemistry Frontiers 4(12) (2017) 2465
Space group: P -1
Cell volume: 1414.37
Cell parameters: 8.4885; 10.6796; 16.8127; 74.369; 82.265; 75.011;  

COD ID: 1553867
CIF file Formula: - C23 H20 N O2 -
Comments: Wu, Jia-Le; Wang, Jing-Yi; Wu, Ping; Mei, Guang-Jian; Shi, Feng Catalytic asymmetric C2-nucleophilic substitutions of C3-substituted indoles with ortho-hydroxybenzyl alcohols Organic Chemistry Frontiers 4(12) (2017) 2465
Space group: P 61
Cell volume: 2943.2
Cell parameters: 18.5578; 18.5578; 9.8682; 90; 90; 120;  

COD ID: 1553868
CIF file Formula: - C17 H22 N2 O2 -
Comments: Liu, Xueke; Qian, Ping; Wang, Yi; Pan, Yi Metal-free sequential decarbonylative annulation of N-cyanamides for the construction of 2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ones Organic Chemistry Frontiers 4(12) (2017) 2370
Space group: P 1 21/n 1
Cell volume: 1594.3
Cell parameters: 6.0777; 22.245; 11.8606; 90; 96.163; 90;  

COD ID: 1553869
CIF file Formula: - C20 H22 N2 O -
Comments: Liu, Xueke; Qian, Ping; Wang, Yi; Pan, Yi Metal-free sequential decarbonylative annulation of N-cyanamides for the construction of 2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ones Organic Chemistry Frontiers 4(12) (2017) 2370
Space group: C 1 2/c 1
Cell volume: 3322.6
Cell parameters: 21.107; 7.3437; 21.914; 90; 101.993; 90;  

COD ID: 1553870
CIF file Formula: - C31 H38 O9 -
Comments: Luo, Jun; Huang, Wan-Sha; Hu, Sheng-Mou; Zhang, Pan-Pan; Zhou, Xu-Wei; Wang, Xiao-Bing; Yang, Ming-Hua; Luo, Jian-Guang; Wang, Chen; Liu, Chang; Yao, He-Quan; Zhang, Can; Sun, Hong-Bin; Chen, Yi-Jun; Kong, Ling-Yi Rearranged limonoids with unique 6/5/6/5 tetracarbocyclic skeletons from Toona ciliata and biomimetic structure divergence Organic Chemistry Frontiers 4(12) (2017) 2417
Space group: P 1 21 1
Cell volume: 1431.01
Cell parameters: 7.9044; 11.5678; 15.8146; 90; 98.267; 90;  

COD ID: 1553871
CIF file Formula: - C31 H38 O9 -
Comments: Luo, Jun; Huang, Wan-Sha; Hu, Sheng-Mou; Zhang, Pan-Pan; Zhou, Xu-Wei; Wang, Xiao-Bing; Yang, Ming-Hua; Luo, Jian-Guang; Wang, Chen; Liu, Chang; Yao, He-Quan; Zhang, Can; Sun, Hong-Bin; Chen, Yi-Jun; Kong, Ling-Yi Rearranged limonoids with unique 6/5/6/5 tetracarbocyclic skeletons from Toona ciliata and biomimetic structure divergence Organic Chemistry Frontiers 4(12) (2017) 2417
Space group: P 21 21 21
Cell volume: 5837.62
Cell parameters: 14.6815; 17.2043; 23.1115; 90; 90; 90;  

COD ID: 1553875
CIF file Formula: - C25 H24 Br2 N2 O3 S -
Comments: Jiang, Bo; Shi, Min Rhodium(ii)-catalyzed intermolecular [3 + 2] annulation of N-vinyl indoles with N-tosyl-1,2,3-triazoles via an aza-vinyl Rh carbene Organic Chemistry Frontiers 4(12) (2017) 2459
Space group: P -1
Cell volume: 1408.7
Cell parameters: 8.4549; 13.872; 14.009; 117.552; 101.368; 92.964;  

COD ID: 1553876
CIF file Formula: - C44 H45 Br2 N3 O6 S2 -
Comments: Jiang, Bo; Shi, Min Rhodium(ii)-catalyzed intermolecular [3 + 2] annulation of N-vinyl indoles with N-tosyl-1,2,3-triazoles via an aza-vinyl Rh carbene Organic Chemistry Frontiers 4(12) (2017) 2459
Space group: P 1 21/c 1
Cell volume: 4777.4
Cell parameters: 13.823; 11.5473; 30.267; 90; 98.559; 90;  

COD ID: 1553877
CIF file Formula: - C43 H38 Br N3 O4 S2 -
Comments: Jiang, Bo; Shi, Min Rhodium(ii)-catalyzed intermolecular [3 + 2] annulation of N-vinyl indoles with N-tosyl-1,2,3-triazoles via an aza-vinyl Rh carbene Organic Chemistry Frontiers 4(12) (2017) 2459
Space group: P -1
Cell volume: 1983.8
Cell parameters: 11.936; 13.1209; 13.8558; 89.702; 84.883; 66.69;  

COD ID: 1553878
CIF file Formula: - C31 H26 N2 O2 S -
Comments: Jiang, Bo; Shi, Min Rhodium(ii)-catalyzed intermolecular [3 + 2] annulation of N-vinyl indoles with N-tosyl-1,2,3-triazoles via an aza-vinyl Rh carbene Organic Chemistry Frontiers 4(12) (2017) 2459
Space group: P -1
Cell volume: 1241.6
Cell parameters: 10.688; 10.745; 11.245; 103.535; 94.412; 96.045;  

COD ID: 1553879
CIF file Formula: - C25 H21 Br N2 O2 S -
Comments: Jiang, Bo; Shi, Min Rhodium(ii)-catalyzed intermolecular [3 + 2] annulation of N-vinyl indoles with N-tosyl-1,2,3-triazoles via an aza-vinyl Rh carbene Organic Chemistry Frontiers 4(12) (2017) 2459
Space group: C 1 2/c 1
Cell volume: 4349.8
Cell parameters: 24.816; 10.401; 16.9512; 90; 96.192; 90;  

COD ID: 1553881
CIF file Formula: - C72 H112 Cl2 N28 O26 -
Comments: Xiao, Zhi-You; Lin, Rui-Lian; Tao, Zhu; Liu, Qing-Yun; Liu, Jing-Xin; Xiao, Xin Multiple noncovalent interaction constructed polymeric supramolecular crystals: recognition of butyl viologen by para-dicyclohexanocucurbit[6]uril and α,α′,δ,δ′-tetramethylcucurbit[6]uril Organic Chemistry Frontiers 4(12) (2017) 2422
Space group: C 1 2/c 1
Cell volume: 9296.9
Cell parameters: 24.1839; 31.5567; 12.6112; 90; 104.99; 90;  

COD ID: 1553882
CIF file Formula: - C108 H176 Cl6 N52 O50 Sr2 -
Comments: Xiao, Zhi-You; Lin, Rui-Lian; Tao, Zhu; Liu, Qing-Yun; Liu, Jing-Xin; Xiao, Xin Multiple noncovalent interaction constructed polymeric supramolecular crystals: recognition of butyl viologen by para-dicyclohexanocucurbit[6]uril and α,α′,δ,δ′-tetramethylcucurbit[6]uril Organic Chemistry Frontiers 4(12) (2017) 2422
Space group: P -1
Cell volume: 4227.9
Cell parameters: 12.8381; 15.6916; 22.2878; 92.995; 98.521; 106.862;  


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