Crystallography Open Database
Search results
Result: there are 250 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Organic Chemistry Frontiers' volume of publication is 4
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1553497 | CIF | C19 H17 N O4 | P -1 | 8.125; 9.328; 11.408 90.91; 96.19; 107.69 | 817.8 | 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, 2017, 4, 297 |
| 1553519 | CIF | C36 H32 F2 N2 O2 | P 21 21 21 | 11.5593; 14.0068; 17.8914 90; 90; 90 | 2896.78 | 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, 2017, 4, 57 |
| 1553520 | CIF | C44 H50 N2 | P 1 21/c 1 | 19.661; 10.71; 17.118 90; 97.306; 90 | 3575 | 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, 2017, 4, 57 |
| 1553521 | CIF | C16 H18 O3 S | P -1 | 6.9478; 9.1969; 11.8012 82.206; 81.643; 75.22 | 717.55 | 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, 2017, 4, 31 |
| 1553522 | CIF | C15 H16 O2 S | P 1 21/n 1 | 7.68603; 23.9176; 7.76261 90; 111.053; 90 | 1331.76 | 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, 2017, 4, 31 |
| 1553523 | CIF | C14 H11 N S | P 1 21/n 1 | 5.7042; 25.743; 7.8069 90; 94.59; 90 | 1142.71 | 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, 2017, 4, 31 |
| 1553524 | CIF | C15 H14 O S | P 1 21/n 1 | 5.7958; 25.4544; 8.3123 90; 93.626; 90 | 1223.85 | 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, 2017, 4, 31 |
| 1553525 | CIF | C15 H14 O2 S | P 1 21/n 1 | 5.611; 25.6833; 8.991 90; 98.982; 90 | 1279.8 | 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, 2017, 4, 31 |
| 1553526 | CIF | C14 H11 N O S | P 1 21/n 1 | 5.67633; 26.8781; 7.7875 90; 95.042; 90 | 1183.53 | 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, 2017, 4, 31 |
| 1553527 | CIF | C14 H8 N2 S2 | P -1 | 7.8232; 11.6428; 14.5818 84.863; 83.654; 73.557 | 1263.68 | 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, 2017, 4, 31 |
| 1553530 | CIF | C35 H53 N O3 | P 1 21 1 | 7.455; 11.3624; 18.4877 90; 92.585; 90 | 1564.44 | 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, 2017, 4, 42 |
| 1553531 | CIF | C30 H50 O3 | P 21 21 21 | 6.52391; 12.9427; 31.7963 90; 90; 90 | 2684.78 | 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, 2017, 4, 42 |
| 1553543 | CIF | C22 H21 N O2 | P 1 21/n 1 | 7.348; 22.781; 11.236 90; 101.092; 90 | 1845.7 | Yu, Wenlong; Zhang, Wei; Liu, Yue; Liu, Zhanxiang; Zhang, Yuhong Cobalt(iii)-catalyzed cross-coupling of enamides with allyl acetates/maleimides Organic Chemistry Frontiers, 2017, 4, 77 |
| 1553544 | CIF | C15 H16 N2 O3 | P 1 21/n 1 | 9.3103; 4.8793; 30.741 90; 96.596; 90 | 1387.3 | Yu, Wenlong; Zhang, Wei; Liu, Yue; Liu, Zhanxiang; Zhang, Yuhong Cobalt(iii)-catalyzed cross-coupling of enamides with allyl acetates/maleimides Organic Chemistry Frontiers, 2017, 4, 77 |
| 1553545 | CIF | C25 H21 N O2 S | R 3 c :H | 33.922; 33.922; 11.008 90; 90; 120 | 10970 | 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, 2017, 4, 14 |
| 1553547 | CIF | C18 H12 Br2 | P 1 21/n 1 | 5.3248; 17.2473; 7.6729 90; 96.167; 90 | 700.59 | 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, 2017, 4, 658 |
| 1553548 | CIF | C20 H16 Br2 | P 1 21/c 1 | 6.6723; 8.653; 15.099 90; 111.66; 90 | 810.2 | 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, 2017, 4, 658 |
| 1553549 | CIF | C28 H16 Br2 | C 1 2/c 1 | 21.802; 4.9336; 18.875 90; 90.188; 90 | 2030.2 | 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, 2017, 4, 658 |
| 1553550 | CIF | C36 H32 Br2 | P -1 | 10.0648; 11.6684; 12.2462 77.981; 86.017; 79.287 | 1381.44 | 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, 2017, 4, 658 |
| 1553551 | CIF | C34 H28 Br2 | P 1 21/n 1 | 11.131; 10.249; 11.763 90; 101.301; 90 | 1315.92 | 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, 2017, 4, 658 |
| 1553552 | CIF | C50 H38 | P -1 | 10.8252; 13.5794; 14.2122 114.377; 91.316; 95.604 | 1889.2 | 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, 2017, 4, 658 |
| 1553554 | CIF | C18 H15 I O Se | C 1 2/c 1 | 20.3; 5.882; 27.651 90; 94.075; 90 | 3293 | 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, 2017, 4, 277 |
| 1553555 | CIF | C20 H19 I O Se | P 1 2/c 1 | 19.0809; 5.7136; 17.2112 90; 100.175; 90 | 1846.87 | 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, 2017, 4, 277 |
| 1553556 | CIF | C29 H25 Cl N2 O8 S | P 1 21 1 | 11.4186; 9.7011; 13.152 90; 92.473; 90 | 1455.5 | 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, 2017, 4, 52 |
| 1553557 | CIF | C25 H18 O2 | P n 21 a | 14.3717; 5.917; 21.4597 90; 90; 90 | 1824.88 | Sreenivasulu, Chinnabattigalla; Gopi Krishna Reddy, A.; Satyanarayana, G. Oxidative annulations triggered by a simple Lewis acid: facile synthesis of benzofurans Organic Chemistry Frontiers, 2017, 4, 972 |
| 1553558 | CIF | C20 H14 O | P 21 21 21 | 7.9447; 10.3826; 17.0108 90; 90; 90 | 1403.16 | Sreenivasulu, Chinnabattigalla; Gopi Krishna Reddy, A.; Satyanarayana, G. Oxidative annulations triggered by a simple Lewis acid: facile synthesis of benzofurans Organic Chemistry Frontiers, 2017, 4, 972 |
| 1553559 | CIF | C27 H31 N O7 S3 | P 1 21/c 1 | 21.226; 8.2493; 16.985 90; 109.61; 90 | 2801.6 | 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, 2017, 4, 135 |
| 1553560 | CIF | C15 H21 N O3 S | C 1 2/c 1 | 25.961; 5.793; 22.2512 90; 114.088; 90 | 3055 | 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, 2017, 4, 135 |
| 1553561 | CIF | C18 H16 F3 N O2 S2 | P -1 | 6.52; 8.149; 18.175 102.278; 95.21; 97.731 | 927.9 | Chen, Min-Tao; Tang, Xiang-Ying; Shi, Min A facile approach for the trifluoromethylthiolation of methylenecyclopropanes Organic Chemistry Frontiers, 2017, 4, 86 |
| 1553562 | CIF | C17 H15 N O2 | P -1 | 13.451; 14.313; 15.248 86.714; 63.827; 90.014 | 2629.2 | 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, 2017, 4, 124 |
| 1553563 | CIF | C26 H20 Cl N O3 | P -1 | 7.3875; 11.6702; 13.4944 64.647; 82.911; 77.69 | 1026.5 | 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, 2017, 4, 124 |
| 1553564 | CIF | C23 H24 N2 O6 S | P -1 | 8.5455; 12.047; 12.1501 60.733; 81.883; 87.112 | 1079.97 | 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, 2017, 4, 124 |
| 1553565 | CIF | C44 H52 N4 S4 | P -1 | 9.3265; 9.7095; 23.593 78.225; 84.998; 75.52 | 2023.6 | 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, 2017, 4, 18 |
| 1553566 | CIF | C20 H21 N O8 | P 1 21/c 1 | 8.101; 19.041; 13.693 90; 107.19; 90 | 2017.8 | 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, 2017, 4, 119 |
| 1553567 | CIF | C22 H16 Cl N O2 | P 1 21/n 1 | 11.366; 11.305; 14.788 90; 110.536; 90 | 1779.4 | 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, 2017, 4, 196 |
| 1553568 | CIF | C33 H30 N4 O3 | P 1 21 1 | 8.902; 13.209; 12.059 90; 99.65; 90 | 1397.9 | 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, 2017, 4, 101 |
| 1553569 | CIF | C31 H27 Br N4 O3 | P 21 21 21 | 9.662; 12.286; 24.441 90; 90; 90 | 2901 | 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, 2017, 4, 101 |
| 1553570 | CIF | C25 H23 N O3 | P 41 | 8.4091; 8.4091; 29.3175 90; 90; 90 | 2073.13 | 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, 2017, 4, 358 |
| 1553571 | CIF | C15 H17 Cl N2 O3 | P 21 21 21 | 7.2915; 12.7983; 15.9552 90; 90; 90 | 1488.92 | 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, 2017, 4, 81 |
| 1553572 | CIF | C15 H11 Cl F3 N3 O3 | P 21 21 21 | 7.74798; 9.1129; 21.719 90; 90; 90 | 1533.5 | 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, 2017, 4, 308 |
| 1553573 | CIF | C14 H13 N3 O S | P -1 | 7.68; 8.494; 11.449 85.96; 77.314; 66.467 | 667.9 | Chen, Jichao; Wang, Tianyu; Wang, Tong; Lin, Aijun; Yao, Hequan; Xu, Jinyi Copper-catalyzed C5-selective thio/selenocyanation of 8-aminoquinolines Organic Chemistry Frontiers, 2017, 4, 130 |
| 1553574 | CIF | C19 H23 Br N O3 P | P 21 21 2 | 9.8916; 26.4389; 7.7778 90; 90; 90 | 2034.1 | 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, 2017, 4, 271 |
| 1553575 | CIF | C153.47 H187.47 Cl4.41 N2 Si8 | P 41 21 2 | 21.2715; 21.2715; 64.3247 90; 90; 90 | 29105.4 | 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, 2017, 4, 664 |
| 1553576 | CIF | C21 H21 Cl F N O2 | P 1 21/c 1 | 9.4639; 21.8249; 9.3192 90; 104.752; 90 | 1861.42 | 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, 2017, 4, 373 |
| 1553577 | CIF | C15 H15 Br O2 | P 1 21 1 | 7.813; 5.321; 15.394 90; 91.594; 90 | 639.7 | Li, Jing; Li, Zequan; Zhang, Xun; Xu, Bing; Shi, Yian Catalytic enantioselective bromohydroxylation of aryl olefins with flexible functionalities Organic Chemistry Frontiers, 2017, 4, 1084 |
| 1553578 | CIF | C11 H14 Br F O2 | P 21 21 21 | 5.651; 16.364; 38.4918 90; 90; 90 | 3559 | Li, Jing; Li, Zequan; Zhang, Xun; Xu, Bing; Shi, Yian Catalytic enantioselective bromohydroxylation of aryl olefins with flexible functionalities Organic Chemistry Frontiers, 2017, 4, 1084 |
| 1553579 | CIF | C17 H12 B F2 N5 O | C 1 2/c 1 | 10.248; 14.634; 11.146 90; 107.352; 90 | 1595.5 | 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, 2017, 4, 178 |
| 1553580 | CIF | C16 H10 Br2 Cl F3 | P -1 | 7.3184; 13.4865; 17.4149 101.672; 94.139; 101.918 | 1635.33 | 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, 2017, 4, 255 |
| 1553581 | CIF | C20 H20 Br F3 O | P -1 | 7.8481; 10.5581; 12.2042 75.472; 72.741; 72.301 | 905.55 | 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, 2017, 4, 255 |
| 1553582 | CIF | C20 H20 Br F3 O2 | P -1 | 8.3533; 9.4941; 12.1934 100.216; 97.306; 100.289 | 923.7 | 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, 2017, 4, 255 |
| 1553583 | CIF | C18 H15 Br2 F3 | P b c a | 16.4974; 6.84171; 28.6498 90; 90; 90 | 3233.72 | 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, 2017, 4, 255 |
| 1553584 | CIF | C16 H11 Br2 F3 | P -1 | 7.1399; 9.7404; 22.8361 97.673; 97.146; 106.455 | 1487.32 | 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, 2017, 4, 255 |
| 1553585 | CIF | C17 H12 Br F3 | C 1 2/c 1 | 22.8229; 7.4881; 16.5828 90; 102.102; 90 | 2771 | 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, 2017, 4, 255 |
| 1553586 | CIF | C19 H17 Br Cl F3 | P 1 21/c 1 | 8.2233; 22.8182; 10.0565 90; 109.447; 90 | 1779.36 | 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, 2017, 4, 255 |
| 1553587 | CIF | C12 H11 I N2 O2 | C m c e | 6.9379; 19.798; 17.773 90; 90; 90 | 2441.2 | 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, 2017, 4, 1046 |
| 1553588 | CIF | C46 H66 Cl2 | P 1 21/n 1 | 10.4263; 10.2668; 40.789 90; 90.6212; 90 | 4366 | 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, 2017, 4, 668 |
| 1553589 | CIF | C47 H64 | P -1 | 10.3367; 10.4631; 19.275 88.5549; 78.0127; 88.5903 | 2038.2 | 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, 2017, 4, 668 |
| 1553590 | CIF | C49 H64 | P 3 1 c | 14.154; 14.154; 12.123 90; 90; 120 | 2103.3 | 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, 2017, 4, 668 |
| 1553591 | CIF | C20 H13 F7 N2 O | P 1 21/c 1 | 7.858; 26.656; 8.984 90; 90.001; 90 | 1881.8 | 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, 2017, 4, 1116 |
| 1553592 | CIF | C44 H58 N2 Se2 Si4 | P 1 21/n 1 | 14.2771; 14.228; 22.6224 90; 99.427; 90 | 4533.33 | 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, 2017, 4, 682 |
| 1553593 | CIF | C44 H58 N2 S2 Si4 | P 1 21/n 1 | 14.2494; 14.1245; 22.4876 90; 98.8; 90 | 4472.7 | 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, 2017, 4, 682 |
| 1553594 | CIF | C32 H22 Br8 N2 | P -1 | 10.8503; 12.4427; 12.9897 100.306; 91.28; 108.652 | 1628.82 | 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, 2017, 4, 682 |
| 1553595 | CIF | C50 H52 N14 O4 | P 1 21/c 1 | 9.842; 21.609; 25.234 90; 91.32; 90 | 5365.2 | 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, 2017, 4, 283 |
| 1553596 | CIF | C54.83 H62.12 Cl1.76 N16.83 O2 | C 1 2/c 1 | 28.402; 9.816; 18.722 90; 90.7; 90 | 5219.2 | 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, 2017, 4, 283 |
| 1553597 | CIF | C54 H60 N16 O2 | P -1 | 9.6636; 15.1098; 18.1939 69.768; 84.466; 84.513 | 2475.53 | 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, 2017, 4, 283 |
| 1553598 | CIF | C40 H24 S2 | P -1 | 7.5051; 8.6296; 11.6509 73.729; 77.669; 77.532 | 697.78 | 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, 2017, 4, 675 |
| 1553599 | CIF | C46 H32 | P n a 21 | 16.8864; 7.4906; 24.7447 90; 90; 90 | 3129.94 | 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, 2017, 4, 675 |
| 1553600 | CIF | C44 H28 | P -1 | 7.597; 8.9994; 11.0344 78.931; 75.805; 83.409 | 715.94 | 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, 2017, 4, 675 |
| 1553601 | CIF | C26 H22 N4 O5 S | C 1 2/c 1 | 26.478; 8.1615; 23.0582 90; 96.411; 90 | 4951.7 | Chen, Dianpeng; Xing, Gangdong; Yao, Jinzhong; Zhou, Hongwei Applicable β-sulfonium carbanions: facile construction of thiophene derivatives Organic Chemistry Frontiers, 2017, 4, 1042 |
| 1553602 | CIF | C12 H9 N O S3 | P b c n | 7.9629; 16.9905; 18.7808 90; 90; 90 | 2540.92 | 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, 2017, 4, 369 |
| 1553603 | CIF | C71 H46 B F24 Ir N O P | P 21 21 21 | 12.2302; 15.3106; 36.571 90; 90; 90 | 6848 | 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, 2017, 4, 627 |
| 1553604 | CIF | C26 H16 Cu N4 O8 | P 1 21/c 1 | 11.1134; 21.1702; 9.8578 90; 101.189; 90 | 2275.19 | 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, 2017, 4, 519 |
| 1553605 | CIF | C16 H11 N O3 | P 1 21/c 1 | 8.269; 9.296; 16.904 90; 93.281; 90 | 1297.3 | 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, 2017, 4, 292 |
| 1553606 | CIF | C22 H15 N O2 | P b c a | 8.874; 13.733; 27.215 90; 90; 90 | 3317 | 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, 2017, 4, 292 |
| 1553607 | CIF | C19 H12 N2 O4 | P -1 | 8.066; 8.242; 12.157 92.727; 102.604; 98.233 | 778 | 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, 2017, 4, 445 |
| 1553608 | CIF | C H F N O | P -1 | 9.4574; 9.9936; 14.0156 89.023; 76.071; 71.074 | 1213.5 | 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, 2017, 4, 938 |
| 1553609 | CIF | C41 H40 O11 | P -1 | 9.7469; 13.1171; 17.5212 70.806; 75.292; 73.524 | 1996.5 | 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, 2017, 4, 578 |
| 1553610 | CIF | C43 H46 O11 | P -1 | 15.1534; 15.8118; 17.7296 68.774; 76.898; 79.352 | 3832 | 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, 2017, 4, 578 |
| 1553611 | CIF | C31 H23 Cl0 N O4 | P 21 21 21 | 9.9046; 10.4946; 23.736 90; 90; 90 | 2467.2 | 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, 2017, 4, 560 |
| 1553612 | CIF | C30 H21 N O3 | P 1 21/n 1 | 9.263; 16.211; 15.413 90; 91.21; 90 | 2313.9 | 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, 2017, 4, 560 |
| 1553613 | CIF | C38.5 H33 Cl O3 | P -1 | 12.3342; 12.422; 20.4886 94.35; 97.642; 100.981 | 3037.8 | 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, 2017, 4, 467 |
| 1553614 | CIF | C13 H12 N2 O | P n a 21 | 9.077; 10.4; 11.75 90; 90; 90 | 1109.2 | 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, 2017, 4, 510 |
| 1553615 | CIF | C23 H19 N O2 S2 | P 21 21 21 | 8.189; 14.782; 17.421 90; 90; 90 | 2108.8 | 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, 2017, 4, 510 |
| 1553616 | CIF | C22 H24 S4 Si2 | P 1 21/c 1 | 10.5479; 16.6; 13.9079 90; 92.242; 90 | 2433.3 | 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, 2017, 4, 1019 |
| 1553617 | CIF | C44 H72 Li4 O4 S4 Si4 | I 41/a :2 | 20.763; 20.763; 13.7545 90; 90; 90 | 5929.6 | 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, 2017, 4, 1019 |
| 1553618 | CIF | C17 H17 N O4 | P -1 | 5.7832; 10.4921; 12.3215 90.576; 97.913; 93.157 | 739.28 | 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, 2017, 4, 455 |
| 1553619 | CIF | C21 H17 F O | P 1 21/c 1 | 13.585; 12.569; 9.741 90; 106.741; 90 | 1592.8 | Cao, Tongxiang; Chen, Kai; Zhu, Shifa An efficient approach to generate aryl carbenes: gold-catalyzed sequential activation of 1,6-diynes Organic Chemistry Frontiers, 2017, 4, 450 |
| 1553620 | CIF | C23 H26 O | P 1 21/c 1 | 12.3103; 20.299; 6.9248 90; 95.884; 90 | 1721.3 | Cao, Tongxiang; Chen, Kai; Zhu, Shifa An efficient approach to generate aryl carbenes: gold-catalyzed sequential activation of 1,6-diynes Organic Chemistry Frontiers, 2017, 4, 450 |
| 1553621 | CIF | C60 H28 F20 N6 O2 | P -1 | 12.4994; 13.1859; 16.0253 102.651; 95.439; 92.29 | 2560.5 | 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, 2017, 4, 534 |
| 1553622 | CIF | C23 H30 N4 O2 Si | P b c a | 15.6516; 14.7041; 20.8303 90; 90; 90 | 4793.9 | 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, 2017, 4, 978 |
| 1553623 | CIF | C20 H21 N5 O2 Si | P -1 | 9.4684; 10.4692; 12.771 96.2634; 95.7478; 113.644 | 1138.27 | 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, 2017, 4, 978 |
| 1553624 | CIF | C14 H8 Br3 N3 | P 1 21/n 1 | 16.2913; 10.0932; 19.7897 90; 112.895; 90 | 2997.7 | 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, 2017, 4, 978 |
| 1553625 | CIF | C21 H34 N4 O2 Si | P b c a | 8.9462; 11.9145; 43.549 90; 90; 90 | 4641.9 | 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, 2017, 4, 978 |
| 1553626 | CIF | C25 H20 O4 | P 1 21/c 1 | 11.9761; 15.4866; 11.0055 90; 106.167; 90 | 1960.46 | Mao, Wenbin; Zhu, Chen Efficient synthesis of multiply substituted butenolides from keto acids and terminal alkynes promoted by combined acids Organic Chemistry Frontiers, 2017, 4, 1029 |
| 1553627 | CIF | C35 H18 Fe O4 | P -1 | 8.8576; 9.515; 15.8743 79.571; 74.479; 86.413 | 1267.66 | Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers, 2017, 4, 699 |
| 1553628 | CIF | C32 H18 O | P 1 21/n 1 | 12.737; 10.827; 15.738 90; 105.708; 90 | 2089.3 | Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers, 2017, 4, 699 |
| 1553629 | CIF | C51 H29 Cl3 O4 | P 21 21 21 | 10.5417; 14.8356; 24.1274 90; 90; 90 | 3773.3 | Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers, 2017, 4, 699 |
| 1553630 | CIF | C51 H30 Cl2 O | P 1 21/n 1 | 12.3541; 20.5251; 15.593 90; 111.562; 90 | 3677.21 | Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers, 2017, 4, 699 |
| 1553631 | CIF | C51 H30 Cl2 | P 1 21/n 1 | 12.2233; 20.4397; 15.612 90; 111.759; 90 | 3622.59 | Cheung, Kwan Yin; Yang, Shuaijun; Miao, Qian From tetrabenzoheptafulvalene to sp2 carbon nano-rings Organic Chemistry Frontiers, 2017, 4, 699 |
| 1553632 | CIF | C20 H19 Br N2 O5 S | P 21 21 21 | 8.8208; 12.857; 18.1141 90; 90; 90 | 2054.3 | 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, 2017, 4, 1336 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!