Crystallography Open Database
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Searching year of publication is 2015
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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1520454 | CIF | C32 H26 N4 O | P 1 21/c 1 | 7.474; 9.2641; 35.865 90; 91.227; 90 | 2482.7 | Matuschek, David; Eusterwiemann, Steffen; Stegemann, Linda; Doerenkamp, Carsten; Wibbeling, Birgit; Daniliuc, Constantin G.; Doltsinis, Nikos L.; Strassert, Cristian A.; Eckert, Hellmut; Studer, Armido Profluorescent verdazyl radicals ‒ synthesis and characterization Chem. Sci., 2015, 6, 4712 |
1520455 | CIF | C36 H28 N4 O | P 1 21/c 1 | 11.2158; 10.0647; 24.8459 90; 97.414; 90 | 2781.25 | Matuschek, David; Eusterwiemann, Steffen; Stegemann, Linda; Doerenkamp, Carsten; Wibbeling, Birgit; Daniliuc, Constantin G.; Doltsinis, Nikos L.; Strassert, Cristian A.; Eckert, Hellmut; Studer, Armido Profluorescent verdazyl radicals ‒ synthesis and characterization Chem. Sci., 2015, 6, 4712 |
1520456 | CIF | C21 H17 Br F3 N O2 | P 21 21 21 | 9.1964; 13.4028; 15.611 90; 90; 90 | 1924.2 | Zhang, Xiao; Liu, Wen-Bo; Tu, Hang-Fei; You, Shu-Li Ligand-enabled Ir-catalyzed intermolecular diastereoselective and enantioselective allylic alkylation of 3-substituted indoles Chem. Sci., 2015, 6, 4525 |
1520484 | CIF | C42 H59 N2 O5 Y | P 1 21/n 1 | 11.5994; 17.3406; 20.277 90; 101.616; 90 | 3995 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520485 | CIF | C42 H59 N2 O5 Yb | P 1 21/n 1 | 11.6286; 17.386; 20.275 90; 101.788; 90 | 4012.6 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520486 | CIF | C42 H55 Cl4 N2 O5 Y | P 1 21/n 1 | 11.801; 20.57; 18.885 90; 104.53; 90 | 4437.6 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520487 | CIF | C45 H55 Cl4 N2 O4 Yb | C 1 2/c 1 | 24.1809; 15.0796; 25.3731 90; 102.719; 90 | 9025 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520488 | CIF | C50 H75 N2 O3 Y | P -1 | 10.5853; 12.7151; 19.2574 89.476; 76.593; 74.104 | 2420.77 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520489 | CIF | C36 H43 Cl4 N2 O4 Yb | P -1 | 11.1518; 14.3086; 14.3249 110.668; 112.05; 101.601 | 1829.7 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520490 | CIF | C101 H141 N4 O6 Y2 | P -1 | 15.7733; 17.1095; 20.0984 93.832; 99.873; 110.235 | 4967 | Gu, Weikai; Xu, Pengfei; Wang, Yaorong; Yao, Yingming; Yuan, Dan; Shen, Qi Synthesis and Characterization of Yttrium and Ytterbium Complexes Supported by Salen Ligands and Their Catalytic Properties forrac-Lactide Polymerization Organometallics, 2015, 34, 2907 |
1520491 | CIF | C60 H74 N4 O4 | P -1 | 11.2497; 12.373; 20.0241 95.185; 106.067; 94.622 | 2651.1 | Xia, Debin; Marszalek, Tomasz; Li, Mengmeng; Guo, Xin; Baumgarten, Martin; Pisula, Wojciech; Müllen, Klaus Solution-Processable n-Type Organic Semiconductors Based on Angular-Shaped 2-(12H-Dibenzofluoren-12-ylidene)malononitrilediimide. Organic letters, 2015, 17, 3074-3077 |
1520492 | CIF | C13 H10 Cl N3 O2 | P b c a | 7.24; 11.439; 29.79 90; 90; 90 | 2467 | Xia, Guomin; Ruan, Chengyan; Wang, Hongming Highly sensitive detection of carbon dioxide by a pyrimido[1,2-a]benzimidazole derivative: combining experimental and theoretical studies. The Analyst, 2015, 140, 5099-5104 |
1520493 | CIF | C30 H26 Co F6 N6 O7 S2 | P -1 | 11.0341; 12.5779; 13.0044 82.865; 88.796; 66.687 | 1643.85 | Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J. Bioinspired design of redox-active ligands for multielectron catalysis: effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water Chem. Sci., 2015, 6, 4954 |
1520494 | CIF | C29 H35 F6 N7 O12 S2 Zn | P 1 21/n 1 | 13.0156; 12.7488; 22.3963 90; 92.294; 90 | 3713.3 | Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J. Bioinspired design of redox-active ligands for multielectron catalysis: effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water Chem. Sci., 2015, 6, 4954 |
1520495 | CIF | C36 H42 Co F6 N6 O11 S2 | P 1 21/n 1 | 12.4657; 15.6171; 21.316 90; 91.047; 90 | 4149.1 | Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J. Bioinspired design of redox-active ligands for multielectron catalysis: effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water Chem. Sci., 2015, 6, 4954 |
1520496 | CIF | C30 H30 F6 N6 O11 S2 Zn | P -1 | 14.707; 21.388; 25.657 67.683; 75.282; 89.683 | 7184 | Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J. Bioinspired design of redox-active ligands for multielectron catalysis: effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water Chem. Sci., 2015, 6, 4954 |
1520497 | CIF | C30 H32.5 F6 N6 O10 S2 Zn | P -1 | 11.0677; 13.3087; 13.5558 71.591; 78.668; 67.235 | 1740.65 | Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J. Bioinspired design of redox-active ligands for multielectron catalysis: effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water Chem. Sci., 2015, 6, 4954 |
1520498 | CIF | C29 H27.5 Co F6 N7 O9.25 S2 | P -1 | 13.2461; 20.9848; 26.9609 111.361; 96.713; 94.455 | 6872.7 | Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J. Bioinspired design of redox-active ligands for multielectron catalysis: effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water Chem. Sci., 2015, 6, 4954 |
1520499 | CIF | C37.35 H42.46 Cl2 N6 O3.88 Ru | P -1 | 10.4996; 13.3012; 13.4802 80.434; 82.981; 86.221 | 1840.52 | Tong, Lianpeng; Zong, Ruifa; Zhou, Rongwei; Kaveevivitchai, Nattawut; Zhang, Gang; Thummel, Randolph P. Ruthenium catalysts for water oxidation involving tetradentate polypyridine-type ligands. Faraday discussions, 2015, 185, 87-104 |
1520502 | CIF | C37 H20 F4 N4 O4 | P 1 21/c 1 | 22.674; 10.0584; 13.4593 90; 99.514; 90 | 3027.4 | Zhang, Jian; Jin, Jianyong; Cooney, Ralph; Fu, Qiang; Qiao, Greg G.; Thomas, Sylvie; Merkel, Tim C. Synthesis of perfectly alternating copolymers for polymers of intrinsic microporosity Polym. Chem., 2015, 6, 5003 |
1520504 | CIF | C20 H16 I N O | P -1 | 10.699; 11.726; 22.2683 94.284; 101.795; 109.369 | 2549 | Wang, Jia; Zhu, Hai-Tao; Qiu, Yi-Feng; Niu, Yuan; Chen, Si; Li, Ying-Xiu; Liu, Xue-Yuan; Liang, Yong-Min Facile Synthesis of Carbazoles via a Tandem Iodocyclization with 1,2-Alkyl Migration and Aromatization. Organic letters, 2015, 17, 3186-3189 |
1520505 | CIF | C20 H16 I N O | P b c a | 7.2355; 20.9295; 23.0167 90; 90; 90 | 3485.5 | Wang, Jia; Zhu, Hai-Tao; Qiu, Yi-Feng; Niu, Yuan; Chen, Si; Li, Ying-Xiu; Liu, Xue-Yuan; Liang, Yong-Min Facile Synthesis of Carbazoles via a Tandem Iodocyclization with 1,2-Alkyl Migration and Aromatization. Organic letters, 2015, 17, 3186-3189 |
1520506 | CIF | C30 H24 Cl4 N2 O2 Zn | C 1 2/c 1 | 21.692; 4.8468; 28.611 90; 111.442; 90 | 2799.9 | Men, Guangwen; Chen, Chunrong; Liang, Chunshuang; Han, Wenkun; Jiang, Shimei A novel cascade strategy with supramolecular and chemodosimetric methods for designing a fluorescent ratiometric detector hypersensitive to trace water. The Analyst, 2015, 140, 5454-5458 |
1520507 | CIF | C42 H86 N4 O6 | P -1 | 4.7746; 5.4698; 44.772 91.162; 91.821; 96.985 | 1159.66 | Zhong, Di-Chang; Liao, Lie-Qiang; Wang, Ke-Jun; Liu, Hui-Jin; Luo, Xu-Zhong Heat-set gels formed from easily accessible gelators of a succinamic acid derivative (SAD) and a primary alkyl amine (R-NH2). Soft matter, 2015, 11, 6386-6392 |
1520513 | CIF | C24 H24 | P 1 21/n 1 | 7.4014; 30.606; 7.739 90; 100.806; 90 | 1722 | Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju Synthesis of Substituted Benzenes via Bi(OTf)3-Mediated Intramolecular Carbonyl Allylation of α-Prenyl or α-Geranyl β-Arylketosulfones. Organic letters, 2015, 17, 3142-3145 |
1520514 | CIF | C20 H24 O4 S | P 1 n 1 | 11.2988; 5.7063; 14.045 90; 102.129; 90 | 885.3 | Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju Synthesis of Substituted Benzenes via Bi(OTf)3-Mediated Intramolecular Carbonyl Allylation of α-Prenyl or α-Geranyl β-Arylketosulfones. Organic letters, 2015, 17, 3142-3145 |
1520515 | CIF | C25 H29 N O5 S | F d d 2 | 22.419; 52.094; 7.523 90; 90; 90 | 8786 | Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju Synthesis of Substituted Benzenes via Bi(OTf)3-Mediated Intramolecular Carbonyl Allylation of α-Prenyl or α-Geranyl β-Arylketosulfones. Organic letters, 2015, 17, 3142-3145 |
1520516 | CIF | C25 H29 N O5 S | C 1 2/c 1 | 30.166; 11.6914; 14.2065 90; 113.297; 90 | 4601.9 | Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju Synthesis of Substituted Benzenes via Bi(OTf)3-Mediated Intramolecular Carbonyl Allylation of α-Prenyl or α-Geranyl β-Arylketosulfones. Organic letters, 2015, 17, 3142-3145 |
1520517 | CIF | C19 H19 F O | P 21 21 21 | 8.4903; 9.6656; 18.663 90; 90; 90 | 1531.6 | Chang, Meng-Yang; Cheng, Yu-Chieh; Lu, Yi-Ju Synthesis of Substituted Benzenes via Bi(OTf)3-Mediated Intramolecular Carbonyl Allylation of α-Prenyl or α-Geranyl β-Arylketosulfones. Organic letters, 2015, 17, 3142-3145 |
1520518 | CIF | C43 H41 N3 O4 | P 1 21/c 1 | 31.617; 15.428; 14.478 90; 101.899; 90 | 6910 | Zhang, Feng-Lian; Zhu, Xu; Chiba, Shunsuke Tf~2~NH-Catalyzed Amide Synthesis from Vinyl Azides and Alcohols Organic Letters, 2015, 17, 3138-3141 |
1520519 | CIF | C13 H12 Cl N O4 | P 21 21 21 | 7.9023; 12.49; 12.9 90; 90; 90 | 1273.2 | Sekikawa, Tohru; Kitaguchi, Takayuki; Kitaura, Hayato; Minami, Tatsuya; Hatanaka, Yasuo Catalytic Activity of epi-Quinine-Derived 3,5-Bis(trifluoromethyl)benzamide in Asymmetric Nitro-Michael Reaction of Furanones. Organic letters, 2015, 17, 3026-3029 |
1520520 | CIF | C39 H40 B F2 N3 O4 | P -1 | 8.745; 10.225; 20.19 89.48; 86.38; 65.669 | 1641.4 | Hiruta, Yuki; Koiso, Hikaru; Ozawa, Hitoshi; Sato, Hiroyasu; Hamada, Kensaku; Yabushita, Satoshi; Citterio, Daniel; Suzuki, Koji Near IR Emitting Red-Shifting Ratiometric Fluorophores Based on Borondipyrromethene. Organic letters, 2015, 17, 3022-3025 |
1520521 | CIF | C37.5 H36.5 B Cl1.5 F2 N3 O4 | P -1 | 8.776; 10.567; 19.225 84.193; 82.204; 69.585 | 1652.6 | Hiruta, Yuki; Koiso, Hikaru; Ozawa, Hitoshi; Sato, Hiroyasu; Hamada, Kensaku; Yabushita, Satoshi; Citterio, Daniel; Suzuki, Koji Near IR Emitting Red-Shifting Ratiometric Fluorophores Based on Borondipyrromethene. Organic letters, 2015, 17, 3022-3025 |
1520522 | CIF | C46 H44 B2 N2 O2 | P 1 21/c 1 | 7.274; 17.864; 15.322 90; 100.332; 90 | 1958.7 | Kubota, Yasuhiro; Niwa, Takahiro; Jin, Jiye; Funabiki, Kazumasa; Matsui, Masaki Synthesis, Absorption, and Electrochemical Properties of Quinoid-Type Bisboron Complexes with Highly Symmetrical Structures. Organic letters, 2015, 17, 3174-3177 |
1520523 | CIF | C42 H36 B2 N2 O2 | P 1 21/c 1 | 7.054; 17.672; 13.751 90; 96.406; 90 | 1703.5 | Kubota, Yasuhiro; Niwa, Takahiro; Jin, Jiye; Funabiki, Kazumasa; Matsui, Masaki Synthesis, Absorption, and Electrochemical Properties of Quinoid-Type Bisboron Complexes with Highly Symmetrical Structures. Organic letters, 2015, 17, 3174-3177 |
1520524 | CIF | C53 H69 N6 O25 P2 Ru | P n n a | 21.3561; 19.4016; 14.9635 90; 90; 90 | 6200.01 | Fielden, John; Sumliner, Jordan M.; Han, Nannan; Geletii, Yurii V.; Xiang, Xu; Musaev, Djamaladdin G.; Lian, Tianquan; Hill, Craig L. Water splitting with polyoxometalate-treated photoanodes: enhancing performance through sensitizer design Chem. Sci., 2015, 6, 5531 |
1520525 | CIF | C34 H20 Co2 N2 O8 | P -1 | 12.956; 13.122; 13.752 84.973; 67.595; 83.245 | 2144.1 | Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci., 2015, 6, 4986 |
1520526 | CIF | C17 H10 Co N O4 | P -1 | 7.7116; 10.2889; 11.0085 71.43; 86.282; 82.265 | 820.22 | Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci., 2015, 6, 4986 |
1520527 | CIF | C34 H20 Co2 N2 O8 | P -1 | 12.9698; 13.1304; 13.7579 85.041; 68.014; 83.544 | 2156.3 | Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci., 2015, 6, 4986 |
1520528 | CIF | C17 H10 Co N O4 | P -1 | 7.6397; 10.4311; 10.9968 71.121; 87.061; 83.361 | 823.5 | Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci., 2015, 6, 4986 |
1520529 | CIF | C51 H30 Co3 N3 O12 | C 1 2 1 | 17.173; 19.784; 13.887 90; 95.771; 90 | 4694 | Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci., 2015, 6, 4986 |
1520530 | CIF | C51 H30 Co3 N3 O12 | C 1 2 1 | 17.0391; 20.0278; 13.8334 90; 96.243; 90 | 4692.7 | Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci., 2015, 6, 4986 |
1520531 | CIF | C13 H8 Br Mn N2 O5 | P 1 21/c 1 | 15.1341; 13.1528; 7.0537 90; 98.591; 90 | 1388.33 | Walsh, James J.; Smith, Charlotte L.; Neri, Gaia; Whitehead, George F. S.; Robertson, Craig M.; Cowan, Alexander J. FDCDU15 - Carbon Dioxide Utilisation: Improving the efficiency of electrochemical CO2 reduction using immobilized manganese complexes Faraday Discuss., 2015 |
1520532 | CIF | C23 H26 Br Mn N2 O10 | P -1 | 6.52291; 13.1864; 16.0537 102.912; 95.846; 98.607 | 1317.59 | Walsh, James J.; Smith, Charlotte L.; Neri, Gaia; Whitehead, George F. S.; Robertson, Craig M.; Cowan, Alexander J. FDCDU15 - Carbon Dioxide Utilisation: Improving the efficiency of electrochemical CO2 reduction using immobilized manganese complexes Faraday Discuss., 2015 |
1520533 | CIF | C15 H16 O2 | P -1 | 7.5962; 8.0111; 10.4017 111.355; 93.168; 90.2112 | 588.43 | Park, Jung-Woo; Kou, Kevin G. M.; Kim, Daniel K.; Dong, Vy M. Rh-Catalyzed Desymmetrization of α-Quaternary Centers by Isomerization-Hydroacylation. Chemical science (Royal Society of Chemistry : 2010), 2015, 6, 4479-4483 |
1520534 | CIF | C20 H20 N4 O4 | P 1 | 7.9466; 14.9541; 16.2556 78.9198; 79.5663; 82.7612 | 1856 | Park, Jung-Woo; Kou, Kevin G. M.; Kim, Daniel K.; Dong, Vy M. Rh-Catalyzed Desymmetrization of α-Quaternary Centers by Isomerization-Hydroacylation. Chemical science (Royal Society of Chemistry : 2010), 2015, 6, 4479-4483 |
1520535 | CIF | C41 H46 N4 S2 | C 1 2/c 1 | 24.1082; 18.137; 16.7624 90; 106.002; 90 | 7045.4 | Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L. Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation Chem. Sci., 2015, 6, 5144 |
1520536 | CIF | C65 H64 B2 N4 S2 | I 41/a :2 | 41.594; 41.594; 13.1413 90; 90; 90 | 22735.2 | Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L. Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation Chem. Sci., 2015, 6, 5144 |
1520537 | CIF | C71 H56 B2 F20 N4 O2 S2 | P 1 21/c 1 | 14.5445; 22.7136; 19.7133 90; 98.039; 90 | 6448.4 | Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L. Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation Chem. Sci., 2015, 6, 5144 |
1520538 | CIF | C42 H49 B N2 S3 | P -1 | 6.3487; 16.1168; 19.3671 74.649; 85.857; 83.373 | 1896.4 | Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L. Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation Chem. Sci., 2015, 6, 5144 |
1520539 | CIF | C32 H45 B N2 S3 | P -1 | 6.524; 13.6675; 18.0034 98.64; 95.792; 101.67 | 1539.9 | Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L. Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation Chem. Sci., 2015, 6, 5144 |
1520540 | CIF | C30 H39 B Br2 N2 S3 | P -1 | 10.2773; 12.1331; 14.8059 65.908; 79.793; 68.09 | 1563 | Crossley, D. L.; Cade, I. A.; Clark, E. R.; Escande, A.; Humphries, M. J.; King, S. M.; Vitorica-Yrezabal, I.; Ingleson, M. J.; Turner, M. L. Enhancing electron affinity and tuning band gap in donor‒acceptor organic semiconductors by benzothiadiazole directed C‒H borylation Chem. Sci., 2015, 6, 5144 |
1520542 | CIF | C32 H25 N O4 | P 1 21 1 | 6.62144; 20.1343; 9.362 90; 100.915; 90 | 1225.54 | Zhao, Shuai; Zhao, Yuan-Yuan; Lin, Jun-Bing; Xie, Ting; Liang, Yong-Min; Xu, Peng-Fei Organocatalyzed Asymmetric Vinylogous Allylic-Allylic Alkylation of Morita-Baylis-Hillman Carbonates with Olefinic Azlactones: Facile Access to Chiral Multifunctional α-Amino Acid Derivatives. Organic letters, 2015, 17, 3206-3209 |
1520543 | CIF | C25 H20 Au Br F3 P | P 21 21 21 | 8.3781; 14.3827; 19.3153 90; 90; 90 | 2327.49 | Martínez-Salvador, Sonia; Falvello, Larry R.; Martín, Antonio; Menjón, Babil A hexanuclear gold carbonyl cluster Chem. Sci., 2015, 6, 5506 |
1520544 | CIF | C27 H22 Au2 Br Cl2 F6 P | P 1 21/n 1 | 11.2208; 16.168; 17.031 90; 108.049; 90 | 2937.7 | Martínez-Salvador, Sonia; Falvello, Larry R.; Martín, Antonio; Menjón, Babil A hexanuclear gold carbonyl cluster Chem. Sci., 2015, 6, 5506 |
1520545 | CIF | C56 H40 Au6 Br2 F18 O2 P2 | C 1 2/m 1 | 11.61; 23.9064; 11.1568 90; 97.975; 90 | 3066.66 | Martínez-Salvador, Sonia; Falvello, Larry R.; Martín, Antonio; Menjón, Babil A hexanuclear gold carbonyl cluster Chem. Sci., 2015, 6, 5506 |
1520546 | CIF | S3 Ti | P 1 21/m 1 | 4.9476; 3.3787; 8.7479 90; 97.617; 90 | 144.944 | Lipatov, Alexey; Wilson, Peter M.; Shekhirev, Mikhail; Teeter, Jacob D.; Netusil, Ross; Sinitskii, Alexander Few-layered titanium trisulfide (TiS3) field-effect transistors. Nanoscale, 2015, 7, 12291-12296 |
1520547 | CIF | C25 H24 S | P -1 | 9.4128; 9.6074; 12.0794 97.999; 97.992; 108.357 | 1007.08 | Zhang, Hang; Wang, Bo; Yi, Heng; Zhang, Yan; Wang, Jianbo Rh(II)-Catalyzed [2,3]-Sigmatropic Rearrangement of Sulfur Ylides Derived from Cyclopropenes and Sulfides. Organic letters, 2015, 17, 3322-3325 |
1520552 | CIF | C36 H22 N12 | P 1 21/n 1 | 15.3809; 11.5149; 17.7975 90; 90.677; 90 | 3151.9 | Saltsman, Irena; Goldberg, Israel; Gross, Zeev Porphyrins and Corroles with 2,6-Pyrimidyl Substituents. Organic letters, 2015, 17, 3214-3217 |
1520553 | CIF | C35 H19 F4 N6 O2 P | I b a 2 | 21.689; 29.869; 10.7143 90; 90; 90 | 6941 | Saltsman, Irena; Goldberg, Israel; Gross, Zeev Porphyrins and Corroles with 2,6-Pyrimidyl Substituents. Organic letters, 2015, 17, 3214-3217 |
1520554 | CIF | C51 H33 Co F4 N8 | P 1 21/c 1 | 12.3996; 15.4999; 21.5037 90; 97.248; 90 | 4099.8 | Saltsman, Irena; Goldberg, Israel; Gross, Zeev Porphyrins and Corroles with 2,6-Pyrimidyl Substituents. Organic letters, 2015, 17, 3214-3217 |
1520555 | CIF | C24 H20 Br2 N2 | C 1 2/c 1 | 16.3504; 14.9527; 9.2389 90; 92.387; 90 | 2256.8 | Laird, Rebecca C.; Sinnwell, Michael A.; Nguyen, Nam P.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via Coordination-Driven Self-Assembly. Organic letters, 2015, 17, 3233-3235 |
1520556 | CIF | C24 H18 N2 | P -1 | 9.4274; 12.3411; 15.5934 83.302; 82.714; 79.24 | 1759.9 | Laird, Rebecca C.; Sinnwell, Michael A.; Nguyen, Nam P.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via Coordination-Driven Self-Assembly. Organic letters, 2015, 17, 3233-3235 |
1520557 | CIF | C62 H50 Ag2 N4 O6 S2 | P 1 21/c 1 | 14.33; 10.8862; 17.8919 90; 110.048; 90 | 2622 | Laird, Rebecca C.; Sinnwell, Michael A.; Nguyen, Nam P.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via Coordination-Driven Self-Assembly. Organic letters, 2015, 17, 3233-3235 |
1520558 | CIF | C50 H36 Ag2 F6 N4 O6 S2 | P -1 | 10.3809; 10.9748; 11.0438 109.43; 98.185; 97.328 | 1153.7 | Laird, Rebecca C.; Sinnwell, Michael A.; Nguyen, Nam P.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via Coordination-Driven Self-Assembly. Organic letters, 2015, 17, 3233-3235 |
1520559 | CIF | C50 H36 Ag2 F6 N4 O6 S2 | P -1 | 10.4495; 11.0503; 11.0576 109.671; 96.586; 97.962 | 1172.8 | Laird, Rebecca C.; Sinnwell, Michael A.; Nguyen, Nam P.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via Coordination-Driven Self-Assembly. Organic letters, 2015, 17, 3233-3235 |
1520560 | CIF | C62 H50 Ag2 N4 O6 S2 | P 1 21/c 1 | 14.369; 10.925; 18.106 90; 110.574; 90 | 2661 | Laird, Rebecca C.; Sinnwell, Michael A.; Nguyen, Nam P.; Swenson, Dale C.; Mariappan, S. V. Santhana; MacGillivray, Leonard R. Intramolecular [2 + 2] Photodimerization Achieved in the Solid State via Coordination-Driven Self-Assembly. Organic letters, 2015, 17, 3233-3235 |
1520561 | CIF | C51 H58 F6 O14 S2 | P -1 | 11.2709; 11.7647; 20.1194 88.271; 83.035; 86.352 | 2642.1 | Han, Jie; Hou, Xisen; Ke, Chenfeng; Zhang, Huacheng; Strutt, Nathan L.; Stern, Charlotte L.; Stoddart, J. Fraser Activation-Enabled Syntheses of Functionalized Pillar[5]arene Derivatives. Organic letters, 2015, 17, 3260-3263 |
1520562 | CIF | C46 H46 Cl2 F6 O14 S2 | P 1 n 1 | 11.616; 18.2419; 11.617 90; 94.1589; 90 | 2455.14 | Han, Jie; Hou, Xisen; Ke, Chenfeng; Zhang, Huacheng; Strutt, Nathan L.; Stern, Charlotte L.; Stoddart, J. Fraser Activation-Enabled Syntheses of Functionalized Pillar[5]arene Derivatives. Organic letters, 2015, 17, 3260-3263 |
1520563 | CIF | C48.75 H55.04 Cl2.25 F3 O12 S | P n a 21 | 35.9931; 12.0648; 11.369 90; 90; 90 | 4937 | Han, Jie; Hou, Xisen; Ke, Chenfeng; Zhang, Huacheng; Strutt, Nathan L.; Stern, Charlotte L.; Stoddart, J. Fraser Activation-Enabled Syntheses of Functionalized Pillar[5]arene Derivatives. Organic letters, 2015, 17, 3260-3263 |
1520564 | CIF | C51 H58 F6 O14 S2 | P 21 21 21 | 11.3045; 12.1357; 37.187 90; 90; 90 | 5101.6 | Han, Jie; Hou, Xisen; Ke, Chenfeng; Zhang, Huacheng; Strutt, Nathan L.; Stern, Charlotte L.; Stoddart, J. Fraser Activation-Enabled Syntheses of Functionalized Pillar[5]arene Derivatives. Organic letters, 2015, 17, 3260-3263 |
1520565 | CIF | C51 H55 F9 O16 S3 | P 1 21/c 1 | 22.0373; 11.9982; 22.7155 90; 110.288; 90 | 5633.5 | Han, Jie; Hou, Xisen; Ke, Chenfeng; Zhang, Huacheng; Strutt, Nathan L.; Stern, Charlotte L.; Stoddart, J. Fraser Activation-Enabled Syntheses of Functionalized Pillar[5]arene Derivatives. Organic letters, 2015, 17, 3260-3263 |
1520566 | CIF | C51 H55 F9 O16 S3 | P b c a | 20.6289; 22.2856; 24.1696 90; 90; 90 | 11111.4 | Han, Jie; Hou, Xisen; Ke, Chenfeng; Zhang, Huacheng; Strutt, Nathan L.; Stern, Charlotte L.; Stoddart, J. Fraser Activation-Enabled Syntheses of Functionalized Pillar[5]arene Derivatives. Organic letters, 2015, 17, 3260-3263 |
1520572 | CIF | C43 H56 O19 | P -1 | 8.6734; 11.1397; 11.8133 92.575; 96.635; 108.711 | 1069.74 | Lai, Yongji; Liu, Tingting; Sa, Rongjian; Wei, Xialan; Xue, Yongbo; Wu, Zhaodi; Luo, Zengwei; Xiang, Ming; Zhang, Yonghui; Yao, Guangmin Neolignans with a Rare 2-Oxaspiro[4.5]deca-6,9-dien-8-one Motif from the Stem Bark of Cinnamomum subavenium. Journal of natural products, 2015, 78, 1740-1744 |
1520573 | CIF | C17 H15 N S | P 21 21 21 | 6.1669; 12.182; 17.8605 90; 90; 90 | 1341.77 | Hardegger, Leo A.; Habegger, Jacqueline; Donohoe, Timothy J. Modular Synthesis of Highly Substituted Pyridines via Enolate α-Alkenylation. Organic letters, 2015, 17, 3222-3225 |
1520574 | CIF | C19 H17 N O | P b c a | 7.4565; 18.3137; 20.6855 90; 90; 90 | 2824.73 | Hardegger, Leo A.; Habegger, Jacqueline; Donohoe, Timothy J. Modular Synthesis of Highly Substituted Pyridines via Enolate α-Alkenylation. Organic letters, 2015, 17, 3222-3225 |
1520575 | CIF | C16 H15 N3 | P 1 21/m 1 | 9.7773; 6.90436; 9.79548 90; 98.985; 90 | 653.14 | Castillo, Juan-Carlos; Quiroga, Jairo; Abonia, Rodrigo; Rodriguez, Jean; Coquerel, Yoann The Aryne aza-Diels-Alder Reaction: Flexible Syntheses of Isoquinolines. Organic letters, 2015, 17, 3374-3377 |
1520576 | CIF | C21 H15 N3 | P 1 21/c 1 | 14.0946; 11.4421; 9.74761 90; 99.2056; 90 | 1551.77 | Castillo, Juan-Carlos; Quiroga, Jairo; Abonia, Rodrigo; Rodriguez, Jean; Coquerel, Yoann The Aryne aza-Diels-Alder Reaction: Flexible Syntheses of Isoquinolines. Organic letters, 2015, 17, 3374-3377 |
1520577 | CIF | C20 H20 O6 | P 21 21 21 | 10.1756; 12.2477; 13.4918 90; 90; 90 | 1681.45 | Bautista, Elihú; Fragoso-Serrano, Mabel; Toscano, Rubén A; García-Peña, María Del Rosario; Ortega, Alfredo Teotihuacanin, a Diterpene with an Unusual Spiro-10/6 System from Salvia amarissima with Potent Modulatory Activity of Multidrug Resistance in Cancer Cells. Organic letters, 2015, 17, 3280-3282 |
1520578 | CIF | C56 H57 Cu3 N38 O22.5 | P -1 | 14.1016; 14.4022; 20.4554 94.939; 95.386; 119.157 | 3570.2 | Palomas, David; Kalamaras, Christos; Haycock, Peter; White, Andrew J. P.; Hellgardt, Klaus; Horton, Andrew; Crimmin, Mark R. Re-evaluating selectivity as a determining factor in peroxidative methane oxidation by multimetallic copper complexes Catal. Sci. Technol., 2015, 5, 4108 |
1520579 | CIF | C24 H52 B6 Cu4 F8 N4 O17 | C 1 2/c 1 | 14.4651; 19.3815; 14.1054 90; 90.991; 90 | 3953.9 | Palomas, David; Kalamaras, Christos; Haycock, Peter; White, Andrew J. P.; Hellgardt, Klaus; Horton, Andrew; Crimmin, Mark R. Re-evaluating selectivity as a determining factor in peroxidative methane oxidation by multimetallic copper complexes Catal. Sci. Technol., 2015, 5, 4108 |
1520580 | CIF | C84 H118 Al3 N6 O6 | P 1 21/n 1 | 13.8521; 24.7127; 22.886 90; 93.263; 90 | 7821.7 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520581 | CIF | C27 H37 Al N2 O2 | P 1 21 1 | 9.9462; 10.3018; 12.8708 90; 108.547; 90 | 1250.3 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520582 | CIF | C29 H41 Al N2 O3 | P 21 21 21 | 8.0191; 13.4769; 25.379 90; 90; 90 | 2742.77 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520583 | CIF | C41 H65 Al N2 O3 | P 1 21/c 1 | 16.6845; 19.6643; 12.0401 90; 99.106; 90 | 3900.4 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520584 | CIF | C32 H48 Hf N2 O4 | P 1 21/c 1 | 14.0484; 13.4118; 16.8344 90; 101.404; 90 | 3109.22 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520585 | CIF | C32 H48 Hf N2 O4 | P 43 | 10.3884; 10.3884; 28.732 90; 90; 90 | 3100.72 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520586 | CIF | C32 H48 Hf N2 O4 | P 41 | 10.39461; 10.39461; 28.7569 90; 90; 90 | 3107.12 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520587 | CIF | C31 H45.67 Al N2 O3 | P a -3 | 26.2561; 26.2561; 26.2561 90; 90; 90 | 18100.5 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520588 | CIF | C32 H48 N2 O4 Ti | P 1 21/c 1 | 13.7916; 12.9946; 17.548 90; 102.79; 90 | 3066.86 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
1520589 | CIF | C45 H70 Th | P 1 c 1 | 12.658; 10.48; 18.889 90; 127; 90 | 2001 | Fang, Bo; Zhang, Lei; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. C‒H bond activation induced by thorium metallacyclopropene complexes: a combined experimental and computational study Chem. Sci., 2015, 6, 4897 |
1520590 | CIF | C48 H74 Th | P 1 21/n 1 | 10.699; 26.148; 17.831 90; 98.273; 90 | 4936 | Fang, Bo; Zhang, Lei; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. C‒H bond activation induced by thorium metallacyclopropene complexes: a combined experimental and computational study Chem. Sci., 2015, 6, 4897 |
1520591 | CIF | C49 H72 Th | P -1 | 10.468; 11.297; 18.569 80.098; 82.085; 78.986 | 2110.8 | Fang, Bo; Zhang, Lei; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. C‒H bond activation induced by thorium metallacyclopropene complexes: a combined experimental and computational study Chem. Sci., 2015, 6, 4897 |
1520592 | CIF | C53 H73 N Th | P -1 | 11.109; 21.888; 21.958 97.052; 90.196; 90.925 | 5298 | Fang, Bo; Zhang, Lei; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. C‒H bond activation induced by thorium metallacyclopropene complexes: a combined experimental and computational study Chem. Sci., 2015, 6, 4897 |
1520593 | CIF | C53 H73 N O Th | P 1 21/c 1 | 15.278; 12.306; 25.718 90; 90.308; 90 | 4835.2 | Fang, Bo; Zhang, Lei; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. C‒H bond activation induced by thorium metallacyclopropene complexes: a combined experimental and computational study Chem. Sci., 2015, 6, 4897 |
1520594 | CIF | C52 H77 N O Th | P -1 | 10.9616; 11.0914; 20.157 77.206; 84.115; 75.93 | 2315.1 | Fang, Bo; Zhang, Lei; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. C‒H bond activation induced by thorium metallacyclopropene complexes: a combined experimental and computational study Chem. Sci., 2015, 6, 4897 |
1520595 | CIF | C15 H20 N2 O3 | P 1 21 1 | 7.9384; 7.0246; 12.9394 90; 98.464; 90 | 713.7 | Mercado-Marin, Eduardo V; Sarpong, Richmond Unified Approach to Prenylated Indole Alkaloids: Total Syntheses of (-)-17-Hydroxy-Citrinalin B, (+)-Stephacidin A, and (+)-Notoamide I. Chemical science (Royal Society of Chemistry : 2010), 2015, 6, 5048-5052 |
1520596 | CIF | C26 H29 N3 O3 | P 21 21 21 | 8.7961; 9.7026; 35.0914 90; 90; 90 | 2994.9 | Mercado-Marin, Eduardo V; Sarpong, Richmond Unified Approach to Prenylated Indole Alkaloids: Total Syntheses of (-)-17-Hydroxy-Citrinalin B, (+)-Stephacidin A, and (+)-Notoamide I. Chemical science (Royal Society of Chemistry : 2010), 2015, 6, 5048-5052 |
1520597 | CIF | C16 H12 Cl N O | P 21 21 21 | 9.3918; 13.5329; 51.624 90; 90; 90 | 6561.3 | Pedroni, J.; Saget, T.; Donets, P. A.; Cramer, N. Enantioselective palladium(0)-catalyzed intramolecular cyclopropane functionalization: access to dihydroquinolones, dihydroisoquinolones and the BMS-791325 ring system Chem. Sci., 2015, 6, 5164 |
1520598 | CIF | C40 H62 N2 Si2 | P -1 | 9.4109; 10.1841; 11.6538 91.036; 102.694; 116.006 | 970.92 | Chandra Mondal, Kartik; Roy, Sudipta; Dittrich, Birger; Maity, Bholanath; Dutta, Sayan; Koley, Debasis; Vasa, Suresh Kumar; Linser, Rasmus; Dechert, Sebastian; Roesky, Herbert W. A soluble molecular variant of the semiconducting silicondiselenide Chem. Sci., 2015, 6, 5230 |
1520599 | CIF | C20 H31 N O | P 1 21/n 1 | 9.269; 17.342; 11.775 90; 96.71; 90 | 1880 | Chandra Mondal, Kartik; Roy, Sudipta; Dittrich, Birger; Maity, Bholanath; Dutta, Sayan; Koley, Debasis; Vasa, Suresh Kumar; Linser, Rasmus; Dechert, Sebastian; Roesky, Herbert W. A soluble molecular variant of the semiconducting silicondiselenide Chem. Sci., 2015, 6, 5230 |
1520600 | CIF | C46 H70 N2 Si2 | P -1 | 12.8; 13.86; 14.36 66.45; 79.9; 67.84 | 2162 | Chandra Mondal, Kartik; Roy, Sudipta; Dittrich, Birger; Maity, Bholanath; Dutta, Sayan; Koley, Debasis; Vasa, Suresh Kumar; Linser, Rasmus; Dechert, Sebastian; Roesky, Herbert W. A soluble molecular variant of the semiconducting silicondiselenide Chem. Sci., 2015, 6, 5230 |
1520601 | CIF | C46 H70 N2 Si2 | P -1 | 12.79; 13.783; 14.433 66.35; 79.58; 67.48 | 2152 | Chandra Mondal, Kartik; Roy, Sudipta; Dittrich, Birger; Maity, Bholanath; Dutta, Sayan; Koley, Debasis; Vasa, Suresh Kumar; Linser, Rasmus; Dechert, Sebastian; Roesky, Herbert W. A soluble molecular variant of the semiconducting silicondiselenide Chem. Sci., 2015, 6, 5230 |
1520602 | CIF | C24 H39 N O Se2 Si | P 1 21/n 1 | 14.6952; 10.08; 17.7472 90; 109.567; 90 | 2477.04 | Chandra Mondal, Kartik; Roy, Sudipta; Dittrich, Birger; Maity, Bholanath; Dutta, Sayan; Koley, Debasis; Vasa, Suresh Kumar; Linser, Rasmus; Dechert, Sebastian; Roesky, Herbert W. A soluble molecular variant of the semiconducting silicondiselenide Chem. Sci., 2015, 6, 5230 |
1520611 | CIF | C22 H23 F N6 O5 | P 1 21/c 1 | 13.8135; 13.3386; 14.0876 90; 114.496; 90 | 2362.04 | Tsou, Nancy; Shultz, C. Scott; Andreani, Teresa; Ball, Richard G.; Brunskill, Andrew; Balsells, Jaume; Cohen, Ryan D.; DaSilva, Jimmy; Li, Jing; Reamer, Robert A.; de Lera Ruiz, Manuel; Variankaval, Narayan; Varsolona, Richard J.; Yasuda, Nobuyoshi; York, Gregory Careful Navigation of the Crystallographic Landscape of MK-8970: A Racemic Acetal Carbonate Prodrug of Raltegravir Organic Process Research & Development, 2015, 19, 1882 |
1520612 | CIF | C25 H29 F N6 O8 | P 21 21 21 | 9.4933; 11.2461; 24.486 90; 90; 90 | 2614.2 | Tsou, Nancy; Shultz, C. Scott; Andreani, Teresa; Ball, Richard G.; Brunskill, Andrew; Balsells, Jaume; Cohen, Ryan D.; DaSilva, Jimmy; Li, Jing; Reamer, Robert A.; de Lera Ruiz, Manuel; Variankaval, Narayan; Varsolona, Richard J.; Yasuda, Nobuyoshi; York, Gregory Careful Navigation of the Crystallographic Landscape of MK-8970: A Racemic Acetal Carbonate Prodrug of Raltegravir Organic Process Research & Development, 2015, 19, 1882 |
1520613 | CIF | C25 H29 F N6 O8 | P 1 21/n 1 | 11.2744; 9.4324; 25.6466 90; 102.205; 90 | 2665.73 | Tsou, Nancy; Shultz, C. Scott; Andreani, Teresa; Ball, Richard G.; Brunskill, Andrew; Balsells, Jaume; Cohen, Ryan D.; DaSilva, Jimmy; Li, Jing; Reamer, Robert A.; de Lera Ruiz, Manuel; Variankaval, Narayan; Varsolona, Richard J.; Yasuda, Nobuyoshi; York, Gregory Careful Navigation of the Crystallographic Landscape of MK-8970: A Racemic Acetal Carbonate Prodrug of Raltegravir Organic Process Research & Development, 2015, 19, 1882 |
1520614 | CIF | C25 H23 N O3 | P 1 21/c 1 | 9.4141; 23.293; 9.0609 90; 92.942; 90 | 1984.3 | Brady, Patrick B.; Carreira, Erick M. Addition of Trifluoroborates to Oxetanyl N,O-Acetals: Entry into Spiro and Fused Saturated Heterocycles. Organic letters, 2015, 17, 3350-3353 |
1520615 | CIF | C18 H17 N O2 | P 1 21/c 1 | 8.0166; 15.8594; 11.2674 90; 98.788; 90 | 1415.7 | Brady, Patrick B.; Carreira, Erick M. Addition of Trifluoroborates to Oxetanyl N,O-Acetals: Entry into Spiro and Fused Saturated Heterocycles. Organic letters, 2015, 17, 3350-3353 |
1520616 | CIF | C37 H31 N O5 | P 1 21/n 1 | 11.364; 10.93; 24.447 90; 96.564; 90 | 3017 | Mo, Lei; Wu, Lin-Lin; Wang, Shaozhong; Yao, Zhu-Jun Efficient Synthesis of Octahydrophenanthrene Derivatives with Mild Cascade Reactions of Isochromenylium Tetrafluoroborates and Bifunctional Styrenes. Organic letters, 2015, 17, 3314-3317 |
1520617 | CIF | C41 H48 Br N7 O3 | P -1 | 11.7286; 15.6534; 22.6519 93.311; 99.266; 107.5 | 3889.5 | Nair, Ratish R.; Raju, M.; Patel, Neha P.; Raval, Ishan H.; Suresh, E.; Haldar, Soumya; Chatterjee, Pabitra B. Naked eye instant reversible sensing of Cu(2+) and its in situ imaging in live brine shrimp Artemia. The Analyst, 2015, 140, 5464-5468 |
1520618 | CIF | C56 H100 F N O4 | P -4 | 15.6111; 15.6111; 10.505 90; 90; 90 | 2560.14 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520619 | CIF | C22 H50 Cl2 F N O4 | P 1 21/c 1 | 9.9446; 18.0891; 15.7361 90; 103.523; 90 | 2752.27 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520620 | CIF | C26 H60 F N O6 | P b c n | 9.9133; 17.3454; 18.3631 90; 90; 90 | 3157.54 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520621 | CIF | C26 H60 F N O4 | C 1 2/c 1 | 22.5166; 14.2863; 19.8783 90; 103.626; 90 | 6214.47 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520622 | CIF | C38.39 H77.58 F N O12 | P 21 21 2 | 18.978; 24.2645; 10.3218 90; 90; 90 | 4753.1 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520623 | CIF | C22 H44 F0.5 N0.5 O7 | C 1 2 1 | 25.1923; 9.6565; 10.6715 90; 92.2457; 90 | 2594.06 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520624 | CIF | C28 H64 F N O4 | P b c a | 18.6017; 18.6158; 19.1084 90; 90; 90 | 6616.96 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520625 | CIF | C56 H64 F N O4 | P 21 21 21 | 10.6859; 12.6528; 34.797 90; 90; 90 | 4704.78 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520626 | CIF | C49 H80 F N O7 | P 1 c 1 | 8.7551; 12.7463; 22.1115 90; 92.0698; 90 | 2465.93 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520627 | CIF | C73 H78 F N O3 | P -1 | 14.5683; 19.9837; 20.7534 91.2454; 94.4191; 103.901 | 5842.46 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520628 | CIF | C55 H72 F N O3 | P -1 | 9.4953; 12.1501; 21.4618 81.8444; 89.1604; 78.5486 | 2401.96 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520629 | CIF | C54 H68 F N O2 | P 1 21/n 1 | 11.2887; 17.6025; 24.966 90; 98.4318; 90 | 4907.35 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520630 | CIF | C60 H80 F N O2 | P -1 | 13.4717; 17.5643; 24.8506 78.8655; 80.5422; 69.645 | 5379 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520631 | CIF | C76 H96 F N3 O5 | C 1 2/c 1 | 27.7157; 9.7374; 25.2072 90; 105.664; 90 | 6550.2 | Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci., 2015, 6, 5293 |
1520633 | CIF | C22 H21 Br N2 O3 S2 | P b c a | 11.7745; 15.3391; 24.3582 90; 90; 90 | 4399.34 | Choi, Wonseok; Kim, Jaeeun; Ryu, Taekyu; Kim, Ki-Bbeum; Lee, Phil Ho Synthesis of N-Imidoyl and N-Oxoimidoyl Sulfoximines from 1-Alkynes, N-Sulfonyl Azides, and Sulfoximines. Organic letters, 2015, 17, 3330-3333 |
1520634 | CIF | C22 H20 N2 O4 S2 | P -1 | 9.0038; 10.66; 11.8108 75.2664; 76.0323; 75.5364 | 1042.26 | Choi, Wonseok; Kim, Jaeeun; Ryu, Taekyu; Kim, Ki-Bbeum; Lee, Phil Ho Synthesis of N-Imidoyl and N-Oxoimidoyl Sulfoximines from 1-Alkynes, N-Sulfonyl Azides, and Sulfoximines. Organic letters, 2015, 17, 3330-3333 |
1520635 | CIF | C30 H29 N O3 | P 21 21 21 | 7.37176; 14.7771; 21.8173 90; 90; 90 | 2376.63 | Majumdar, Nilanjana; Saito, Akira; Yin, Liang; Kumagai, Naoya; Shibasaki, Masakatsu Direct Catalytic Asymmetric Conjugate Addition of Saturated and Unsaturated Thioamides. Organic letters, 2015, 17, 3362-3365 |
1520636 | CIF | C29 H32 N2 S2 | P 1 21 1 | 10.39896; 9.11807; 13.7409 90; 108.291; 90 | 1237.06 | Majumdar, Nilanjana; Saito, Akira; Yin, Liang; Kumagai, Naoya; Shibasaki, Masakatsu Direct Catalytic Asymmetric Conjugate Addition of Saturated and Unsaturated Thioamides. Organic letters, 2015, 17, 3362-3365 |
1520637 | CIF | C21 H15 F O2 | P 1 21/c 1 | 12.0845; 5.9453; 22.597 90; 103.246; 90 | 1580.3 | Du, Xiang-Wei; Stanley, Levi M. Tandem Alkyne Hydroacylation and Oxo-Michael Addition: Diastereoselective Synthesis of 2,3-Disubstituted Chroman-4-ones and Fluorinated Derivatives. Organic letters, 2015, 17, 3276-3279 |
1520638 | CIF | C29 H24 Au Fe O2 P S | P -1 | 9.187; 9.964; 15.554 108.411; 96.805; 95.38 | 1328.34 | Fernández-Gallardo, Jacob; Elie, Benelita T.; Sadhukha, Tanmoy; Prabha, Swayam; Sanaú, Mercedes; Rotenberg, Susan A.; Ramos, Joe W.; Contel, María Heterometallic titanium‒gold complexes inhibit renal cancer cells in vitro and in vivo Chem. Sci., 2015, 6, 5269 |
1520639 | CIF | C33 H29 Cl N2 O2 S | P 1 21 1 | 10.1227; 25.116; 11.547 90; 97.553; 90 | 2910.3 | Wang, Yidong; Zhang, Peichao; Liu, Yuan; Xia, Fei; Zhang, Junliang Enantioselective gold-catalyzed intermolecular [2+2] versus [4+2]-cycloadditions of 3-styrylindoles with N-allenamides: observation of interesting substituent effects Chem. Sci., 2015, 6, 5564 |
1520640 | CIF | C35 H32 N2 O4 S | P 21 21 21 | 6.0633; 11.5428; 42.4729 90; 90; 90 | 2972.57 | Wang, Yidong; Zhang, Peichao; Liu, Yuan; Xia, Fei; Zhang, Junliang Enantioselective gold-catalyzed intermolecular [2+2] versus [4+2]-cycloadditions of 3-styrylindoles with N-allenamides: observation of interesting substituent effects Chem. Sci., 2015, 6, 5564 |
1520655 | CIF | C32 H38 O5 Si2 | P 1 21/c 1 | 9.2692; 9.7098; 34.752 90; 92.266; 90 | 3125.3 | Zimmerman, Jake R.; Johntony, Olivia; Steigerwald, Daniel; Criss, Cody; Myers, Brian J.; Kinder, David H. The Synthesis of a New Class of Highly Fluorescent Chromones via an Inverse-Demand Hetero-Diels-Alder Reaction. Organic letters, 2015, 17, 3256-3259 |
1520656 | CIF | C16 H17 Cl O5 | P -1 | 6.9648; 7.7685; 14.728 76.228; 76.658; 84.002 | 752.04 | Zimmerman, Jake R.; Johntony, Olivia; Steigerwald, Daniel; Criss, Cody; Myers, Brian J.; Kinder, David H. The Synthesis of a New Class of Highly Fluorescent Chromones via an Inverse-Demand Hetero-Diels-Alder Reaction. Organic letters, 2015, 17, 3256-3259 |
1520657 | CIF | C18 H17 Br O5 | P 1 21 1 | 5.6762; 10.5443; 14.1611 90; 100.294; 90 | 833.92 | Sinha, Debarshi; Biswas, Arnab; Singh, Vinod K. Chiral Phosphine-Silver(I) Complex Catalyzed Enantioselective Interrupted Feist-Bénary Reaction with Ynones: The Aldol-Cycloisomerization Cascade. Organic letters, 2015, 17, 3302-3305 |
1520658 | CIF | C19 H20 N2 O6 | P 21 21 21 | 5.8624; 9.6327; 31.868 90; 90; 90 | 1799.61 | Chen, Shi; Ibrahim, Ahmad A.; Mondal, Mukulesh; Magee, Anthony J.; Cruz, Adam J.; Wheeler, Kraig A.; Kerrigan, Nessan J. Asymmetric Synthesis of Deoxypropionate Derivatives via Catalytic Hydrogenolysis of Enantioenriched Z-Ketene Heterodimers. Organic letters, 2015, 17, 3248-3251 |
1520659 | CIF | C22 H32 Cl2 I2 Si2 | P 1 21/n 1 | 13.1915; 9.4009; 22.0383 90; 106.275; 90 | 2623.49 | Sproul, Kyle C.; Chalifoux, Wesley A. Highly Regio- and Diastereoselective Formation of Tetrasubstituted (Z)-1,2-Dihaloalkenes from the Halogenation of Trimethylsilyl Alkynes with ICl. Organic letters, 2015, 17, 3334-3337 |
1520660 | CIF | C16 H10 Cl2 I2 | P b c a | 9.0806; 15.5457; 23.2185 90; 90; 90 | 3277.6 | Sproul, Kyle C.; Chalifoux, Wesley A. Highly Regio- and Diastereoselective Formation of Tetrasubstituted (Z)-1,2-Dihaloalkenes from the Halogenation of Trimethylsilyl Alkynes with ICl. Organic letters, 2015, 17, 3334-3337 |
1520661 | CIF | C20 H16 Br2 O | P -1 | 7.1574; 11.25; 22.434 84.231; 84.177; 89.834 | 1787.9 | Li, De-Yao; Wei, Yin; Marek, Ilan; Tang, Xiang-Ying; Shi, Min Gold(i)-catalyzed cycloisomerization of vinylidenecyclopropane-enes via carbene or non-carbene processes Chem. Sci., 2015, 6, 5519 |
1520662 | CIF | C25 H36 O | P 1 21/c 1 | 14.4666; 10.0707; 16.4037 90; 109.508; 90 | 2252.65 | Li, De-Yao; Wei, Yin; Marek, Ilan; Tang, Xiang-Ying; Shi, Min Gold(i)-catalyzed cycloisomerization of vinylidenecyclopropane-enes via carbene or non-carbene processes Chem. Sci., 2015, 6, 5519 |
1520663 | CIF | C28 H34 O | C 1 2/c 1 | 23.302; 11.4445; 18.904 90; 104.415; 90 | 4882.6 | Li, De-Yao; Wei, Yin; Marek, Ilan; Tang, Xiang-Ying; Shi, Min Gold(i)-catalyzed cycloisomerization of vinylidenecyclopropane-enes via carbene or non-carbene processes Chem. Sci., 2015, 6, 5519 |
1520664 | CIF | C20 H16 Br2 O | P -1 | 6.0698; 11.4589; 13.8421 67.027; 85.348; 76.337 | 861.26 | Li, De-Yao; Wei, Yin; Marek, Ilan; Tang, Xiang-Ying; Shi, Min Gold(i)-catalyzed cycloisomerization of vinylidenecyclopropane-enes via carbene or non-carbene processes Chem. Sci., 2015, 6, 5519 |
1520665 | CIF | C62 H138 Ge2 Si14 | C 1 2/c 1 | 38.0616; 9.3192; 48.0059 90; 92.3498; 90 | 17013.6 | Sasamori, Takahiro; Sugahara, Tomohiro; Agou, Tomohiro; Sugamata, Koh; Guo, Jing-Dong; Nagase, Shigeru; Tokitoh, Norihiro Reaction of a diaryldigermyne with ethylene Chem. Sci., 2015, 6, 5526 |
1520666 | CIF | C80 H162 Ge2 Si14 | P 1 21/a 1 | 12.7486; 20.8969; 18.9393 90; 103.248; 90 | 4911.28 | Sasamori, Takahiro; Sugahara, Tomohiro; Agou, Tomohiro; Sugamata, Koh; Guo, Jing-Dong; Nagase, Shigeru; Tokitoh, Norihiro Reaction of a diaryldigermyne with ethylene Chem. Sci., 2015, 6, 5526 |
1520667 | CIF | C64 H142 Ge2 Si14 | P b c a | 21.4391; 21.7284; 36.5231 90; 90; 90 | 17013.8 | Sasamori, Takahiro; Sugahara, Tomohiro; Agou, Tomohiro; Sugamata, Koh; Guo, Jing-Dong; Nagase, Shigeru; Tokitoh, Norihiro Reaction of a diaryldigermyne with ethylene Chem. Sci., 2015, 6, 5526 |
1520670 | CIF | C44 H28 O14 | P 1 21/c 1 | 19.7826; 11.0872; 30.0405 90; 95.85; 90 | 6554.6 | Cheuk, Dominic; Khamar, Dikshitkumar; McArdle, Patrick; Rasmuson, Åke C. Solid Forms, Crystal Habits, and Solubility of Danthron Journal of Chemical & Engineering Data, 2015, 60, 2110 |
1520671 | CIF | C15 H16 O3 | P 41 21 2 | 9.6557; 9.6557; 26.319 90; 90; 90 | 2453.8 | Shi, Yu-Sheng; Liu, Yun-Bao; Ma, Shuang-Gang; Li, Yong; Qu, Jing; Li, Li; Yuan, Shao-Peng; Hou, Qi; Li, Yu-Huan; Jiang, Jian-Dong; Yu, Shi-Shan Bioactive Sesquiterpenes and Lignans from the Fruits of Xanthium sibiricum. Journal of natural products, 2015, 78, 1526-1535 |
1520672 | CIF | C11 H14 O3 | P 21 21 21 | 6.1491; 8.0979; 20.2092 90; 90; 90 | 1006.31 | Shi, Yu-Sheng; Liu, Yun-Bao; Ma, Shuang-Gang; Li, Yong; Qu, Jing; Li, Li; Yuan, Shao-Peng; Hou, Qi; Li, Yu-Huan; Jiang, Jian-Dong; Yu, Shi-Shan Bioactive Sesquiterpenes and Lignans from the Fruits of Xanthium sibiricum. Journal of natural products, 2015, 78, 1526-1535 |
1520673 | CIF | C20 H30 O4 | P 21 21 21 | 7.587; 9.6985; 25.106 90; 90; 90 | 1847.4 | Xu, Jing; Sun, Yihang; Wang, Meicheng; Ren, Quanhui; Li, Shen; Wang, Hao; Sun, Xiaocong; Jin, Da-Qing; Sun, Hongwei; Ohizumi, Yasushi; Guo, Yuanqiang Bioactive Diterpenoids from the Leaves of Callicarpa macrophylla. Journal of natural products, 2015, 78, 1563-1569 |
1520674 | CIF | C28 H33 N3 Na O10 Re S | P 1 21/c 1 | 31.609; 10.4939; 9.2829 90; 96.146; 90 | 3061.5 | Jia, Jianhua; Cui, Mengchao; Dai, Jiapei; Liu, Boli (99m)Tc(CO)3-Labeled Benzothiazole Derivatives Preferentially Bind Cerebrovascular Amyloid: Potential Use as Imaging Agents for Cerebral Amyloid Angiopathy. Molecular pharmaceutics, 2015, 12, 2937-2946 |
1520675 | CIF | C16 H14 N2 O | P 1 21/n 1 | 13.4616; 4.959; 19.7696 90; 93.71; 90 | 1316.98 | Li, Shangda; Ji, Huafang; Cai, Lei; Li, Gang Pd(ii)-catalyzed remote regiodivergent ortho- and meta-C‒H functionalizations of phenylethylamines Chem. Sci., 2015, 6, 5595 |
1520676 | CIF | C20 H18 N2 O3 | C 1 2/c 1 | 33.97; 6.299; 16.431 90; 92.257; 90 | 3513 | Li, Shangda; Ji, Huafang; Cai, Lei; Li, Gang Pd(ii)-catalyzed remote regiodivergent ortho- and meta-C‒H functionalizations of phenylethylamines Chem. Sci., 2015, 6, 5595 |
1520682 | CIF | C26 H19 N3 O5 S | P -1 | 10.4761; 10.8361; 11.3358 76.911; 61.867; 86.563 | 1103.68 | Rao, Wei-Hao; Zhan, Bei-Bei; Chen, Kai; Ling, Peng-Xiang; Zhang, Zhuo-Zhuo; Shi, Bing-Feng Pd(II)-Catalyzed Direct Sulfonylation of Unactivated C(sp(3))-H Bonds with Sodium Sulfinates. Organic letters, 2015, 17, 3552-3555 |
1520683 | CIF | C20 H24 Cl N3 O | P 1 21 1 | 10.868; 6.8325; 12.6102 90; 103.793; 90 | 909.38 | Johnson, Rebecca E.; de Rond, Tristan; Lindsay, Vincent N. G.; Keasling, Jay D.; Sarpong, Richmond Synthesis of Cycloprodigiosin Identifies the Natural Isolate as a Scalemic Mixture. Organic letters, 2015, 17, 3474-3477 |
1520684 | CIF | C13 H17 Cl O3 | P n a 21 | 28.508; 5.4891; 8.1976 90; 90; 90 | 1282.79 | Tanveer, Kashif; Jarrah, Kareem; Taylor, Mark S. Borinic Acid Catalyzed, Regioselective Chloroacylations and Chlorosulfonylations of 2,3-Epoxy Alcohols. Organic letters, 2015, 17, 3482-3485 |
1520685 | CIF | C21 H21 Cl O4 | P b c a | 15.5081; 11.7102; 20.245 90; 90; 90 | 3676.6 | Tanveer, Kashif; Jarrah, Kareem; Taylor, Mark S. Borinic Acid Catalyzed, Regioselective Chloroacylations and Chlorosulfonylations of 2,3-Epoxy Alcohols. Organic letters, 2015, 17, 3482-3485 |
1520686 | CIF | C33 H30 N2 O6 S2 | P -1 | 10.7946; 12.4093; 13.1553 76.627; 68.739; 81.216 | 1593.12 | Yan, Xiaonan; Ling, Fei; Zhang, Yuchen; Ma, Cheng Three-Component Functionalized Dihydropyridine Synthesis via a Formal Inverse Electron-Demand Hetero-Diels-Alder Reaction. Organic letters, 2015, 17, 3536-3539 |
1520694 | CIF | C33 H27 N3 O13 | P -1 | 11.319; 12.665; 14.597 86.284; 86.306; 68.207 | 1937.1 | Chen, Ji-Peng; He, Wei; Yang, Zhen-Yu; Yao, Zhu-Jun Synthesis of Tricyclo[4,3,1,0(1,5)]decane Core of Plumisclerin A Using Pauson-Khand Annulation and SmI2-Mediated Radical Cyclization. Organic letters, 2015, 17, 3379-3381 |
1520695 | CIF | C41 H29 N2 O | P 21 21 21 | 9.7022; 14.1065; 22.5755 90; 90; 90 | 3089.78 | Martínez, Ángel Manu; Echavarren, Javier; Alonso, Inés; Rodríguez, Nuria; Gómez Arrayás, Ramón; Carretero, Juan C. RhI/RhIIIcatalyst-controlled divergent aryl/heteroaryl C‒H bond functionalization of picolinamides with alkynes Chem. Sci., 2015, 6, 5802 |
1520696 | CIF | C41 H32 N2 O | P b c a | 9.7137; 21.2283; 30.357 90; 90; 90 | 6259.8 | Martínez, Ángel Manu; Echavarren, Javier; Alonso, Inés; Rodríguez, Nuria; Gómez Arrayás, Ramón; Carretero, Juan C. RhI/RhIIIcatalyst-controlled divergent aryl/heteroaryl C‒H bond functionalization of picolinamides with alkynes Chem. Sci., 2015, 6, 5802 |
1520697 | CIF | C28 H19 F3 N2 O | P -1 | 9.7447; 10.0599; 12.2374 103.037; 100.267; 97.73 | 1130.75 | Martínez, Ángel Manu; Echavarren, Javier; Alonso, Inés; Rodríguez, Nuria; Gómez Arrayás, Ramón; Carretero, Juan C. RhI/RhIIIcatalyst-controlled divergent aryl/heteroaryl C‒H bond functionalization of picolinamides with alkynes Chem. Sci., 2015, 6, 5802 |
1520698 | CIF | C27 H21 N O S | P 1 21/n 1 | 11.5129; 21.7914; 17.1772 90; 98.718; 90 | 4259.66 | Martínez, Ángel Manu; Echavarren, Javier; Alonso, Inés; Rodríguez, Nuria; Gómez Arrayás, Ramón; Carretero, Juan C. RhI/RhIIIcatalyst-controlled divergent aryl/heteroaryl C‒H bond functionalization of picolinamides with alkynes Chem. Sci., 2015, 6, 5802 |
1520699 | CIF | C42 H34 N2 O | P 1 21/n 1 | 7.8222; 19.2845; 21.7791 90; 100.329; 90 | 3232.1 | Martínez, Ángel Manu; Echavarren, Javier; Alonso, Inés; Rodríguez, Nuria; Gómez Arrayás, Ramón; Carretero, Juan C. RhI/RhIIIcatalyst-controlled divergent aryl/heteroaryl C‒H bond functionalization of picolinamides with alkynes Chem. Sci., 2015, 6, 5802 |
1520700 | CIF | C21 H23 N2 O Rh | P 1 21/n 1 | 7.9626; 12.2907; 18.1403 90; 102.579; 90 | 1732.7 | Martínez, Ángel Manu; Echavarren, Javier; Alonso, Inés; Rodríguez, Nuria; Gómez Arrayás, Ramón; Carretero, Juan C. RhI/RhIIIcatalyst-controlled divergent aryl/heteroaryl C‒H bond functionalization of picolinamides with alkynes Chem. Sci., 2015, 6, 5802 |
1520702 | CIF | C41 H60 N8 O3 Ti2 | P 1 21/n 1 | 19.8643; 9.0349; 24.8875 90; 106.793; 90 | 4276.1 | Chen, Zhou; Liu, Jinna; Pei, Hao; Liu, Wei; Chen, Yanmei; Wu, Jian; Li, Wu; Li, Yahong Directed Amination of Aryl Methyl Ethers Mediated by Ti(NMe2)4 at Room Temperature. Organic letters, 2015, 17, 3406-3409 |
1520703 | CIF | C163 H221 N28 O13 Ti4 | P -1 | 19.976; 20.518; 21.236 89.583; 78.919; 76.303 | 8292 | Chen, Zhou; Liu, Jinna; Pei, Hao; Liu, Wei; Chen, Yanmei; Wu, Jian; Li, Wu; Li, Yahong Directed Amination of Aryl Methyl Ethers Mediated by Ti(NMe2)4 at Room Temperature. Organic letters, 2015, 17, 3406-3409 |
1520704 | CIF | C22 H20 N2 O3 | P -1 | 11.7148; 11.8534; 14.1205 110; 95.83; 100.677 | 1781.51 | Dörr, Aurélie A; Lubell, William D. γ-Turn Mimicry with Benzodiazepinones and Pyrrolobenzodiazepinones Synthesized from a Common Amino Ketone Intermediate. Organic letters, 2015, 17, 3592-3595 |
1520705 | CIF | C22 H22 N2 O3 | P c a 21 | 17.651; 15.5231; 13.7865 90; 90; 90 | 3777.48 | Dörr, Aurélie A; Lubell, William D. γ-Turn Mimicry with Benzodiazepinones and Pyrrolobenzodiazepinones Synthesized from a Common Amino Ketone Intermediate. Organic letters, 2015, 17, 3592-3595 |
1520706 | CIF | C22 H20 N2 O3 | P 1 21/n 1 | 15.2406; 5.6664; 20.6863 90; 94.254; 90 | 1781.53 | Dörr, Aurélie A; Lubell, William D. γ-Turn Mimicry with Benzodiazepinones and Pyrrolobenzodiazepinones Synthesized from a Common Amino Ketone Intermediate. Organic letters, 2015, 17, 3592-3595 |
1520707 | CIF | C20 H23 N O8 | P 21 21 21 | 8.7215; 11.3257; 19.217 90; 90; 90 | 1898.2 | Paladino, Marco; Zaifman, Joshua; Ciufolini, Marco A. Total Synthesis of (+)-3-Demethoxyerythratidinone and (+)-Erysotramidine via the Oxidative Amidation of a Phenol. Organic letters, 2015, 17, 3422-3425 |
1520708 | CIF | C15 H15 N3 O4 | P 1 21/n 1 | 11.4762; 7.95324; 16.5869 90; 107.894; 90 | 1440.7 | Wang, Qi; Tang, Xuli; Luo, Xiangchao; de Voogd, Nicole J.; Li, Pinglin; Li, Guoqiang (+)- and (-)-Spiroreticulatine, A Pair of Unusual Spiro Bisheterocyclic Quinoline-imidazole Alkaloids from the South China Sea Sponge Fascaplysinopsis reticulata. Organic letters, 2015, 17, 3458-3461 |
1520709 | CIF | C324.95 H223.55 Cu4 N97.65 Na11.5 O115.55 S16 Zn12 | P 1 n 1 | 21.91216; 32.64068; 35.0386 90; 98.2694; 90 | 24800 | Giri, Chandan; Topić, Filip; Cametti, Massimo; Rissanen, Kari Mixed valence mono- and hetero-metallic grid catenanes Chem. Sci., 2015, 6, 5712 |
1520710 | CIF | C326.45 H230.05 Cu10 N98.15 O119.55 S16 Zn6.4 | P -1 | 24.6339; 26.2771; 38.566 71.189; 77.8; 87.75 | 23086 | Giri, Chandan; Topić, Filip; Cametti, Massimo; Rissanen, Kari Mixed valence mono- and hetero-metallic grid catenanes Chem. Sci., 2015, 6, 5712 |
1520711 | CIF | C325.25 H227.25 Cu16 N97.75 O116.25 S16 | P -1 | 24.6594; 26.1086; 38.5294 71.7131; 78.2731; 87.7169 | 23054.1 | Giri, Chandan; Topić, Filip; Cametti, Massimo; Rissanen, Kari Mixed valence mono- and hetero-metallic grid catenanes Chem. Sci., 2015, 6, 5712 |
1520712 | CIF | C80 H52 N24 O20 S4 Zn4 | I 41/a | 16.4641; 16.4641; 53.397 90; 90; 90 | 14474.1 | Giri, Chandan; Topić, Filip; Cametti, Massimo; Rissanen, Kari Mixed valence mono- and hetero-metallic grid catenanes Chem. Sci., 2015, 6, 5712 |
1520713 | CIF | C25 H24 N4 O4 | P 1 21/c 1 | 20.3743; 5.7348; 19.2424 90; 102.342; 90 | 2196.4 | Huang, Zhongxing; Sam, Quynh P.; Dong, Guangbin Palladium-catalyzed direct β-arylation of ketones with diaryliodonium salts: a stoichiometric heavy metal-free and user-friendly approach Chem. Sci., 2015, 6, 5491 |
1520714 | CIF | C28 H28 N2 O4 S4 | P 1 21/c 1 | 6.5498; 20.4037; 11.0725 90; 100.469; 90 | 1455.1 | Huang, Zhongxing; Sam, Quynh P.; Dong, Guangbin Palladium-catalyzed direct β-arylation of ketones with diaryliodonium salts: a stoichiometric heavy metal-free and user-friendly approach Chem. Sci., 2015, 6, 5491 |
1520715 | CIF | C28 H28 N2 O4 S4 | I 1 2/a 1 | 15.181; 15.559; 23.696 90; 105.016; 90 | 5406 | Huang, Zhongxing; Sam, Quynh P.; Dong, Guangbin Palladium-catalyzed direct β-arylation of ketones with diaryliodonium salts: a stoichiometric heavy metal-free and user-friendly approach Chem. Sci., 2015, 6, 5491 |
1520716 | CIF | C25 H45 N O2 S | P 1 21/c 1 | 37.479; 7.292; 9.0925 90; 93.702; 90 | 2479.8 | Bhat, R.; Patel, H.; Tsai, P.-C.; Sun, X.-L.; Daoud, D.; Lalancette, R. A.; Michniak-Kohn, B.; Pietrangelo, A. Effect of residue structure on the thermal and thermoresponsive properties of γ-substituted poly(N-acryloyl-2-pyrrolidones) Polym. Chem., 2015, 6, 5993 |
1520720 | CIF | C21 H31 Cl3 O2 | C 1 2 1 | 22.6971; 11.6034; 19.6097 90; 124.027; 90 | 4280.19 | Wang, Li-Jun; Xiong, Juan; Liu, Shu-Ting; Pan, Li-Long; Yang, Guo-Xun; Hu, Jin-Feng ent-Abietane-Type and Related Seco-/Nor-diterpenoids from the Rare Chloranthaceae Plant Chloranthus sessilifolius and Their Antineuroinflammatory Activities. Journal of natural products, 2015, 78, 1635-1646 |
1520721 | CIF | C20 H32 O3 | P 1 21 1 | 6.1311; 17.3576; 8.5062 90; 98.395; 90 | 895.54 | Wang, Li-Jun; Xiong, Juan; Liu, Shu-Ting; Pan, Li-Long; Yang, Guo-Xun; Hu, Jin-Feng ent-Abietane-Type and Related Seco-/Nor-diterpenoids from the Rare Chloranthaceae Plant Chloranthus sessilifolius and Their Antineuroinflammatory Activities. Journal of natural products, 2015, 78, 1635-1646 |
1520722 | CIF | C20 H30 O4 | P 21 21 21 | 7.0352; 9.6018; 26.5701 90; 90; 90 | 1794.83 | Wang, Li-Jun; Xiong, Juan; Liu, Shu-Ting; Pan, Li-Long; Yang, Guo-Xun; Hu, Jin-Feng ent-Abietane-Type and Related Seco-/Nor-diterpenoids from the Rare Chloranthaceae Plant Chloranthus sessilifolius and Their Antineuroinflammatory Activities. Journal of natural products, 2015, 78, 1635-1646 |
1520723 | CIF | C22 H29 N3 O5 | P 1 21/c 1 | 13.212; 9.1505; 18.16 90; 105.195; 90 | 2118.7 | Braun, Doris E.; Koztecki, Lien H.; McMahon, Jennifer A.; Price, Sarah L.; Reutzel-Edens, Susan M Navigating the Waters of Unconventional Crystalline Hydrates. Molecular pharmaceutics, 2015, 12, 3069-3088 |
1520724 | CIF | C22 H28.46 N3 O4.73 | C 1 2/c 1 | 26.498; 9.6469; 20.342 90; 128.706; 90 | 4057.8 | Braun, Doris E.; Koztecki, Lien H.; McMahon, Jennifer A.; Price, Sarah L.; Reutzel-Edens, Susan M Navigating the Waters of Unconventional Crystalline Hydrates. Molecular pharmaceutics, 2015, 12, 3069-3088 |
1520725 | CIF | C22 H28.9 N3 O4.95 | C 1 2/c 1 | 26.663; 9.634; 20.863 90; 128.322; 90 | 4204 | Braun, Doris E.; Koztecki, Lien H.; McMahon, Jennifer A.; Price, Sarah L.; Reutzel-Edens, Susan M Navigating the Waters of Unconventional Crystalline Hydrates. Molecular pharmaceutics, 2015, 12, 3069-3088 |
1520726 | CIF | C44 H42 F6 N6 O7 S2 | P b c a | 21.512; 10.424; 40.881 90; 90; 90 | 9167 | Zhu, Chuan-Le; Yang, Li-Jun; Li, Shen; Zheng, Yan; Ma, Jun-An Brine-Stabilized 2,2,2-Trifluorodiazoethane and Its Application in the Synthesis of CF3-Substituted Cyclopropane α-Amino Acids. Organic letters, 2015, 17, 3442-3445 |
1520727 | CIF | C28 H23 F3 N2 O3 | P -1 | 8.882; 10.743; 14.629 87; 76.43; 65.66 | 1234.8 | Zhu, Chuan-Le; Yang, Li-Jun; Li, Shen; Zheng, Yan; Ma, Jun-An Brine-Stabilized 2,2,2-Trifluorodiazoethane and Its Application in the Synthesis of CF3-Substituted Cyclopropane α-Amino Acids. Organic letters, 2015, 17, 3442-3445 |
1520728 | CIF | C25 H34 N2 O9 Si | P b c a | 10.3059; 20.6482; 25.5756 90; 90; 90 | 5442.4 | Cheng, Qing-Qing; Qian, Yu; Zavalij, Peter Y.; Doyle, Michael P. Lewis Acid/Rhodium-Catalyzed Formal [3 + 3]-Cycloaddition of Enoldiazoacetates with Donor-Acceptor Cyclopropanes. Organic letters, 2015, 17, 3568-3571 |
1520729 | CIF | C25 H31 N O3 S2 | P 1 21 1 | 6.6067; 19.709; 9.7407 90; 109.22; 90 | 1197.65 | Fernández-Valparís, Javier; Romo, Juan Manuel; Romea, Pedro; Urpí, Fèlix; Kowalski, Hubert; Font-Bardia, Mercè Stereoselective Alkylation of (S)-N-Acyl-4-isopropyl-1,3-thiazolidine-2-thiones Catalyzed by (Me3P)2NiCl2. Organic letters, 2015, 17, 3540-3543 |
1520734 | CIF | C15 H24 N2 O3 | P 21 21 21 | 7.9518; 12.143; 14.869 90; 90; 90 | 1435.7 | Pan, Qi-Ming; Li, Yu-Huan; Hua, Jing; Huang, Fu-Ping; Wang, Heng-Shan; Liang, Dong Antiviral Matrine-Type Alkaloids from the Rhizomes of Sophora tonkinensis. Journal of natural products, 2015, 78, 1683-1688 |
1520735 | CIF | C15 H22 N2 O3 | P 21 21 21 | 9.052; 10.577; 14.128 90; 90; 90 | 1352.7 | Pan, Qi-Ming; Li, Yu-Huan; Hua, Jing; Huang, Fu-Ping; Wang, Heng-Shan; Liang, Dong Antiviral Matrine-Type Alkaloids from the Rhizomes of Sophora tonkinensis. Journal of natural products, 2015, 78, 1683-1688 |
1520736 | CIF | C16 H16 N2 O S | P 21 21 21 | 7.2412; 10.1066; 19.681 90; 90; 90 | 1440.33 | Mary Sheeba, Mani; Preethi, Sankaranarayanan; Nijamudheen, A.; Muthu Tamizh, Manoharan; Datta, Ayan; Farrugia, Louis J.; Karvembu, Ramasamy Half-sandwich Ru(η6-C6H6) complexes with chiral aroylthioureas for enhanced asymmetric transfer hydrogenation of ketones ‒ experimental and theoretical studies Catal. Sci. Technol., 2015, 5, 4790 |
1520737 | CIF | C14 H14 N2 O S2 | P 21 21 21 | 7.1805; 9.8395; 19.6096 90; 90; 90 | 1385.47 | Mary Sheeba, Mani; Preethi, Sankaranarayanan; Nijamudheen, A.; Muthu Tamizh, Manoharan; Datta, Ayan; Farrugia, Louis J.; Karvembu, Ramasamy Half-sandwich Ru(η6-C6H6) complexes with chiral aroylthioureas for enhanced asymmetric transfer hydrogenation of ketones ‒ experimental and theoretical studies Catal. Sci. Technol., 2015, 5, 4790 |
1520738 | CIF | C24 H25 Cl2 N3 O Ru S | P 21 21 21 | 10.0568; 14.9314; 16.7695 90; 90; 90 | 2518.1 | Mary Sheeba, Mani; Preethi, Sankaranarayanan; Nijamudheen, A.; Muthu Tamizh, Manoharan; Datta, Ayan; Farrugia, Louis J.; Karvembu, Ramasamy Half-sandwich Ru(η6-C6H6) complexes with chiral aroylthioureas for enhanced asymmetric transfer hydrogenation of ketones ‒ experimental and theoretical studies Catal. Sci. Technol., 2015, 5, 4790 |
1520739 | CIF | C20 H20 Cl2 N2 O Ru S2 | P 21 21 21 | 6.6174; 17.1016; 19.4048 90; 90; 90 | 2196 | Mary Sheeba, Mani; Preethi, Sankaranarayanan; Nijamudheen, A.; Muthu Tamizh, Manoharan; Datta, Ayan; Farrugia, Louis J.; Karvembu, Ramasamy Half-sandwich Ru(η6-C6H6) complexes with chiral aroylthioureas for enhanced asymmetric transfer hydrogenation of ketones ‒ experimental and theoretical studies Catal. Sci. Technol., 2015, 5, 4790 |
1520740 | CIF | C20 H20 Cl2 N2 O2 Ru S | P 21 21 21 | 6.503; 10.2867; 31.8305 90; 90; 90 | 2129.28 | Mary Sheeba, Mani; Preethi, Sankaranarayanan; Nijamudheen, A.; Muthu Tamizh, Manoharan; Datta, Ayan; Farrugia, Louis J.; Karvembu, Ramasamy Half-sandwich Ru(η6-C6H6) complexes with chiral aroylthioureas for enhanced asymmetric transfer hydrogenation of ketones ‒ experimental and theoretical studies Catal. Sci. Technol., 2015, 5, 4790 |
1520741 | CIF | C39 H69 Ga N2 Si3 | P -1 | 10.5026; 11.3327; 19.4036 85.025; 85.154; 71.124 | 2173.1 | Uzelac, Marina; Hernán-Gómez, Alberto; Armstrong, David R.; Kennedy, Alan R.; Hevia, Eva Rational synthesis of normal, abnormal and anionic NHC‒gallium alkyl complexes: structural, stability and isomerization insights Chem. Sci., 2015, 6, 5719 |
1520742 | CIF | C43 H80 Ga Li N2 Si4 | P 1 21/m 1 | 11.519; 20.858; 11.942 90; 117.73; 90 | 2539.7 | Uzelac, Marina; Hernán-Gómez, Alberto; Armstrong, David R.; Kennedy, Alan R.; Hevia, Eva Rational synthesis of normal, abnormal and anionic NHC‒gallium alkyl complexes: structural, stability and isomerization insights Chem. Sci., 2015, 6, 5719 |
1520743 | CIF | C47 H84 Ga Li N2 O2 Si3 | P 1 21/n 1 | 11.5267; 18.7832; 24.68 90; 90.988; 90 | 5342.6 | Uzelac, Marina; Hernán-Gómez, Alberto; Armstrong, David R.; Kennedy, Alan R.; Hevia, Eva Rational synthesis of normal, abnormal and anionic NHC‒gallium alkyl complexes: structural, stability and isomerization insights Chem. Sci., 2015, 6, 5719 |
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