Crystallography Open Database
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Searching year of publication is 2015
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1551388 | CIF | C188 H186 Cl0 F N36 O36 | P -1 | 17.5372; 19.8099; 33.578 105.041; 90.103; 108.356 | 10648 | Nagula Chandramouli; Yann Ferrand; Guillaume Lautrette; Brice Kauffmann; Cameron David Mackereth; Michel Laguerre; Didier Dubreuil; Ivan Huc Iterative design of a helically folded aromatic oligoamide sequence for the selective encapsulation of fructose Nature Chemistry, 2015, 7, 334-341 |
| 1551389 | CIF | C191 H189 Cl6 F2 N35 O36 | P -1 | 17.554; 19.747; 33.398 74.98; 89.62; 71.99 | 10600 | Nagula Chandramouli; Yann Ferrand; Guillaume Lautrette; Brice Kauffmann; Cameron David Mackereth; Michel Laguerre; Didier Dubreuil; Ivan Huc Iterative design of a helically folded aromatic oligoamide sequence for the selective encapsulation of fructose Nature Chemistry, 2015, 7, 334-341 |
| 1551415 | CIF | C194 H146 Br8 Cl17 Fe6.5 N40 O21 | P -1 | 16.0089; 25.8622; 29.879 89.88; 89.852; 72.396 | 11791.3 | Christopher S. Wood; Tanya K. Ronson; Ana M. Belenguer; Julian J. Holstein; Jonathan R. Nitschke Two-stage directed self-assembly of a cyclic [3]catenane Nature Chemistry, 2015, 7, 354-358 |
| 1551416 | CIF | C196 H165 Cl12 Fe6 N35 O24 | P 1 21/n 1 | 33.0443; 19.184; 41.84 90; 111.339; 90 | 24705 | Christopher S. Wood; Tanya K. Ronson; Ana M. Belenguer; Julian J. Holstein; Jonathan R. Nitschke Two-stage directed self-assembly of a cyclic [3]catenane Nature Chemistry, 2015, 7, 354-358 |
| 1551417 | CIF | C192 H150 F24 Fe6 N36 O12 P4 S6 | C 1 c 1 | 42.114; 54.516; 14.0878 90; 107.763; 90 | 30802 | Christopher S. Wood; Tanya K. Ronson; Ana M. Belenguer; Julian J. Holstein; Jonathan R. Nitschke Two-stage directed self-assembly of a cyclic [3]catenane Nature Chemistry, 2015, 7, 354-358 |
| 1551418 | CIF | C234 H234 Br12.75 Fe6 K0.75 N30 O42.25 | C 1 2/c 1 | 59.465; 16.8956; 62.436 90; 116.189; 90 | 56290 | Christopher S. Wood; Tanya K. Ronson; Ana M. Belenguer; Julian J. Holstein; Jonathan R. Nitschke Two-stage directed self-assembly of a cyclic [3]catenane Nature Chemistry, 2015, 7, 354-358 |
| 1551453 | CIF | C24 H16 Al2 O10 | I 41 2 2 | 14.8228; 14.8228; 11.7919 90; 90; 90 | 2590.86 | Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework Nature Chemistry, 2015, 7, 121-129 |
| 1551454 | CIF | C21 H18 Al2 O10 | I 41 2 2 | 14.80469; 14.80469; 11.801726 90; 90; 90 | 2586.69 | Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework Nature Chemistry, 2015, 7, 121-129 |
| 1551455 | CIF | C21.4 H8 Al2 D5.4 O10 | I 41 2 2 | 14.785355; 14.785355; 11.77396 90; 90; 90 | 2573.87 | Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework Nature Chemistry, 2015, 7, 121-129 |
| 1551456 | CIF | C19.6 H8 Al2 D7.2 O10 | I 41 2 2 | 14.794232; 14.794232; 11.77851 90; 90; 90 | 2577.95 | Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework Nature Chemistry, 2015, 7, 121-129 |
| 1551457 | CIF | C18.6 H8 Al2 D6.8 O10 | I 41 2 2 | 14.79549; 14.79549; 11.77847 90; 90; 90 | 2578.38 | Sihai Yang; Anibal J. Ramirez-Cuesta; Ruth Newby; Victoria Garcia-Sakai; Pascal Manuel; Samantha K. Callear; Stuart I. Campbell; Chiu C. Tang; Martin Schroder Supramolecular binding and separation of hydrocarbons within a functionalized porous metal-organic framework Nature Chemistry, 2015, 7, 121-129 |
| 1551478 | CIF | C266 H240 Br12 Cu6 N18 O63 S7 | R -3 :H | 38.1839; 38.1839; 57.9645 90; 90; 120 | 73190.3 | Flora L. Thorp-Greenwood; Alexander N. Kulak; Michaele J. Hardie An infinite chainmail of M6L6 metallacycles featuring multiple Borromean links Nature Chemistry, 2015, 7, 526-531 |
| 1551538 | CIF | C45 H34 Cl F3 N2 | P 21 21 21 | 11.726; 17.511; 17.758 90; 90; 90 | 3646.3 | Shin Suzuki; Yasutomo Segawa; Kenichiro Itami; Junichiro Yamaguchi Synthesis and characterization of hexaarylbenzenes with five or six different substituents enabled by programmed synthesis Nature Chemistry, 2015, 7, 227-233 |
| 1551539 | CIF | C56 H57 Cl3 F3 N O2 Si | P -1 | 11.095; 15.395; 16.048 86.404; 88.39; 71.517 | 2594.5 | Shin Suzuki; Yasutomo Segawa; Kenichiro Itami; Junichiro Yamaguchi Synthesis and characterization of hexaarylbenzenes with five or six different substituents enabled by programmed synthesis Nature Chemistry, 2015, 7, 227-233 |
| 1551540 | CIF | C40 H33 F3 O | P 1 21/c 1 | 7.973; 24.778; 15.926 90; 101.836; 90 | 3079.4 | Shin Suzuki; Yasutomo Segawa; Kenichiro Itami; Junichiro Yamaguchi Synthesis and characterization of hexaarylbenzenes with five or six different substituents enabled by programmed synthesis Nature Chemistry, 2015, 7, 227-233 |
| 1551541 | CIF | C50 H41 F3 O | P 21 21 21 | 8.6566; 19.9388; 22.106 90; 90; 90 | 3815.5 | Shin Suzuki; Yasutomo Segawa; Kenichiro Itami; Junichiro Yamaguchi Synthesis and characterization of hexaarylbenzenes with five or six different substituents enabled by programmed synthesis Nature Chemistry, 2015, 7, 227-233 |
| 1551542 | CIF | C40 H33 F3 N2 O | P 1 21/a 1 | 16.718; 12.216; 16.184 90; 99; 90 | 3264.5 | Shin Suzuki; Yasutomo Segawa; Kenichiro Itami; Junichiro Yamaguchi Synthesis and characterization of hexaarylbenzenes with five or six different substituents enabled by programmed synthesis Nature Chemistry, 2015, 7, 227-233 |
| 1551619 | CIF | C17 H16 N4 O7 | C 1 2/c 1 | 18.388; 10.355; 19.159 90; 113.596; 90 | 3343 | MIUKURIYA, Masahiro; NAKA, Yuko; YOSHIOKA, Daisuke Synthesis and Crystal Structure of 1,3-Bis(5-nitrosalicylideneamino)-2-propanol X-ray Structure Analysis Online, 2015, 31, 55 |
| 1551620 | CIF | C69 H84 B3 N3 Ni O7 | P -1 | 11.8846; 14.5812; 20.235 73.031; 84.561; 66.297 | 3069.9 | YAMAGUCHI, Ryo; YAMASAKI, Mikio; SAKIYAMA, Hiroshi Structure of Bis(2,2′-iminodiethanol-<i>N</i>,<i>O</i>,<i>O</i>′)-Nickel(II) Hydrogen-Bonded to an Organoboron Coordination Complex X-ray Structure Analysis Online, 2015, 31, 19 |
| 1551621 | CIF | C53 H34 Cl2 F16 N8 Pd | P -1 | 10.1; 14.544; 17.861 83.619; 85.295; 73.839 | 2500.8 | MORIWAKI, Kazuhiro; AKASHI, Haruo Synthesis and Crystal Structure of 5,10,15,20-Tetrakis(2,3,5,6-tetrafluoro-4-(dimethylamino)phenyl)porphyrinato)palladium(II)-dichloromethane (1/1) X-ray Structure Analysis Online, 2015, 31, 15 |
| 1551622 | CIF | C30 H52 N2 O10 V2 | P -1 | 8.5059; 9.8815; 11.3339 82.916; 83.819; 65.595 | 859.2 | MIKURIYA, Masahiro; FUKUTANI, Masami; YOSHIOKA, Daisuke Synthesis and Crystal Structures of Dinuclear Dioxidovanadium(V) and Tetranuclear Oxidovanadium(IV) Complexes with 2,6-Bis(hydroxymethyl)-4-methylphenol X-ray Structure Analysis Online, 2015, 31, 33 |
| 1551623 | CIF | C32 H58 N2 O20 S2 V4 | P -1 | 10.731; 11.373; 11.558 104.28; 112.76; 108.23 | 1121 | MIKURIYA, Masahiro; FUKUTANI, Masami; YOSHIOKA, Daisuke Synthesis and Crystal Structures of Dinuclear Dioxidovanadium(V) and Tetranuclear Oxidovanadium(IV) Complexes with 2,6-Bis(hydroxymethyl)-4-methylphenol X-ray Structure Analysis Online, 2015, 31, 33 |
| 1551624 | CIF | C8 H11 N2 O3 Re S | P 1 21/n 1 | 10.054; 8.466; 12.924 90; 108.552; 90 | 1042.9 | MIKURIYA, Masahiro; WATANABE, Tetsuji; SUYAMA, Aiko; YOSHIOKA, Daisuke Rhenium Complex with 2-[(2-Pyridylmethyl)amino]ethanethiol X-ray Structure Analysis Online, 2015, 31, 3 |
| 1551625 | CIF | C75 H69 N9 O6 S3 | C 1 c 1 | 24.986; 23.548; 13.762 90; 101.358; 90 | 7939 | ISHIMARU, Yoshihiro; SHIMOYAMA, Naoyuki; SHIBA, Haruaki; FUJIHARA, Takashi <i>p</i>-Nitrophenyl[36]trithianonaphyrin(1.0.0.1.0.0.1.0.0) with a Weak Antiaromatic Character X-ray Structure Analysis Online, 2015, 31, 21 |
| 1551626 | CIF | C60 H70 B2 N6 Ni O6 | P -1 | 10.68; 13.271; 19.96 86.043; 84.483; 87.335 | 2806.9 | SAKIYAMA, Hiroshi; MITSUHASHI, Ryoji; MIKURIYA, Masahiro <i>Pseudo</i>-<i>S</i><sub>6</sub> Complex Cations of a Hexakis-<i>N</i>-methylformamide Nickel(II) Complex X-ray Structure Analysis Online, 2015, 31, 45 |
| 1551627 | CIF | C41 H49 F6 N4 O6 Rh2 | P -1 | 11.4725; 12.4679; 16.113 77.391; 75.265; 85.548 | 2174.6 | HANDA, Makoto; TAKAHASHI, Kazuki; INOUE, Asami; IKEUE, Takahisa; YOSHIOKA, Daisuke; MIKURIYA, Masahiro Crystal Structure of a Lantern-Type Dirhodium(II) Complex with a <i>cis</i>-(2:2) Arrangement of Two Formamidinato and Two Trifluoroacetato Bridges X-ray Structure Analysis Online, 2015, 31, 31 |
| 1551628 | CIF | C10 H13 N3 O2 S | P 1 21/c 1 | 8.496; 8.504; 17.2236 90; 111.513; 90 | 1157.71 | de Oliveira, Adriano Bof; Beck, Johannes; Daniels, Jörg; Feitosa, Bárbara Regina Santos Crystal Structure of 4-Hydroxy-3-methoxybenzaldehyde-4-methylthiosemicarbazone X-ray Structure Analysis Online, 2015, 31, 5 |
| 1551629 | CIF | C16 H17 N O4 S2 | P 1 2/c 1 | 14.1757; 8.23382; 28.6476 90; 102.007; 90 | 3270.59 | IGARASHI, Ryota; NAGASE, Hiromasa; FURUISHI, Takayuki; TOMONO, Kazuo; ENDO, Tomohiro; UEDA, Haruhisa Crystal Structure of an Epalrestat Methanol Solvate X-ray Structure Analysis Online, 2015, 31, 1 |
| 1551630 | CIF | C20 H23 N O2 | P -1 | 6.425; 8.495; 16.665 93.09; 98.399; 110.373 | 838.1 | KUBO, Kanji; MATSUMOTO, Taisuke; IDETA, Keiko; UJIIE, Seiji Mesomorphic Property and Crystal Structure of 4-Carboxybenzylidene-4′-hexylaniline X-ray Structure Analysis Online, 2015, 31, 39 |
| 1551631 | CIF | C12 H31 Cl2 N3 O S3 | P 1 21/n 1 | 9.9553; 13.7164; 14.724 90; 102.528; 90 | 1962.7 | MIKURIYA, Masahiro; MIYOSHI, Kazufumi; KURANO, Shuhei; TAGUCHI, Jun; KOTERA, Takanori; YOSHIOKA, Daisuke Synthesis and Crystal Structure of 1,4,7-Tris(2-mercaptoethyl)-1,4,7-triazacyclononane X-ray Structure Analysis Online, 2015, 31, 59 |
| 1551632 | CIF | C25 H28 Cu N6 O6 | P b c n | 12.666; 12.687; 15.113 90; 90; 90 | 2428.6 | SAGA, Makoto; SAKANE, Genta; YAMAZAKI, Shigeo; SAITO, Keiitsu Crystal Structure of a Copper(II) Complex with <i>N</i>,<i>N</i>′-Bis(2-methylquinolyl)-dimethyl-1,3-propanediamine X-ray Structure Analysis Online, 2015, 31, 41 |
| 1551633 | CIF | C14 H14 O6 | P 1 21/c 1 | 5.6929; 13.3409; 9.5865 90; 106.414; 90 | 698.41 | UEJI, Kan; TAMAKI, Yoshinori; MIYAMURA, Kazuo Crystal Structure of 4,4′-Bi(3-(1-methylethoxy)-3-cyclobutene-1,2-dione) X-ray Structure Analysis Online, 2015, 31, 57 |
| 1551634 | CIF | C36 H54 Co4 N10 O12 | P 42/n :2 | 11.608; 11.608; 16.717 90; 90; 90 | 2252.5 | LIM, Jongwan; KIM, Gibeom; DO, Kyungseo; LEE, Seonghyun; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro Tetranuclear Nickel(II) and Cobalt(II) Complexes with 3,5-Dimethyl-1-pyrazolylmethanolato and Acetato Bridges Having a Cubane Core X-ray Structure Analysis Online, 2015, 31, 49 |
| 1551635 | CIF | C36 H54 N10 Ni4 O12 | P 42/n :2 | 11.5812; 11.5812; 16.58 90; 90; 90 | 2223.8 | LIM, Jongwan; KIM, Gibeom; DO, Kyungseo; LEE, Seonghyun; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro Tetranuclear Nickel(II) and Cobalt(II) Complexes with 3,5-Dimethyl-1-pyrazolylmethanolato and Acetato Bridges Having a Cubane Core X-ray Structure Analysis Online, 2015, 31, 49 |
| 1551636 | CIF | C32 H48 Cu2 N2 O8 | C 1 2/c 1 | 21.267; 18.25; 10.1715 90; 99.716; 90 | 3891.2 | MIKURIYA, Masahiro; YANO, Mari; TAKAHASHI, Naoya; YOSHIOKA, Daisuke; TANAKA, Hidekazu; HANDA, Makoto Synthesis and Crystal Structure of a Chain Complex of Copper(II) Pivalate and 1,2-Bis(4-pyridyl)ethane in Relation to Adsorption Property for N<sub>2</sub> X-ray Structure Analysis Online, 2015, 31, 47 |
| 1551637 | CIF | C26 H28 N O3 P | P 1 21/c 1 | 13.273; 9.7015; 18.444 90; 109.5; 90 | 2238.8 | MARANDI, Pari; RAISSI SHABARI, Akbar; KHOSRAVI, Morteza; POURAYOUBI, Mehrdad Synthesis and Crystal Structure of a New Hydrated Phosphinate Salt, [(C<sub>6</sub>H<sub>5</sub>CH<sub>2</sub>)<sub>2</sub>NH<sub>2</sub>][(C<sub>6</sub>H<sub>5</sub>)<sub>2</sub>P(O)(O)]·H<sub>2</sub>O X-ray Structure Analysis Online, 2015, 31, 37 |
| 1551638 | CIF | C34 H50 N2 O4 | C 1 2/c 1 | 31.61; 7.686; 12.807 90; 97.643; 90 | 3084 | KUBO, Kanji; YAMAMOTO, Emi; MATSUMOTO, Taisuke; MORI, Akira Crystal Structure of <i>N</i>,<i>N</i>′-Bis(5-octyloxytropon-2-yl)piperazine X-ray Structure Analysis Online, 2015, 31, 43 |
| 1551639 | CIF | C60 H70 B2 Co N6 O6 | P -1 | 10.9801; 22.581; 23.805 72.198; 87.088; 88.497 | 5612 | YAMAGUCHI, Ryo; YOSHIOKA, Daisuke; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi Structural Feature of an Hexakis-<i>N</i>-methylformamide Cobalt(II) Complex: <i>Pseudo</i>-<i>S</i><sub>6</sub> and <i>Pseudo</i>-<i>C</i><sub>2</sub> Complex Cations X-ray Structure Analysis Online, 2015, 31, 7 |
| 1551640 | CIF | C22 H32 O3 | P 21 21 21 | 8.9849; 12.53; 17.441 90; 90; 90 | 1963.5 | Ortiz, Aylin Viviana Silva; Cabeza, Marisa; Bratoeff, Eugene; Soriano-García, Manuel Crystal Structure and Synthesis of Two Steroidal Derivatives: 3<i>β</i>-Propanoyloxyandrost-5-en-17-one and 3<i>β</i>-Pentanoyloxyandrost-5-en-17-one X-ray Structure Analysis Online, 2015, 31, 9 |
| 1551641 | CIF | C70 H88 B2 Cu N4 O4 | P 1 | 12.2123; 12.5684; 12.9841 100.526; 107.424; 116.156 | 1587.4 | MATSUI, Chihiro; OKAWARA, Toru; NAGAMURA, Toshihiko; TAKEHARA, Kenji Crystal Structure of Bis(acetone-<i>κ</i><i>O</i>)-1,4,8,11-tetraazacyclotetradecane Copper(II) Ditetraphenylborate Acetone Disolvate X-ray Structure Analysis Online, 2015, 31, 53 |
| 1551642 | CIF | C7 H11 N O3 | P 21 21 21 | 6.4713; 6.7196; 17.9369 90; 90; 90 | 779.98 | INADA, Aya; KANAZAWA, Hitoshi; UEKUSA, Hidehiro Crystal Structure of <font size=-1>L</font>-Isoleucine <i>N</i>-Carboxy Anhydride X-ray Structure Analysis Online, 2015, 31, 17 |
| 1551643 | CIF | C30 H40 Cl4 Co2 N10 | P 1 21/n 1 | 12.4671; 10.1719; 29.292 90; 101.26; 90 | 3643.1 | LIM, Jongwan; SON, Young; GU, Gimoon; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro Dinuclear Cobalt(II) Complex with <i>N</i>,<i>N</i>,<i>N</i>′,<i>N</i>′-Tetrakis(3,5-dimethyl-1-pyrazolyl)methyl-1,4-phenylenediamine Having a Tetrahedral Coordination Geometry X-ray Structure Analysis Online, 2015, 31, 25 |
| 1551644 | CIF | C10 H13 Cl F N O2 | P b c a | 24.679; 9.873; 9.253 90; 90; 90 | 2254.5 | Guillon, Jean; Pinaud, Noël; Marchivie, Mathieu; Ronga, Luisa; Benazzouz, Abdelhamid; Moreau, Stéphane Crystal Structure of a Fluoro Analogue of 3,4-(Methylenedioxy)amphetamine X-ray Structure Analysis Online, 2015, 31, 23 |
| 1551645 | CIF | C27 H19 N O2 | P 1 21/n 1 | 9.837; 13.221; 16.325 90; 107.914; 90 | 2020.2 | AKITA, Motoko; KIMURA, Yuko; KOBAYASHI, Keiji Crystal Structure of 2-(<i>p</i>-Anilinophenyl)-2-phenylindan-1,3-dione and Its Unexpected Formation X-ray Structure Analysis Online, 2015, 31, 13 |
| 1551646 | CIF | C22 H20 N2 O2 | P 1 21/c 1 | 8.7451; 15.1964; 6.9425 90; 113.561; 90 | 845.7 | AKITA, Motoko; KASONO, Masaki; KOBAYASHI, Keiji Crystal Structure of 3,3′-Ethanediylidenebis(1-ethylindoline-2-one): An Unexpected Byproduct in <i>N</i>-Ethylation of Isatin in Tetrahydrofurane X-ray Structure Analysis Online, 2015, 31, 11 |
| 1551647 | CIF | C17 H17 Br O4 S | P 1 21/c 1 | 9.4884; 9.5235; 18.154 90; 95.203; 90 | 1633.69 | KUBO, Kanji; MATSUMOTO, Taisuke Crystal Structure of 7-Bromo-4-isopropyl-2-[[(4-methylphenyl)sulfonyl]oxy]-tropone X-ray Structure Analysis Online, 2015, 31, 29 |
| 1551844 | CIF | C49 H36 N8 | I 41/a :2 | 23.6365; 23.6365; 7.1651 90; 90; 90 | 4003 | Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers Nature Chemistry, 2015, 7, 634-640 |
| 1551845 | CIF | C53 H44 N8 | I 41/a :2 | 24.2515; 24.2515; 7.7078 90; 90; 90 | 4533.2 | Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers Nature Chemistry, 2015, 7, 634-640 |
| 1551846 | CIF | C53 H44 N8 | I 41/a :2 | 24.072; 24.072; 7.4555 90; 90; 90 | 4320.2 | Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers Nature Chemistry, 2015, 7, 634-640 |
| 1551847 | CIF | C16.25 H17 N2 | I -4 | 20.205; 20.205; 7.278 90; 90; 90 | 2971.2 | Massimo Baroncini; Simone d Agostino; Giacomo Bergamini; Paola Ceroni; Angiolina Comotti; Piero Sozzani; Irene Bassanetti; Fabrizia Grepioni; Taylor M. Hernandez; Serena Silvi; Margherita Venturi; Alberto Credi Photoinduced reversible switching of porosity in molecular crystals based on star-shaped azobenzene tetramers Nature Chemistry, 2015, 7, 634-640 |
| 1551923 | CIF | C108 H72 Cl6 N18 O27 | P 1 21/c 1 | 19.4062; 30.4471; 19.8996 90; 101.576; 90 | 11518.8 | Hao Li; Huacheng Zhang; Aaron D. Lammer; Ming Wang; Xiaopeng Li; Vincent M. Lynch; Jonathan L. Sessler Quantitative self-assembly of a purely organic three-dimensional catenane in water Nature Chemistry, 2015, 7, 1003-1008 |
| 1551959 | CIF | C26 H23 N O4 | P 21 21 21 | 7.0956; 11.5517; 24.171 90; 90; 90 | 1981.21 | Tatiana Caneque; Filipe Gomes; Trang Thi Mai; Giovanni Maestri; Max Malacria; Raphael Rodriguez Synthesis of marmycin A and investigation into its cellular activity Nature Chemistry, 2015, 7, 744-751 |
| 1551960 | CIF | C34.48 H34.96 Cl0.96 O14 | C 2 2 21 | 9.8002; 11.4061; 30.952 90; 90; 90 | 3459.9 | Tian Qin; Sarah L. Skraba-Joiner; Zeinab G. Khalil; Richard P. Johnson; Robert J. Capon; John A. Porco Jr Atropselective syntheses of (-) and (+) rugulotrosin A utilizing point-to-axial chirality transfer Nature Chemistry, 2015, 7, 234-240 |
| 1551961 | CIF | C40 H42 O16 | P 1 21 1 | 11.3036; 15.895; 11.5465 90; 111.075; 90 | 1935.8 | Tian Qin; Sarah L. Skraba-Joiner; Zeinab G. Khalil; Richard P. Johnson; Robert J. Capon; John A. Porco Jr Atropselective syntheses of (-) and (+) rugulotrosin A utilizing point-to-axial chirality transfer Nature Chemistry, 2015, 7, 234-240 |
| 1551962 | CIF | C33 H77 As N4 Si3 U | P m c n | 20.8958; 12.54925; 16.04531 90; 90; 90 | 4207.51 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
| 1551963 | CIF | C33 H77 As N4 Si3 U | P n a 21 | 16.04632; 12.55844; 20.9096 90; 90; 90 | 4213.63 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
| 1551964 | CIF | C61 H116 As K N4 O10 Si3 U | P 1 21/c 1 | 16.2073; 19.3582; 24.0982 90; 104.211; 90 | 7329.3 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
| 1551965 | CIF | C40.4 H82.5 As K2 N4 Si3 U | P 1 21/n 1 | 17.84985; 34.2192; 32.8697 90; 97.2734; 90 | 19915.5 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
| 1551966 | CIF | C52.5 H115.5 As K N6 O6 Si3 U | P -1 | 15.3188; 18.8965; 24.8556 88.3008; 89.3347; 68.8052 | 6705.3 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
| 1551967 | CIF | C101 H198 As3 K N8 O10 Si6 U2 | P 1 2/n 1 | 13.1907; 20.1898; 22.7981 90; 105.065; 90 | 5862.9 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
| 1551968 | CIF | C6 H6 F6 | P 1 21 1 | 5.556; 5.842; 10.511 90; 93.54; 90 | 340.5 | Neil S. Keddie; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; David O Hagan All-cis 1,2,3,4,5,6-hexafluorocyclohexane is a facially polarized cyclohexane Nature Chemistry, 2015, 7, 483-488 |
| 1551969 | CIF | C6 H8 O4 | P c a 21 | 11.166; 12.913; 8.653 90; 90; 90 | 1247.6 | Neil S. Keddie; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; David O Hagan All-cis 1,2,3,4,5,6-hexafluorocyclohexane is a facially polarized cyclohexane Nature Chemistry, 2015, 7, 483-488 |
| 1551970 | CIF | C6 H8 F4 O2 | P 21 21 2 | 11.4368; 11.7139; 10.7701 90; 90; 90 | 1442.9 | Neil S. Keddie; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; David O Hagan All-cis 1,2,3,4,5,6-hexafluorocyclohexane is a facially polarized cyclohexane Nature Chemistry, 2015, 7, 483-488 |
| 1551971 | CIF | C6 H7 F5 O | P 1 21 1 | 5.7119; 5.5655; 11.244 90; 93.724; 90 | 356.69 | Neil S. Keddie; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; David O Hagan All-cis 1,2,3,4,5,6-hexafluorocyclohexane is a facially polarized cyclohexane Nature Chemistry, 2015, 7, 483-488 |
| 1551972 | CIF | C7 H6 F8 O3 S | P 1 21 1 | 5.6059; 7.4253; 13.076 90; 97.192; 90 | 540 | Neil S. Keddie; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; David O Hagan All-cis 1,2,3,4,5,6-hexafluorocyclohexane is a facially polarized cyclohexane Nature Chemistry, 2015, 7, 483-488 |
| 1552503 | CIF | Cr2 Mg O4 | C m c m | 2.85107; 9.4893; 9.67853 90; 90; 90 | 261.849 | Ishii, T.; Kojitani, H.; Fujino, K.; Yusa, H.; Mori, D.; Inaguma, Y.; Matsushita, Y.; Yamamura, K.; Akaogi, M. High-pressure high-temperature transitions in MgCr2O4 and crystal structures of new Mg2Cr2O5 and post-spinel MgCr2O4 phases with implications for ultrahigh-pressure chromitites in ophiolites American Mineralogist, 2015, 100, 59-65 |
| 1552953 | CIF | C61 H69.4 N4 O12.7 P4 | P -1 | 6.5913; 13.2499; 17.1269 97.941; 94.83; 96.958 | 1462.74 | Venkatramaiah, N.; Pereira, Carla F.; Mendes, Ricardo F.; Paz, Filipe A Almeida; Tomé, João P C Phosphonate appended porphyrins as versatile chemosensors for selective detection of trinitrotoluene. Analytical chemistry, 2015, 87, 4515-4522 |
| 1552954 | CIF | C48 H48 N6 O12 P4 | P -1 | 13.1137; 13.9435; 17.8162 70.854; 82.606; 77.84 | 3002.2 | Venkatramaiah, N.; Pereira, Carla F.; Mendes, Ricardo F.; Paz, Filipe A Almeida; Tomé, João P C Phosphonate appended porphyrins as versatile chemosensors for selective detection of trinitrotoluene. Analytical chemistry, 2015, 87, 4515-4522 |
| 1552955 | CIF | C44 H28 N4 O20 P4 S2 | P 1 21/m 1 | 8.381; 19.609; 17.205 90; 101.644; 90 | 2769.3 | Venkatramaiah, N.; Pereira, Carla F.; Mendes, Ricardo F.; Paz, Filipe A Almeida; Tomé, João P C Phosphonate appended porphyrins as versatile chemosensors for selective detection of trinitrotoluene. Analytical chemistry, 2015, 87, 4515-4522 |
| 1553040 | CIF | C27 H31 N O6 S | P 1 21 1 | 18.2388; 14.6418; 20.7375 90; 90.251; 90 | 5537.9 | Liu, Feng; Wang, Yidong; Ye, Weiming; Zhang, Junliang Gold(i)-catalyzed asymmetric [3 + 2]-cycloadditions of γ-1-ethoxyethoxy-propiolates and aldehydes Organic Chemistry Frontiers, 2015, 2, 221 |
| 1553041 | CIF | C38 H42 Au Cl N O2 P | P 1 21 1 | 8.893; 20.6873; 9.7453 90; 105.318; 90 | 1729.17 | Liu, Feng; Wang, Yidong; Ye, Weiming; Zhang, Junliang Gold(i)-catalyzed asymmetric [3 + 2]-cycloadditions of γ-1-ethoxyethoxy-propiolates and aldehydes Organic Chemistry Frontiers, 2015, 2, 221 |
| 1553042 | CIF | C92 H98 N8 | P n n 2 | 15.865; 16.43; 14.961 90; 90; 90 | 3899.8 | Ie, Machiko; Setsune, Jun-ichiro; Eda, Kazuo; Tsuda, Akihiko Chiroptical sensing of oligonucleotides with a cyclic octapyrrole Organic Chemistry Frontiers, 2015, 2, 29 |
| 1553043 | CIF | C20 H20 N2 O2 | P 21 21 21 | 10.255; 10.8108; 15.4763 90; 90; 90 | 1715.8 | Yin, Xue-Song; Li, Yi-Chen; Yuan, Jun; Gu, Wen-Jia; Shi, Bing-Feng Copper(ii)-catalyzed methoxylation of unactivated (hetero)aryl C‒H bonds using a removable bidentate auxiliary Organic Chemistry Frontiers, 2015, 2, 119 |
| 1553044 | CIF | C17 H17 F3 N2 O2 | P 1 21/c 1 | 10.5428; 16.2625; 10.8624 90; 118.846; 90 | 1631.3 | Yin, Xue-Song; Li, Yi-Chen; Yuan, Jun; Gu, Wen-Jia; Shi, Bing-Feng Copper(ii)-catalyzed methoxylation of unactivated (hetero)aryl C‒H bonds using a removable bidentate auxiliary Organic Chemistry Frontiers, 2015, 2, 119 |
| 1553045 | CIF | C16 H19 N3 O2 | P -1 | 8.0742; 12.4409; 17.6473 71.94; 79.009; 72.177 | 1595.4 | Yin, Xue-Song; Li, Yi-Chen; Yuan, Jun; Gu, Wen-Jia; Shi, Bing-Feng Copper(ii)-catalyzed methoxylation of unactivated (hetero)aryl C‒H bonds using a removable bidentate auxiliary Organic Chemistry Frontiers, 2015, 2, 119 |
| 1553046 | CIF | C44 H33 F10 Ir N11 P | P -1 | 9.5524; 13.2533; 18.9296 101.946; 101.154; 103.248 | 2208 | Cai, Rong; Yan, Wuming; Bologna, Matthew G.; de Silva, Kaushalya; Ma, Zhao; Finklea, Harry O.; Petersen, Jeffrey L.; Li, Minyong; Shi, Xiaodong Synthesis and characterization of N-2-aryl-1,2,3-triazole based iridium complexes as photocatalysts with tunable photoredox potential Organic Chemistry Frontiers, 2015, 2, 141 |
| 1553047 | CIF | C34 H23 F2 Ir N8 O | P -1 | 11.0054; 14.2851; 21.789 71.698; 89.997; 67.306 | 2971.6 | Cai, Rong; Yan, Wuming; Bologna, Matthew G.; de Silva, Kaushalya; Ma, Zhao; Finklea, Harry O.; Petersen, Jeffrey L.; Li, Minyong; Shi, Xiaodong Synthesis and characterization of N-2-aryl-1,2,3-triazole based iridium complexes as photocatalysts with tunable photoredox potential Organic Chemistry Frontiers, 2015, 2, 141 |
| 1553048 | CIF | C27 H33 N O3 S Si | P 1 21/c 1 | 10.8466; 23.0405; 10.6995 90; 102.658; 90 | 2608.9 | Shen, Kun; Han, Xiuling; Xia, Guoqin; Lu, Xiyan Cationic Pd(ii)-catalyzed cyclization of N-tosyl-aniline tethered alkynyl ketones initiated by hydropalladation of alkynes: a facile way to 1,2-dihydro or 1,2,3,4-tetrahydroquinoline derivatives Organic Chemistry Frontiers, 2015, 2, 145 |
| 1553049 | CIF | C26 H28 Cl N O3 S Si | C 1 2/c 1 | 32.673; 12.2122; 12.9554 90; 92.633; 90 | 5163.9 | Shen, Kun; Han, Xiuling; Xia, Guoqin; Lu, Xiyan Cationic Pd(ii)-catalyzed cyclization of N-tosyl-aniline tethered alkynyl ketones initiated by hydropalladation of alkynes: a facile way to 1,2-dihydro or 1,2,3,4-tetrahydroquinoline derivatives Organic Chemistry Frontiers, 2015, 2, 145 |
| 1553050 | CIF | C32 H53 B11 N2 | P b c a | 17.5053; 20.281; 21.1684 90; 90; 90 | 7515.3 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553051 | CIF | C32 H55 B11 N2 | P b c a | 17.474; 20.161; 21.123 90; 90; 90 | 7441.5 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553052 | CIF | C26 H43 B11 N2 | P 21 21 21 | 11.591; 15.516; 16.796 90; 90; 90 | 3020.7 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553053 | CIF | C41 H63 B11 N2 O | P 21 21 21 | 10.343; 18.963; 22.347 90; 90; 90 | 4383 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553054 | CIF | C33 H55 B11 N2 | P b c a | 17.5189; 20.3686; 21.3348 90; 90; 90 | 7613 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553055 | CIF | C27 H43 B11 N2 | P 1 21/n 1 | 10.2998; 16.7445; 19.7479 90; 101.979; 90 | 3331.7 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553056 | CIF | C39 H59 B11 N2 | P 21 21 21 | 10.4375; 19.3175; 22.8874 90; 90; 90 | 4614.7 | Zheng, Fangrui; Xie, Zuowei Reaction of N-heterocyclic carbenes with 13-vertex closo-carboranes: synthesis and structural characterization of zwitterionic salts of 13-vertex nido-carboranes Organic Chemistry Frontiers, 2015, 2, 55 |
| 1553057 | CIF | C20 H23 N3 O2 S | P 1 21/n 1 | 9.2469; 12.1137; 17.1803 90; 99.893; 90 | 1895.8 | Zhu, Tong-Hao; Wei, Tian-Qi; Wang, Shun-Yi; Ji, Shun-Jun NIS/CHP-mediated reaction of isocyanides with hydrazones: access to aminopyrazoles Organic Chemistry Frontiers, 2015, 2, 259 |
| 1553058 | CIF | C25 H25 Br N2 O7 | P 21 21 21 | 10.943; 12.564; 18.454 90; 90; 90 | 2537.2 | Sun, Qiang-Sheng; Chen, Xiao-Yang; Zhu, Hua; Lin, Hua; Sun, Xing-Wen; Lin, Guo-Qiang Asymmetric synthesis of poly-substituted spirocyclohexane oxindole via a squaramide catalyzed cascade Michael‒Michael‒aldol sequence Organic Chemistry Frontiers, 2015, 2, 110 |
| 1553059 | CIF | C17 H18 Br N O5 | P 21 21 21 | 6.6023; 7.8736; 32.754 90; 90; 90 | 1702.7 | Li, Ying-Zi; Wang, Jie; Sun, Wang-Bin; Shan, Yi-Fan; Sun, Bing-Feng; Lin, Guo-Qiang; Zou, Jian-Ping Enantioselective synthesis of bicyclo[2.2.2]octane-1-carboxylates under metal free conditions Organic Chemistry Frontiers, 2015, 2, 274 |
| 1553060 | CIF | C12 H17 N O4 S | P 21 21 21 | 8.7741; 9.7409; 14.5365 90; 90; 90 | 1242.4 | Riaño, Iker; Uria, Uxue; Carrillo, Luisa; Reyes, Efraim; Vicario, Jose L. 4-Alkenyl-5H-1,2,3-oxathiazole 2,2-dioxides in catalytic and enantioselective [4 + 2] cycloaddition through iminium activation. Straightforward access to the trans-decaline framework and to densely functionalized cyclohexanes Organic Chemistry Frontiers, 2015, 2, 206 |
| 1553061 | CIF | C8 H10 O3 | P -1 | 3.9045; 9.1939; 22.5383 88.422; 88.131; 78.161 | 791.26 | Wang, Qiang; Xu, Qin; Shi, Min Co-catalysis between DABCO and a Brønsted acid in the catalytic [4 + 2] annulation of isatin with but-3-yn-2-one and mechanistic investigations Organic Chemistry Frontiers, 2015, 2, 211 |
| 1553062 | CIF | C21 H19 N O3 | P -1 | 8.1086; 8.8324; 13.26 108.838; 97.636; 94.663 | 883 | Wang, Qiang; Xu, Qin; Shi, Min Co-catalysis between DABCO and a Brønsted acid in the catalytic [4 + 2] annulation of isatin with but-3-yn-2-one and mechanistic investigations Organic Chemistry Frontiers, 2015, 2, 211 |
| 1553063 | CIF | C77 H89 Br4 Cl3 F8 I4 N4 O8 | P 4/n c c :2 | 18.4165; 18.4165; 27.9044 90; 90; 90 | 9464.3 | Beyeh, N. Kodiah; Valkonen, Arto; Bhowmik, Sandip; Pan, Fangfang; Rissanen, K. N-Alkyl ammonium resorcinarene salts: multivalent halogen-bonded deep-cavity cavitands Organic Chemistry Frontiers, 2015, 2, 340 |
| 1553064 | CIF | C72 H114 Br4 Cl2 N4 O9 | P b c a | 23.3371; 23.5232; 27.0473 90; 90; 90 | 14848 | Beyeh, N. Kodiah; Valkonen, Arto; Bhowmik, Sandip; Pan, Fangfang; Rissanen, K. N-Alkyl ammonium resorcinarene salts: multivalent halogen-bonded deep-cavity cavitands Organic Chemistry Frontiers, 2015, 2, 340 |
| 1553065 | CIF | C7 H7 Cl N O2 | C 1 2/c 1 | 24.849; 4.7231; 14.8643 90; 103.467; 90 | 1696.6 | Barnes, Korry L.; Chen, Kelly; Catalano, Vincent J.; Jeffrey, Christopher S. New building blocks for iminosugars: a concise synthesis of polyhydroxylated N-alkoxypiperidines through an intramolecular azepine ring contraction Organic Chemistry Frontiers, 2015, 2, 497 |
| 1553066 | CIF | C13 H17 N O3 | P -1 | 9.9549; 11.3328; 11.8818 106.461; 101.618; 100.174 | 1219.6 | Barnes, Korry L.; Chen, Kelly; Catalano, Vincent J.; Jeffrey, Christopher S. New building blocks for iminosugars: a concise synthesis of polyhydroxylated N-alkoxypiperidines through an intramolecular azepine ring contraction Organic Chemistry Frontiers, 2015, 2, 497 |
| 1553067 | CIF | C13 H19 N O5 | P -1 | 5.3906; 15.9299; 17.3564 112.457; 97.7331; 99.3952 | 1326.85 | Barnes, Korry L.; Chen, Kelly; Catalano, Vincent J.; Jeffrey, Christopher S. New building blocks for iminosugars: a concise synthesis of polyhydroxylated N-alkoxypiperidines through an intramolecular azepine ring contraction Organic Chemistry Frontiers, 2015, 2, 497 |
| 1553068 | CIF | C15 H11 N O2 | P -1 | 7.1432; 8.4932; 10.1874 99.388; 97.577; 106.771 | 573.27 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553069 | CIF | C22 H20 N2 O4 | P 1 21/n 1 | 7.0179; 4.6365; 29.074 90; 92.757; 90 | 944.93 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553070 | CIF | C21 H21 N3 O | P 1 c 1 | 18.2723; 5.5654; 8.7266 90; 103.633; 90 | 862.43 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553071 | CIF | C23 H16 O | P 1 21 1 | 11.008; 7.5883; 19.571 90; 90.988; 90 | 1634.6 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553072 | CIF | C22 H23 N O2 | P -1 | 9.1264; 9.7169; 10.2731 95.504; 91.157; 101.221 | 888.78 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553073 | CIF | C20 H18 N4 O2 | P -1 | 5.6257; 19.7469; 23.768 79.737; 88.28; 82.746 | 2577.3 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553074 | CIF | C20 H13 N O4 | P -1 | 7.1728; 8.0196; 12.8455 84.142; 89.687; 87.901 | 734.56 | Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds Organic Chemistry Frontiers, 2015, 2, 312 |
| 1553075 | CIF | C9 H9 N7 O | P c a 21 | 9.9162; 14.8123; 7.3118 90; 90; 90 | 1073.97 | Quinodoz, Pierre; Lo, Cheikh; Kletskii, Mikhail; Burov, Oleg; Marrot, Jérôme; Couty, François Regio- and stereoselective synthesis of α-hydroxy-β-azido tetrazoles Organic Chemistry Frontiers, 2015, 2, 492 |
| 1553076 | CIF | C15 H13 N O5 S | P 32 | 10.3879; 10.3879; 24.218 90; 90; 120 | 2263.2 | Quan, Mao; Yang, Guoqiang; Xie, Fang; Gridnev, Ilya D.; Zhang, Wanbin Pd(ii)-catalyzed asymmetric addition of arylboronic acids to cyclic N-sulfonyl ketimine esters and a DFT study of its mechanism Organic Chemistry Frontiers, 2015, 2, 398 |
| 1553083 | CIF | C23 H21 B F10 N2 | P 1 21/c 1 | 19.6299; 19.4566; 12.265 90; 101.938; 90 | 4583.1 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553084 | CIF | C23 H18.711 B F10 N2 | P 1 21/n 1 | 11.5423; 12.863; 15.801 90; 93.409; 90 | 2341.8 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553085 | CIF | C29 H39 B N2 | P c c n | 16.756; 19.073; 15.93 90; 90; 90 | 5091 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553086 | CIF | C18 H25 B N2 | P 1 21 1 | 8.4021; 10.0498; 9.2882 90; 93.645; 90 | 782.7 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553087 | CIF | C13 H23 B N2 | P 1 21 1 | 9.2454; 7.0797; 9.5352 90; 100.812; 90 | 613.04 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553088 | CIF | C15 H27 B N2 | P 1 21/c 1 | 7.4085; 9.5348; 20.4481 90; 97.479; 90 | 1432.14 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553089 | CIF | C13 H21 B Cl2 N2 | P 1 21/n 1 | 8.8877; 14.4614; 10.8854 90; 91.815; 90 | 1398.38 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553090 | CIF | C37 H20 B2 Cl2 F20 N2 | P 1 c 1 | 10.6012; 10.7318; 16.8601 90; 105.327; 90 | 1849.9 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553091 | CIF | C11 H24 B P | P 1 21/c 1 | 11.0408; 6.6868; 16.9825 90; 97.038; 90 | 1244.3 | Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science, 2015, 6, 2010-2015 |
| 1553095 | CIF | C14 H16 O3 | P -1 | 9.017; 12.174; 12.8341 108.889; 99.634; 109.852 | 1191.34 | Dethe, Dattatraya H.; Boda, Raghavender; Murhade, Ganesh M. Lewis acid catalyzed Nazarov type cyclization for the synthesis of a substituted indane framework: total synthesis of (±)-mutisianthol Organic Chemistry Frontiers, 2015, 2, 645 |
| 1553096 | CIF | C56 H79 B5 O10 | P 21 21 21 | 12.38928; 20.5595; 23.639 90; 90; 90 | 6021.26 | Da Ros, Sara; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S. Boronic esters of corannulene: potential building blocks toward icosahedral supramolecules Organic Chemistry Frontiers, 2015, 2, 626 |
| 1553097 | CIF | C46 H46 B5 Cl3 O10 | P m n 21 | 20.2644; 13.18215; 8.2499 90; 90; 90 | 2203.78 | Da Ros, Sara; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S. Boronic esters of corannulene: potential building blocks toward icosahedral supramolecules Organic Chemistry Frontiers, 2015, 2, 626 |
| 1553098 | CIF | C32 H22 Cl2 Si | P 1 21/c 1 | 9.959; 24.396; 11.0384 90; 108.602; 90 | 2541.8 | Xu, Liang; Zhang, Shuai; Li, Pengfei Synthesis of silafluorenes and silaindenes via silyl radicals from arylhydrosilanes: intramolecular cyclization and intermolecular annulation with alkynes Organic Chemistry Frontiers, 2015, 2, 459 |
| 1553099 | CIF | C25 H29 N O3 | P 21 21 21 | 5.572; 15.48; 25.4858 90; 90; 90 | 2198.3 | Arena, Giada; Cini, Elena; Petricci, Elena; Randino, Rosario; Taddei, Maurizio A highly stereo-controlled protocol to prepare pipecolic acids based on Heck and cyclohydrocarbonylation reactions Organic Chemistry Frontiers, 2015, 2, 526 |
| 1553100 | CIF | C23 H16 O3.19 | P 1 21/c 1 | 22.264; 10.1945; 30.92 90; 91.849; 90 | 7014 | Liu, Tong; Ding, Qiuping; Zong, Qianshou; Qiu, Guanyinsheng Radical 5-exo cyclization of alkynoates with 2-oxoacetic acids for synthesis of 3-acylcoumarins Organic Chemistry Frontiers, 2015, 2, 670 |
| 1553101 | CIF | C18 H13 N O2 | P -1 | 7.159; 9.364; 10.541 78.846; 82.356; 72.557 | 659.3 | Dethe, Dattatraya H.; Kumar B, Vijay Concise asymmetric total synthesis of bruceolline J Organic Chemistry Frontiers, 2015, 2, 548 |
| 1553102 | CIF | C30 H24 F12 N6 Ru Sb2 | P -3 c 1 | 10.786; 10.786; 17.286 90; 90; 120 | 1741.59 | Gomes, Filipe; Narbonne, Vanessa; Blanchard, Florent; Maestri, Giovanni; Malacria, Max Formal base-free homolytic aromatic substitutions via photoredox catalysis Organic Chemistry Frontiers, 2015, 2, 464 |
| 1553103 | CIF | C16 H22 N O3 S | P -1 | 6.2097; 11.272; 11.547 104.782; 101.238; 100.235 | 744.1 | Zhang, Yan-Yan; Hao, Jian; Shi, Min One pot cascade synthesis of fused heterocycles from furan-tethered terminal alkynes and aldehydes in the presence of amines and CuBr Organic Chemistry Frontiers, 2015, 2, 394 |
| 1553104 | CIF | C16 H17 N O3 S | P -1 | 8.3878; 9.8582; 19.139 76.354; 84.421; 73.985 | 1477.3 | Zhang, Yan-Yan; Hao, Jian; Shi, Min One pot cascade synthesis of fused heterocycles from furan-tethered terminal alkynes and aldehydes in the presence of amines and CuBr Organic Chemistry Frontiers, 2015, 2, 394 |
| 1553105 | CIF | C17 H19 N O3 S | P 1 21/c 1 | 14.5933; 9.6858; 11.3977 90; 92.745; 90 | 1609.2 | Zhang, Yan-Yan; Hao, Jian; Shi, Min One pot cascade synthesis of fused heterocycles from furan-tethered terminal alkynes and aldehydes in the presence of amines and CuBr Organic Chemistry Frontiers, 2015, 2, 394 |
| 1553106 | CIF | C33 H30 Br N O5 | I 2 2 2 | 15.713; 28.08; 28.507 90; 90; 90 | 12578 | Zhang, Jun-Wei; Liu, Xiao-Wei; Gu, Qing; Shi, Xiao-Xin; You, Shu-Li Enantioselective synthesis of 4,5,6,7-tetrahydroindoles via olefin cross-metathesis/intramolecular Friedel‒Crafts alkylation reaction of pyrroles Organic Chemistry Frontiers, 2015, 2, 476 |
| 1553107 | CIF | C17 H0 I2 N3 O6 | P 1 21/c 1 | 5.5881; 18.985; 10.6706 90; 94.113; 90 | 1129.13 | Zhang, Shuo; Chen, Ying; Wang, Jianwu; Pan, Yue; Xu, Zhenghu; Tung, Chen-Ho An efficient synthesis of gem-diiodoolefins and (E)-iodoalkenes from propargylic amides with a Cu(i)/Cu(iii) cycle Organic Chemistry Frontiers, 2015, 2, 578 |
| 1553108 | CIF | C23 H25 N O5 | P -1 | 9.2215; 10.9612; 11.6484 87.764; 69.092; 73.409 | 1051.48 | Zhang, Shuo; Chen, Ying; Wang, Jianwu; Pan, Yue; Xu, Zhenghu; Tung, Chen-Ho An efficient synthesis of gem-diiodoolefins and (E)-iodoalkenes from propargylic amides with a Cu(i)/Cu(iii) cycle Organic Chemistry Frontiers, 2015, 2, 578 |
| 1553109 | CIF | C23 H17 I O3 | C 1 2/c 1 | 26.291; 8.781; 18.363 90; 111.863; 90 | 3934 | Zhu, Hai-Tao; Fan, Ming-Jin; Yang, De-Suo; Wang, Xiao-Ling; Ke, Sen; Zhang, Chao-Yang; Guan, Zheng-Hui An iodine-promoted Meyer‒Schuster rearrangement for the synthesis of α-iodo unsaturated ketones Organic Chemistry Frontiers, 2015, 2, 506 |
| 1553110 | CIF | C59 H49 Cl4 F6 N P3 Rh | P 1 21/c 1 | 12.3535; 28.8354; 15.2713 90; 99.472; 90 | 5365.7 | Chen, Shanshan; Su, Yan; Han, Keli; Li, Xingwei Mechanistic studies on C‒C reductive coupling of five-coordinate Rh(iii) complexes Organic Chemistry Frontiers, 2015, 2, 783 |
| 1553111 | CIF | C65 H61 F6 N O2 P3 Rh | P -1 | 10.8319; 13.2288; 22.0889 75.156; 79.856; 69.201 | 2847.44 | Chen, Shanshan; Su, Yan; Han, Keli; Li, Xingwei Mechanistic studies on C‒C reductive coupling of five-coordinate Rh(iii) complexes Organic Chemistry Frontiers, 2015, 2, 783 |
| 1553112 | CIF | C59 H46 Cl2 F9 N P3 Rh | P 1 21/n 1 | 13.6534; 25.7008; 15.5862 90; 93.092; 90 | 5461.29 | Chen, Shanshan; Su, Yan; Han, Keli; Li, Xingwei Mechanistic studies on C‒C reductive coupling of five-coordinate Rh(iii) complexes Organic Chemistry Frontiers, 2015, 2, 783 |
| 1553113 | CIF | C58 H52 B Cl6 F4 N O Os P2 | P 1 21/n 1 | 16.5731; 19.6848; 18.1839 90; 112.182; 90 | 5493.2 | Wei, Yuanqing; Zhou, Xiaoxi; Hong, Guangning; Chen, Zhixin; Zhang, Hong; Xia, Haiping Reactions of osmapyridinium with terminal alkynes Organic Chemistry Frontiers, 2015, 2, 560 |
| 1553114 | CIF | C56.25 H52.25 B Cl2.75 F4 N O3 Os P2 | P 1 21/c 1 | 11.9299; 14.1946; 33.0235 90; 98.576; 90 | 5529.7 | Wei, Yuanqing; Zhou, Xiaoxi; Hong, Guangning; Chen, Zhixin; Zhang, Hong; Xia, Haiping Reactions of osmapyridinium with terminal alkynes Organic Chemistry Frontiers, 2015, 2, 560 |
| 1553115 | CIF | C50 H43 B Cl5 F4 N3 O Os P | P 1 21/c 1 | 12.0746; 18.8448; 20.9677 90; 90.023; 90 | 4771.06 | Wei, Yuanqing; Zhou, Xiaoxi; Hong, Guangning; Chen, Zhixin; Zhang, Hong; Xia, Haiping Reactions of osmapyridinium with terminal alkynes Organic Chemistry Frontiers, 2015, 2, 560 |
| 1553116 | CIF | C52 H55 B Cl4 F4 N3 Os P | C 1 c 1 | 19.3445; 16.8974; 16.1902 90; 111.004; 90 | 4940.5 | Wei, Yuanqing; Zhou, Xiaoxi; Hong, Guangning; Chen, Zhixin; Zhang, Hong; Xia, Haiping Reactions of osmapyridinium with terminal alkynes Organic Chemistry Frontiers, 2015, 2, 560 |
| 1553117 | CIF | C19 H21 N O3 | P 1 21/c 1 | 7.2941; 13.2249; 17.2264 90; 96.919; 90 | 1649.62 | Santos, Hugo; Distiller, Amy; D'Souza, Asha M.; Arnoux, Quentin; White, Jonathan M.; Meyer, Adam G.; Ryan, John H. 1,3-Dipolar cycloaddition reactions of phthalic anhydrides with an azomethine ylide Organic Chemistry Frontiers, 2015, 2, 705 |
| 1553118 | CIF | C32 H37 N O4 S Sn | P 1 21 1 | 8.592; 10.956; 16.545 90; 92.673; 90 | 1556 | Kamimura, Akio; Yoshinaga, Tatsuro; Noguchi, Fumiaki; Miyazaki, Koichiro; Uno, Hidemitsu A mechanistic study on the SHi reaction at tin atoms in a radical cascade reaction Organic Chemistry Frontiers, 2015, 2, 713 |
| 1553119 | CIF | C16 H16 Cl I O S | P 21 21 21 | 7.6495; 12.803; 16.9343 90; 90; 90 | 1658.5 | Berthelot-Bréhier, Anaïs; Panossian, Armen; Colobert, Françoise; Leroux, Frédéric R. Atroposelective synthesis of axially chiral P,S-ligands based on arynes Organic Chemistry Frontiers, 2015, 2, 634 |
| 1553120 | CIF | C28 H26 Cl P S | P 21 21 21 | 9.4309; 13.5255; 19.3191 90; 90; 90 | 2464.3 | Berthelot-Bréhier, Anaïs; Panossian, Armen; Colobert, Françoise; Leroux, Frédéric R. Atroposelective synthesis of axially chiral P,S-ligands based on arynes Organic Chemistry Frontiers, 2015, 2, 634 |
| 1553121 | CIF | C35 H34 Cl3 P Pd S | P 21 21 21 | 11.8312; 15.3726; 17.795 90; 90; 90 | 3236.49 | Berthelot-Bréhier, Anaïs; Panossian, Armen; Colobert, Françoise; Leroux, Frédéric R. Atroposelective synthesis of axially chiral P,S-ligands based on arynes Organic Chemistry Frontiers, 2015, 2, 634 |
| 1553122 | CIF | C19 H20 F3 N | P 1 21 1 | 10.4422; 33.2582; 10.4466 90; 114.77; 90 | 3294.2 | Chen, Mu-Wang; Ye, Zhi-Shi; Chen, Zhang-Pei; Wu, Bo; Zhou, Yong-Gui Enantioselective synthesis of trifluoromethyl substituted piperidines with multiple stereogenic centers via hydrogenation of pyridinium hydrochlorides Organic Chemistry Frontiers, 2015, 2, 586 |
| 1553123 | CIF | C23 H35 N S Si Ti | P 1 21/c 1 | 18.029; 9.695; 14.246 90; 110.517; 90 | 2332.1 | Suzuki, Noriyuki; Asada, Takumi; Kawamura, Akiko; Masuyama, Yoshiro Sulfur-containing stable five-membered “cycloallene” complexes: 1-thia-2-zircona- and 1-thia-2-titanacyclopenta-3,4-dienes Organic Chemistry Frontiers, 2015, 2, 681 |
| 1553124 | CIF | C23 H35 N S Si Zr | P 1 21/c 1 | 18.125; 9.87; 14.346 90; 110.563; 90 | 2402.9 | Suzuki, Noriyuki; Asada, Takumi; Kawamura, Akiko; Masuyama, Yoshiro Sulfur-containing stable five-membered “cycloallene” complexes: 1-thia-2-zircona- and 1-thia-2-titanacyclopenta-3,4-dienes Organic Chemistry Frontiers, 2015, 2, 681 |
| 1553125 | CIF | C18 H25 N S Si Zr | P 1 21/c 1 | 15.471; 9.164; 14.06 90; 108.282; 90 | 1892.8 | Suzuki, Noriyuki; Asada, Takumi; Kawamura, Akiko; Masuyama, Yoshiro Sulfur-containing stable five-membered “cycloallene” complexes: 1-thia-2-zircona- and 1-thia-2-titanacyclopenta-3,4-dienes Organic Chemistry Frontiers, 2015, 2, 681 |
| 1553126 | CIF | C8 H17 N S Si | P -1 | 6.2605; 6.9304; 14.4299 92.0278; 99.0665; 112.207 | 569.305 | Suzuki, Noriyuki; Asada, Takumi; Kawamura, Akiko; Masuyama, Yoshiro Sulfur-containing stable five-membered “cycloallene” complexes: 1-thia-2-zircona- and 1-thia-2-titanacyclopenta-3,4-dienes Organic Chemistry Frontiers, 2015, 2, 681 |
| 1553127 | CIF | C18 H16 O2 S | P 1 21/n 1 | 8.3022; 11.1608; 16.3992 90; 94.272; 90 | 1515.31 | Chen, Dianpeng; Xing, Gangdong; Zhou, Hongwei Sulfone promoted Rh(iii)-catalyzed C‒H activation and base assisted 1,5-H shift strategy for the construction of seven-membered rings Organic Chemistry Frontiers, 2015, 2, 947 |
| 1553128 | CIF | C17 H21 N O3 | P -1 | 8.6808; 8.9707; 11.2873 104.818; 112.003; 92.742 | 777.67 | Liu, Xianglei; Gu, Zhenhua Pd-catalyzed Heck cyclization and in situ hydrocarboxylation or hydromethenylation via a hydrogen borrowing strategy Organic Chemistry Frontiers, 2015, 2, 778 |
| 1553129 | CIF | C16 H25 F O2 | P 21 21 21 | 5.9958; 13.644; 17.789 90; 90; 90 | 1455.3 | Zhang, Xiaofei; Guo, Shuo; Tang, Pingping Transition-metal free oxidative aliphatic C‒H fluorination Organic Chemistry Frontiers, 2015, 2, 806 |
| 1553130 | CIF | C24 H31 F O8 | P 21 21 21 | 8.7359; 12.804; 20.625 90; 90; 90 | 2307 | Zhang, Xiaofei; Guo, Shuo; Tang, Pingping Transition-metal free oxidative aliphatic C‒H fluorination Organic Chemistry Frontiers, 2015, 2, 806 |
| 1553131 | CIF | C16 H24 Cl2 N2 O Pd | P 1 21 1 | 12.1876; 9.8204; 15.854 90; 96.796; 90 | 1884.2 | Yu, Feng; Chen, Pinhong; Liu, Guosheng Pd(ii)-catalyzed intermolecular enantioselective hydroamination of styrenes Organic Chemistry Frontiers, 2015, 2, 819 |
| 1553132 | CIF | C2.889 H5.111 N0.222 O0.667 S0.222 | P 1 21 1 | 10.291; 5.9808; 12.068 90; 103.531; 90 | 722.1 | Ye, Jian-Liang; Zhang, Yu-Feng; Liu, Yang; Zhang, Jin-Yuan; Ruan, Yuan-Ping; Huang, Pei-Qiang Studies on the asymmetric synthesis of pandamarilactonines: an unexpected syn-selective vinylogous Mannich reaction of N-tert-butanesulfinimines Organic Chemistry Frontiers, 2015, 2, 697 |
| 1553133 | CIF | C33 H36 N O8 P S | P -1 | 10.3564; 12.0563; 14.1956 69.77; 82.139; 68.496 | 1547.3 | Kondoh, Azusa; Terada, Masahiro Brønsted base-catalyzed α-oxygenation of carbonyl compounds utilizing the [1,2]-phospha-Brook rearrangement Organic Chemistry Frontiers, 2015, 2, 801 |
| 1553134 | CIF | C11 H13 N O7 S2 | P 21 21 21 | 7.82043; 10.2265; 17.491 90; 90; 90 | 1398.85 | Kang, Jian; Zhu, Baofu; Liu, Jiewei; Wang, Bo; Zhang, Li; Su, Cheng-Yong Chiral dirhodium catalysts derived from l-serine, l-threonine and l-cysteine: design, synthesis and application Organic Chemistry Frontiers, 2015, 2, 890 |
| 1553135 | CIF | C11 H12 N2 O7 S | P 41 | 15.41418; 15.41418; 5.95145 90; 90; 90 | 1414.05 | Kang, Jian; Zhu, Baofu; Liu, Jiewei; Wang, Bo; Zhang, Li; Su, Cheng-Yong Chiral dirhodium catalysts derived from l-serine, l-threonine and l-cysteine: design, synthesis and application Organic Chemistry Frontiers, 2015, 2, 890 |
| 1553136 | CIF | C14 H14 N2 O3 | P 1 2/c 1 | 12.8276; 8.4882; 24.8068 90; 91.044; 90 | 2700.6 | Zhang, Duo; Cui, Xiuling; Yang, Fangfang; Zhang, Qianqian; Zhu, Yu; Wu, Yangjie Palladium-catalyzed direct ortho C‒O bond construction of azoxybenzenes with carboxylic acids and alcohols Organic Chemistry Frontiers, 2015, 2, 951 |
| 1553137 | CIF | C28 H21 F3 N4 O6 Pd2 | P 1 21/c 1 | 14.4863; 17.2032; 11.5651 90; 105.969; 90 | 2770.93 | Zhang, Duo; Cui, Xiuling; Yang, Fangfang; Zhang, Qianqian; Zhu, Yu; Wu, Yangjie Palladium-catalyzed direct ortho C‒O bond construction of azoxybenzenes with carboxylic acids and alcohols Organic Chemistry Frontiers, 2015, 2, 951 |
| 1553138 | CIF | C17 H18 N2 O3 | P -1 | 6.8879; 8.282; 14.4023 104.655; 94.121; 91.668 | 791.85 | Zhang, Duo; Cui, Xiuling; Yang, Fangfang; Zhang, Qianqian; Zhu, Yu; Wu, Yangjie Palladium-catalyzed direct ortho C‒O bond construction of azoxybenzenes with carboxylic acids and alcohols Organic Chemistry Frontiers, 2015, 2, 951 |
| 1553139 | CIF | C20 H26 N O2 S | P -1 | 8.6248; 9.8158; 11.6537 99.05; 101.411; 96.596 | 944.1 | Pan, Dong; Chen, Gen-Qiang; Tang, Xiang-Ying; Shi, Min Palladium-catalyzed intramolecular rearrangement of vinylidenecyclopropanes through C‒C bond activation Organic Chemistry Frontiers, 2015, 2, 792 |
| 1553140 | CIF | C30 H31 N O2 S | P 1 21/n 1 | 8.5768; 10.2978; 28.986 90; 90.183; 90 | 2560.1 | Pan, Dong; Chen, Gen-Qiang; Tang, Xiang-Ying; Shi, Min Palladium-catalyzed intramolecular rearrangement of vinylidenecyclopropanes through C‒C bond activation Organic Chemistry Frontiers, 2015, 2, 792 |
| 1553141 | CIF | C21 H22 Br N3 O5 | P 1 21 1 | 9.8915; 9.4814; 11.942 90; 102.048; 90 | 1095.31 | Hu, Ying; Zhou, Zijun; Gong, Lei; Meggers, Eric Asymmetric aza-Henry reaction to provide oxindoles with quaternary carbon stereocenter catalyzed by a metal-templated chiral Brønsted base Organic Chemistry Frontiers, 2015, 2, 968 |
| 1553142 | CIF | C14 H15 Br N2 O3 | P n a 21 | 7.1573; 21.4898; 9.4975 90; 90; 90 | 1460.8 | Hu, Ying; Zhou, Zijun; Gong, Lei; Meggers, Eric Asymmetric aza-Henry reaction to provide oxindoles with quaternary carbon stereocenter catalyzed by a metal-templated chiral Brønsted base Organic Chemistry Frontiers, 2015, 2, 968 |
| 1553143 | CIF | C70 H66 Cl34 N8 P2 Ru2 | P 1 21/n 1 | 13.25; 16.9695; 23.3436 90; 103.948; 90 | 5093.95 | Mejuto, Carmen; García-Eleno, Marco A.; Guisado-Barrios, Gregorio; Spasyuk, Denis; Gusev, Dmitri; Peris, Eduardo Ruthenium complexes with an N-heterocyclic carbene NNC-pincer ligand: preparation and catalytic properties Organic Chemistry Frontiers, 2015, 2, 936 |
| 1553144 | CIF | C32 H35 Cl2 N4 O5 P Ru | P 1 21/c 1 | 18.2792; 11.74106; 17.1049 90; 117.389; 90 | 3259.49 | Mejuto, Carmen; García-Eleno, Marco A.; Guisado-Barrios, Gregorio; Spasyuk, Denis; Gusev, Dmitri; Peris, Eduardo Ruthenium complexes with an N-heterocyclic carbene NNC-pincer ligand: preparation and catalytic properties Organic Chemistry Frontiers, 2015, 2, 936 |
| 1553145 | CIF | C26 H17 O3 P | P 21 21 21 | 8.4926; 12.013; 19.248 90; 90; 90 | 1963.7 | Xu, Guangqing; Li, Minghong; Wang, Shouliang; Tang, Wenjun Efficient synthesis of P-chiral biaryl phosphonates by stereoselective intramolecular cyclization Organic Chemistry Frontiers, 2015, 2, 1342 |
| 1553146 | CIF | C25 H23 Au I N3 O | C 1 2/c 1 | 32.577; 10.964; 15.077 90; 101.267; 90 | 5281.3 | Xu, Qin; Gu, Peng; Wang, Feijun; Shi, Min Selectfluor promoted NHC‒oxazoline gold(i) complex catalyzed cycloaddition/oxidation reaction of enynones with alkenes Organic Chemistry Frontiers, 2015, 2, 1475 |
| 1553147 | CIF | C23 H19 Au I N3 O | P 21 21 21 | 10.3025; 16.0231; 26.3966 90; 90; 90 | 4357.5 | Xu, Qin; Gu, Peng; Wang, Feijun; Shi, Min Selectfluor promoted NHC‒oxazoline gold(i) complex catalyzed cycloaddition/oxidation reaction of enynones with alkenes Organic Chemistry Frontiers, 2015, 2, 1475 |
| 1553148 | CIF | C24 H34 O10 | P 21 21 21 | 5.8507; 14.177; 30.834 90; 90; 90 | 2557.5 | Huang, Xin; Xue, Can; Fu, Chunling; Ma, Shengming A concise construction of carbohydrate-tethered axially chiral allenes via copper catalysis Organic Chemistry Frontiers, 2015, 2, 1040 |
| 1553149 | CIF | C21 H19 N O6 | P 21 21 21 | 10.8569; 14.913; 23.1808 90; 90; 90 | 3753.2 | Duan, Jindian; Cheng, Jing; Li, Pengfei Enantioselective construction of spiro-1,3-indandiones with three stereocenters via organocatalytic Michael-aldol reaction of 2-arylideneindane-1,3-diones and nitro aldehydes Organic Chemistry Frontiers, 2015, 2, 1048 |
| 1553150 | CIF | C72 H74 I2 N36 O16 | P n a 21 | 13.093; 25.621; 27.14 90; 90; 90 | 9104 | Zhou, Tian-You; Qi, Qiao-Yan; Zhang, Ying; Xu, Xiao-Na; Zhao, Xin A thermally stable pH-responsive “supramolecular buckle” based on the encapsulation of 4-(4-aminophenyl)-N-methylpyridinium by cucurbit[8]uril Organic Chemistry Frontiers, 2015, 2, 1030 |
| 1553151 | CIF | C18 H19 N O2 | C 1 2/c 1 | 20.293; 6.84225; 22.5979 90; 90.8593; 90 | 3137.36 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553152 | CIF | C18 H19 N O2 | P 1 21/c 1 | 7.63367; 29.2305; 6.84862 90; 102.295; 90 | 1493.12 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553153 | CIF | C19 H21 N O2 | P b c a | 12.4972; 14.1613; 17.5538 90; 90; 90 | 3106.61 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553154 | CIF | C16 H17 N O3 | P 21 21 21 | 6.86998; 15.21957; 27.0563 90; 90; 90 | 2828.96 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553155 | CIF | C19 H21 N O3 | P -1 | 6.98428; 15.3845; 16.6168 110.497; 97.0023; 102.274 | 1596.16 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553156 | CIF | C18 H20 N2 O3 | P -1 | 6.8071; 15.0202; 15.8559 90.798; 101.156; 100.035 | 1564.3 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553157 | CIF | C11 H14 N2 O2 | P -1 | 7.5414; 11.8446; 12.2635 80.154; 88.093; 88.519 | 1078.48 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553158 | CIF | C46 H42 N2 O | C 1 2/c 1 | 12.55604; 15.09459; 18.9643 90; 105.866; 90 | 3457.35 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553159 | CIF | C48 H46 N2 O3 | P -1 | 10.1705; 10.2903; 19.4528 99.778; 99.679; 106.888 | 1868.04 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553160 | CIF | C34 H34 N2 O | P 1 21/c 1 | 11.9986; 10.6018; 20.9045 90; 104.851; 90 | 2570.36 | Hama Salih, Mariwan A.; Male, Louise; Spencer, Neil; Fossey, John S. γ-Lactams and furan bispyrrolidines via iodine mediated cyclisation of homoallylamines Organic Chemistry Frontiers, 2015, 2, 1445 |
| 1553161 | CIF | C15 H18 N2 O2 | P 1 21/n 1 | 18.06936; 17.802; 18.2203 90; 90.5295; 90 | 5860.69 | Huang, Pei-Qiang; Ou, Wei; Ye, Jian-Liang Aza-Knoevenagel-type condensation of secondary amides: direct access to N-monosubstituted β,β-difunctionalized enamines Organic Chemistry Frontiers, 2015, 2, 1094 |
| 1553162 | CIF | C10 H9 F3 O2 S2 | P 1 21/n 1 | 9.4647; 5.7312; 22.1678 90; 100.283; 90 | 1183.16 | Yang, Hai-Bin; Fan, Xing; Wei, Yin; Shi, Min Solvent-controlled nucleophilic trifluoromethylthiolation of Morita‒Baylis‒Hillman carbonates: dual roles of DABCO in activating the Zard's trifluoromethylthiolation reagent and the MBH carbonates Organic Chemistry Frontiers, 2015, 2, 1088 |
| 1553163 | CIF | C23 H27 N O3 | P 1 21/c 1 | 10.695; 21.389; 9.1312 90; 99.66; 90 | 2059.2 | Li, Ming; Qiu, Bin; Kong, Xiang-Jing; Wen, Li-Rong Synthesis of Passerini adducts from aldehydes and isocyanides under the auxiliary of water Organic Chemistry Frontiers, 2015, 2, 1326 |
| 1553164 | CIF | C22 H24 Cl N O4 | P b c a | 12.5003; 9.5999; 34.846 90; 90; 90 | 4181.6 | Li, Ming; Qiu, Bin; Kong, Xiang-Jing; Wen, Li-Rong Synthesis of Passerini adducts from aldehydes and isocyanides under the auxiliary of water Organic Chemistry Frontiers, 2015, 2, 1326 |
| 1553165 | CIF | C30 H23 N O2 | P -1 | 8.8044; 9.6097; 13.3333 93.346; 95.699; 90.433 | 1120.5 | Guo, Tenglong; Jiang, Quanbin; Yu, Zhengkun Palladium-catalyzed oxidative annulation of in situ generated enones to pyrroles: a concise route to functionalized indoles Organic Chemistry Frontiers, 2015, 2, 1361 |
| 1553166 | CIF | C10 H8 N4 O | P b c a | 7.008; 13.515; 19.467 90; 90; 90 | 1843.8 | Li, Pan; Zhao, Jingjing; Xia, Chungu; Li, Fuwei The development of carbene-stabilized N‒O radical coupling strategy in metal-free regioselective C‒H azidation of quinoline N-oxides Organic Chemistry Frontiers, 2015, 2, 1313 |
| 1553167 | CIF | C25 H0 N24 O0.5 | P -1 | 10.974; 13.036; 14.337 68.085; 67.898; 73.316 | 1737 | Song, Chuanling; Sun, Yihua; Wang, Jianwu; Chen, Hui; Yao, Jiannian; Tung, Chen-Ho; Xu, Zhenghu Successive Cu/Pd transmetalation relay catalysis in stereoselective synthesis of tetraarylethenes Organic Chemistry Frontiers, 2015, 2, 1366 |
| 1553168 | CIF | C36 H40 O8 | C 1 2/c 1 | 8.621; 21.744; 18.379 90; 100.954; 90 | 3382.5 | Song, Chuanling; Sun, Yihua; Wang, Jianwu; Chen, Hui; Yao, Jiannian; Tung, Chen-Ho; Xu, Zhenghu Successive Cu/Pd transmetalation relay catalysis in stereoselective synthesis of tetraarylethenes Organic Chemistry Frontiers, 2015, 2, 1366 |
| 1553169 | CIF | C33 H41 N O9 | P 1 21/c 1 | 9.7518; 17.4971; 20.0458 90; 101.206; 90 | 3355.17 | Song, Chuanling; Sun, Yihua; Wang, Jianwu; Chen, Hui; Yao, Jiannian; Tung, Chen-Ho; Xu, Zhenghu Successive Cu/Pd transmetalation relay catalysis in stereoselective synthesis of tetraarylethenes Organic Chemistry Frontiers, 2015, 2, 1366 |
| 1553170 | CIF | C15 H14 O3 S | P -1 | 8.503; 10.6762; 15.8607 76.75; 81.107; 88.437 | 1384.6 | Li, Siyu; Li, Xiang; Yang, Fan; Wu, Yangjie Copper-catalyzed direct decarboxylative hydrosulfonylation of aryl propiolic acids with sulfonylhydrazides leading to vinylsulfones Organic Chemistry Frontiers, 2015, 2, 1076 |
| 1553171 | CIF | C28 H29 N3 O4 S2 | P 1 21/n 1 | 10.2945; 18.1137; 14.6463 90; 105.831; 90 | 2627.5 | Zhang, Yong-Sheng; Tang, Xiang-Ying; Shi, Min Divergent synthesis of indole-fused polycycles via Rh(ii)-catalyzed intramolecular [3 + 2] cycloaddition and C‒H functionalization of indolyltriazoles Organic Chemistry Frontiers, 2015, 2, 1516 |
| 1553172 | CIF | C27 H24 Cl3 N3 O4 S2 | P -1 | 11.3585; 11.981; 13.438 106.42; 108.985; 104.217 | 1539.6 | Zhang, Yong-Sheng; Tang, Xiang-Ying; Shi, Min Divergent synthesis of indole-fused polycycles via Rh(ii)-catalyzed intramolecular [3 + 2] cycloaddition and C‒H functionalization of indolyltriazoles Organic Chemistry Frontiers, 2015, 2, 1516 |
| 1553173 | CIF | C26 H23 Cl F7 N O | C 1 c 1 | 12.89225; 15.11065; 24.8076 90; 101.997; 90 | 4727.22 | Lao, Ye-Xing; Wu, Jia-Qiang; Chen, Yunyun; Zhang, Shang-Shi; Li, Qingjiang; Wang, Honggen Palladium-catalyzed methylene C(sp3)‒H arylation of the adamantyl scaffold Organic Chemistry Frontiers, 2015, 2, 1374 |
| 1553174 | CIF | C9 H6 F3 N3 | P 1 21/c 1 | 11.6048; 11.0429; 22.106 90; 94.237; 90 | 2825.2 | Wang, Shuai; Yang, Li-Jun; Zeng, Jun-Liang; Zheng, Yan; Ma, Jun-An Silver-catalyzed [3 + 2] cycloaddition of isocyanides with diazo compounds: new regioselective access to 1,4-disubstituted-1,2,3-triazoles Organic Chemistry Frontiers, 2015, 2, 1468 |
| 1553175 | CIF | C11 H7 F6 N3 | P 1 21/c 1 | 10.63; 8.222; 13.645 90; 100.814; 90 | 1171.4 | Wang, Shuai; Yang, Li-Jun; Zeng, Jun-Liang; Zheng, Yan; Ma, Jun-An Silver-catalyzed [3 + 2] cycloaddition of isocyanides with diazo compounds: new regioselective access to 1,4-disubstituted-1,2,3-triazoles Organic Chemistry Frontiers, 2015, 2, 1468 |
| 1553176 | CIF | C23 H19 Cl O2 | C 1 2/c 1 | 28.386; 9.195; 17.591 90; 125.324; 90 | 3746.1 | Li, Yang; Liu, Bang; Ouyang, Xuan-Hui; Song, Ren-Jie; Li, Jin-Heng Alkylation/1,2-aryl migration of α-aryl allylic alcohols with α-carbonyl alkyl bromides using visible-light photoredox catalysis Organic Chemistry Frontiers, 2015, 2, 1457 |
| 1553177 | CIF | C25 H27 Br2 N5 O2 | P -1 | 8.8674; 9.3784; 16.618 82.99; 87.24; 62.65 | 1218.3 | Zende, V. M.; Schulzke, C.; Kapdi, A. R. Pincer CNC bis-N-heterocyclic carbenes: robust ligands for palladium-catalysed Suzuki‒Miyaura arylation of bromoanthracene and related substrates Organic Chemistry Frontiers, 2015, 2, 1397 |
| 1553178 | CIF | C21 H14 O2 | C 1 2/c 1 | 23.657; 7.2556; 18.859 90; 111.31; 90 | 3015.7 | Zende, V. M.; Schulzke, C.; Kapdi, A. R. Pincer CNC bis-N-heterocyclic carbenes: robust ligands for palladium-catalysed Suzuki‒Miyaura arylation of bromoanthracene and related substrates Organic Chemistry Frontiers, 2015, 2, 1397 |
| 1553179 | CIF | C26 H18 | P 1 21/n 1 | 10.441; 7.4965; 22.577 90; 94.06; 90 | 1762.7 | Zende, V. M.; Schulzke, C.; Kapdi, A. R. Pincer CNC bis-N-heterocyclic carbenes: robust ligands for palladium-catalysed Suzuki‒Miyaura arylation of bromoanthracene and related substrates Organic Chemistry Frontiers, 2015, 2, 1397 |
| 1553180 | CIF | C26 H18 | C 1 2/c 1 | 10.596; 13.501; 12.12 90; 90.38; 90 | 1733.8 | Zende, V. M.; Schulzke, C.; Kapdi, A. R. Pincer CNC bis-N-heterocyclic carbenes: robust ligands for palladium-catalysed Suzuki‒Miyaura arylation of bromoanthracene and related substrates Organic Chemistry Frontiers, 2015, 2, 1397 |
| 1553181 | CIF | C29 H27 N O4 | P -1 | 10.767; 11.483; 19.2866 88.719; 87.476; 80.292 | 2347.8 | Patra, Atanu; Bhunia, Anup; Yetra, Santhivardhana Reddy; Gonnade, Rajesh G.; Biju, Akkattu T. Diastereoselective synthesis of cyclopentanone-fused spirooxindoles by N-heterocyclic carbene-catalyzed homoenolate annulation with isatilidenes Organic Chemistry Frontiers, 2015, 2, 1584 |
| 1553183 | CIF | C21 H33 N O4 Si | P 21 21 21 | 6.3258; 17.6205; 20.9213 90; 90; 90 | 2331.97 | Si, Chang-Mei; Mao, Zhuo-Ya; Liu, Yi-Wen; Du, Zhen-Ting; Wei, Bang-Guo; Lin, Guo-Qiang Stereoselective formation of chiral trans-4-hydroxy-5-substituted 2-pyrrolidinones: syntheses of streptopyrrolidine and 3-epi-epohelmin A Organic Chemistry Frontiers, 2015, 2, 1485 |
| 1553184 | CIF | C76 H19 N3 O5 | P 1 21/n 1 | 13.06; 13.2703; 29.7423 90; 95.06; 90 | 5134.6 | Xu, Liang; Liang, Sisi; Sun, Jiahao; Gan, Liangbing Open-cage fullerene with a stopper acts as a molecular vial for a single water molecule Organic Chemistry Frontiers, 2015, 2, 1500 |
| 1553185 | CIF | C82 H27 N5 O5 | P 1 21/c 1 | 17.987; 18.451; 19.171 90; 117.87; 90 | 5624 | Xu, Liang; Liang, Sisi; Sun, Jiahao; Gan, Liangbing Open-cage fullerene with a stopper acts as a molecular vial for a single water molecule Organic Chemistry Frontiers, 2015, 2, 1500 |
| 1553186 | CIF | C16 H8 Br F3 O2 S | P 1 21/n 1 | 12.9202; 7.9412; 14.2105 90; 91.2584; 90 | 1457.67 | Zeng, Yao-Fu; Tan, Dong-Hang; Chen, Yunyun; Lv, Wen-Xin; Liu, Xu-Ge; Li, Qingjiang; Wang, Honggen Direct radical trifluoromethylthiolation and thiocyanation of aryl alkynoate esters: mild and facile synthesis of 3-trifluoromethylthiolated and 3-thiocyanated coumarins Organic Chemistry Frontiers, 2015, 2, 1511 |
| 1553187 | CIF | C22 H16 N2 O | P 1 21/c 1 | 8.4582; 11.1421; 18.5214 90; 100.439; 90 | 1716.61 | Li, Yaxuan; Fu, Yajie; Ren, Chaojie; Tang, Dong; Wu, Ping; Meng, Xu; Chen, Baohua Copper-catalyzed oxidative coupling reaction of α,β-unsaturated aldehydes with amidines: synthesis of 1,2,4-trisubstituted-1H-imidazole-5-carbaldehydes Organic Chemistry Frontiers, 2015, 2, 1632 |
| 1553188 | CIF | C26 H23 F6 N2 O P2 Rh | P 1 21/c 1 | 10.6439; 11.6245; 21.782 90; 100.416; 90 | 2650.7 | Tang, Z.; Mandal, S.; Paul, N. D.; Lutz, M.; Li, P.; van der Vlugt, J. I.; de Bruin, B. Rhodium catalysed conversion of carbenes into ketenes and ketene imines using PNN pincer complexes Organic Chemistry Frontiers, 2015, 2, 1561 |
| 1553189 | CIF | C20 H27 F6 N2 O P2 Rh | P 1 21/n 1 | 13.4021; 10.9937; 15.6906 90; 97.462; 90 | 2292.3 | Tang, Z.; Mandal, S.; Paul, N. D.; Lutz, M.; Li, P.; van der Vlugt, J. I.; de Bruin, B. Rhodium catalysed conversion of carbenes into ketenes and ketene imines using PNN pincer complexes Organic Chemistry Frontiers, 2015, 2, 1561 |
| 1553190 | CIF | C22 H25 F6 N2 O2 P2 Rh | P -1 | 9.70447; 9.77001; 14.1603 83.358; 74.636; 74.636 | 1246.84 | Tang, Z.; Mandal, S.; Paul, N. D.; Lutz, M.; Li, P.; van der Vlugt, J. I.; de Bruin, B. Rhodium catalysed conversion of carbenes into ketenes and ketene imines using PNN pincer complexes Organic Chemistry Frontiers, 2015, 2, 1561 |
| 1553191 | CIF | C24 H25 Cl N2 O0.25 Ru S | P -1 | 10.0366; 10.6641; 12.3895 70.891; 84.601; 64.031 | 1124.59 | Xie, Xiaoke; Huynh, Han Vinh Cyclometallated ruthenium(ii) complexes with ditopic thienyl‒NHC ligands: syntheses and alkyne annulations Organic Chemistry Frontiers, 2015, 2, 1598 |
| 1553192 | CIF | C30 H29 Cl N2 Ru S | P 1 21/c 1 | 10.4555; 15.1572; 16.4668 90; 94.422; 90 | 2601.83 | Xie, Xiaoke; Huynh, Han Vinh Cyclometallated ruthenium(ii) complexes with ditopic thienyl‒NHC ligands: syntheses and alkyne annulations Organic Chemistry Frontiers, 2015, 2, 1598 |
| 1553193 | CIF | C24 H25 Br N2 Ru S | P -1 | 10.5184; 10.8146; 11.5002 87.04; 64.781; 69.987 | 1105.18 | Xie, Xiaoke; Huynh, Han Vinh Cyclometallated ruthenium(ii) complexes with ditopic thienyl‒NHC ligands: syntheses and alkyne annulations Organic Chemistry Frontiers, 2015, 2, 1598 |
| 1553194 | CIF | C28 H27 Cl N2 Ru S | P 1 21/n 1 | 14.301; 11.104; 15.932 90; 108.464; 90 | 2399.7 | Xie, Xiaoke; Huynh, Han Vinh Cyclometallated ruthenium(ii) complexes with ditopic thienyl‒NHC ligands: syntheses and alkyne annulations Organic Chemistry Frontiers, 2015, 2, 1598 |
| 1553244 | CIF | C37 H28 O | P 1 21/c 1 | 11.6881; 17.6933; 12.7663 90; 97.516; 90 | 2617.4 | Hoang, Giang T.; Kubo, Tomohiro; Young, Victor G.; Kautzky, Jacob A.; Wissinger, Jane E. Illustrating the Utility of X-ray Crystallography for Structure Elucidation through a Tandem Aldol Condensation/Diels‒Alder Reaction Sequence Journal of Chemical Education, 2015, 92, 1381 |
| 1553245 | CIF | C37 H28 O | P -1 | 10.6896; 11.5817; 12.2608 118.181; 94.775; 99.292 | 1298.1 | Hoang, Giang T.; Kubo, Tomohiro; Young, Victor G.; Kautzky, Jacob A.; Wissinger, Jane E. Illustrating the Utility of X-ray Crystallography for Structure Elucidation through a Tandem Aldol Condensation/Diels‒Alder Reaction Sequence Journal of Chemical Education, 2015, 92, 1381 |
| 1553249 | CIF | C21 H24 O5 | P 21 21 21 | 4.9653; 10.6228; 34.2129 90; 90; 90 | 1804.57 | Jiang, Junhang; Zheng, Canhui; Zhu, Kongkai; Liu, Jia; Sun, Nannan; Wang, Chongqing; Jiang, Hualiang; Zhu, Ju; Luo, Cheng; Zhou, Youjun Quantum chemistry calculation-aided structural optimization of combretastatin A-4-like tubulin polymerization inhibitors: improved stability and biological activity. Journal of medicinal chemistry, 2015, 58, 2538-2546 |
| 1553280 | CIF | C34 H54 O4 | P 21 21 21 | 9.3781; 12.6568; 27.0482 90; 90; 90 | 3210.53 | Yang, Xing-Wei; Li, Ming-Ming; Liu, Xia; Ferreira, Daneel; Ding, Yuanqing; Zhang, Jing-Jing; Liao, Yang; Qin, Hong-Bo; Xu, Gang Polycyclic Polyprenylated Acylphloroglucinol Congeners Possessing Diverse Structures from Hypericum henryi. Journal of natural products, 2015, 78, 885-895 |
| 1553281 | CIF | C69 H92 O13 | C 1 2 1 | 18.0066; 13.5854; 13.2739 90; 93.898; 90 | 3239.64 | Yang, Xing-Wei; Li, Ming-Ming; Liu, Xia; Ferreira, Daneel; Ding, Yuanqing; Zhang, Jing-Jing; Liao, Yang; Qin, Hong-Bo; Xu, Gang Polycyclic Polyprenylated Acylphloroglucinol Congeners Possessing Diverse Structures from Hypericum henryi. Journal of natural products, 2015, 78, 885-895 |
| 1553282 | CIF | C36 H54 O5 | P 1 21 1 | 9.3216; 13.2025; 13.8291 90; 107.968; 90 | 1618.92 | Yang, Xing-Wei; Li, Ming-Ming; Liu, Xia; Ferreira, Daneel; Ding, Yuanqing; Zhang, Jing-Jing; Liao, Yang; Qin, Hong-Bo; Xu, Gang Polycyclic Polyprenylated Acylphloroglucinol Congeners Possessing Diverse Structures from Hypericum henryi. Journal of natural products, 2015, 78, 885-895 |
| 1553283 | CIF | C30 H36 O4 | P 1 21 1 | 10.7509; 7.7655; 14.8907 90; 99.69; 90 | 1225.43 | Yang, Xing-Wei; Li, Ming-Ming; Liu, Xia; Ferreira, Daneel; Ding, Yuanqing; Zhang, Jing-Jing; Liao, Yang; Qin, Hong-Bo; Xu, Gang Polycyclic Polyprenylated Acylphloroglucinol Congeners Possessing Diverse Structures from Hypericum henryi. Journal of natural products, 2015, 78, 885-895 |
| 1553284 | CIF | C30 H44 O5 | P 21 21 21 | 10.0575; 16.0634; 17.39 90; 90; 90 | 2809.49 | Yang, Xing-Wei; Li, Ming-Ming; Liu, Xia; Ferreira, Daneel; Ding, Yuanqing; Zhang, Jing-Jing; Liao, Yang; Qin, Hong-Bo; Xu, Gang Polycyclic Polyprenylated Acylphloroglucinol Congeners Possessing Diverse Structures from Hypericum henryi. Journal of natural products, 2015, 78, 885-895 |
| 1553285 | CIF | C16 H24.6667 N2 O1.3333 | P 21 21 21 | 9.7135; 13.9213; 31.7069 90; 90; 90 | 4287.6 | Cao, Ming-Ming; Zhang, Yu; Huang, Sheng-Dian; Di, Ying-Tong; Peng, Zong-Gen; Jiang, Jian-Dong; Yuan, Chun-Mao; Chen, Duo-Zhi; Li, Shun-Lin; He, Hong-Ping; Hao, Xiao-Jiang Alkaloids with Different Carbon Units from Myrioneuron faberi. Journal of natural products, 2015, 78, 2609-2616 |
| 1553286 | CIF | C15 H26 N2 | P 1 21 1 | 9.1535; 5.1702; 14.568 90; 106.495; 90 | 661.06 | Cao, Ming-Ming; Zhang, Yu; Huang, Sheng-Dian; Di, Ying-Tong; Peng, Zong-Gen; Jiang, Jian-Dong; Yuan, Chun-Mao; Chen, Duo-Zhi; Li, Shun-Lin; He, Hong-Ping; Hao, Xiao-Jiang Alkaloids with Different Carbon Units from Myrioneuron faberi. Journal of natural products, 2015, 78, 2609-2616 |
| 1553287 | CIF | C15 H24 N2 O | P -1 | 8.8466; 9.1188; 9.5971 95.094; 112.717; 112.004 | 636.97 | Cao, Ming-Ming; Zhang, Yu; Huang, Sheng-Dian; Di, Ying-Tong; Peng, Zong-Gen; Jiang, Jian-Dong; Yuan, Chun-Mao; Chen, Duo-Zhi; Li, Shun-Lin; He, Hong-Ping; Hao, Xiao-Jiang Alkaloids with Different Carbon Units from Myrioneuron faberi. Journal of natural products, 2015, 78, 2609-2616 |
| 1553992 | CIF | C16 H19 I N4 O4 | P -1 | 7.0211; 8.3237; 15.1967 86.651; 85.306; 89.485 | 883.62 | Rosokha, Sergiy V.; Loboda, Eric A. Interplay of Halogen and π-π Charge-Transfer Bondings in Intermolecular Associates of Bromo- or Iododinitrobenzene with Tetramethyl-p-phenylenediamine. The journal of physical chemistry. A, 2015, 119, 3833-3842 |
| 1553993 | CIF | C16 H19 Br N4 O4 | P -1 | 6.9478; 8.2799; 15.0522 94.6594; 93.2402; 90.2781 | 861.63 | Rosokha, Sergiy V.; Loboda, Eric A. Interplay of Halogen and π-π Charge-Transfer Bondings in Intermolecular Associates of Bromo- or Iododinitrobenzene with Tetramethyl-p-phenylenediamine. The journal of physical chemistry. A, 2015, 119, 3833-3842 |
| 1553994 | CIF | C18 H18 B Cl N2 O3 | P 1 21/n 1 | 7.7528; 19.1764; 11.3962 90; 93.209; 90 | 1691.63 | Golub, Igor E.; Gulyaeva, Ekaterina S.; Filippov, Oleg A.; Dyadchenko, Victor P.; Belkova, Natalia V.; Epstein, Lina M.; Arkhipov, Dmitry E.; Shubina, Elena S. Dihydrogen bond intermediated alcoholysis of dimethylamine-borane in nonaqueous media. The journal of physical chemistry. A, 2015, 119, 3853-3868 |
| 1553995 | CIF | C10 H16 B F12 N O4 | P 1 21/n 1 | 9.4694; 13.2943; 14.0325 90; 90.038; 90 | 1766.5 | Golub, Igor E.; Gulyaeva, Ekaterina S.; Filippov, Oleg A.; Dyadchenko, Victor P.; Belkova, Natalia V.; Epstein, Lina M.; Arkhipov, Dmitry E.; Shubina, Elena S. Dihydrogen bond intermediated alcoholysis of dimethylamine-borane in nonaqueous media. The journal of physical chemistry. A, 2015, 119, 3853-3868 |
| 1553996 | CIF | C12 H25.95 Cd N6 O8.98 | P 1 21/c 1 | 12.1161; 29.0903; 11.0501 90; 92.127; 90 | 3892 | Colaneri, Michael J.; Teat, Simon J.; Vitali, Jacqueline Models for Copper Dynamic Behavior in Doped Cadmium dl-Histidine Crystals: Electron Paramagnetic Resonance and Crystallographic Analysis. The journal of physical chemistry. A, 2015, 119, 11119-11127 |
| 1553997 | CIF | C12 H25.8 Cd N6 O8.9 | P 1 21/c 1 | 12.2555; 29.4689; 11.1087 90; 92.396; 90 | 4008.5 | Colaneri, Michael J.; Teat, Simon J.; Vitali, Jacqueline Models for Copper Dynamic Behavior in Doped Cadmium dl-Histidine Crystals: Electron Paramagnetic Resonance and Crystallographic Analysis. The journal of physical chemistry. A, 2015, 119, 11119-11127 |
| 1553998 | CIF | C29 H21 Cl N | P -1 | 9.9486; 10.079; 10.8072 100.318; 90.072; 96.899 | 1058.1 | Pati, Avik Kumar; Gharpure, Santosh J.; Mishra, Ashok K. Contrasting Solid-State Fluorescence of Diynes with Small and Large Aryl Substituents: Crystal Packing Dependence and Stimuli-Responsive Fluorescence Switching. The journal of physical chemistry. A, 2015, 119, 10481-10493 |
| 1553999 | CIF | C18 H14 O2 | P 1 21/c 1 | 7.2042; 15.6697; 12.5803 90; 91.753; 90 | 1419.5 | Pati, Avik Kumar; Gharpure, Santosh J.; Mishra, Ashok K. Contrasting Solid-State Fluorescence of Diynes with Small and Large Aryl Substituents: Crystal Packing Dependence and Stimuli-Responsive Fluorescence Switching. The journal of physical chemistry. A, 2015, 119, 10481-10493 |
| 1554000 | CIF | C18 H15 N | P 1 21/c 1 | 9.872; 12.082; 12.46 90; 103.028; 90 | 1447.9 | Pati, Avik Kumar; Gharpure, Santosh J.; Mishra, Ashok K. Contrasting Solid-State Fluorescence of Diynes with Small and Large Aryl Substituents: Crystal Packing Dependence and Stimuli-Responsive Fluorescence Switching. The journal of physical chemistry. A, 2015, 119, 10481-10493 |
| 1554001 | CIF | C17 H12 O | P 1 21/c 1 | 13.8324; 9.3533; 10.2395 90; 101.943; 90 | 1296.1 | Pati, Avik Kumar; Gharpure, Santosh J.; Mishra, Ashok K. Contrasting Solid-State Fluorescence of Diynes with Small and Large Aryl Substituents: Crystal Packing Dependence and Stimuli-Responsive Fluorescence Switching. The journal of physical chemistry. A, 2015, 119, 10481-10493 |
| 1554002 | CIF | C16 H24 N5 O | P 1 21/n 1 | 5.89; 14.574; 19.326 90; 93.463; 90 | 1655.9 | Haller, Benjamin C.; Chambers, Dallas; Cheng, Ran; Chemistruck, Victoria; Hom, Timothy F.; Li, Zhengzheng; Nguyen, Jeffrey; Ichimura, Andrew; Brook, David J. R. Oxidation of Electron Donor-Substituted Verdazyls: Building Blocks for Molecular Switches. The journal of physical chemistry. A, 2015, 119, 10750-10760 |
| 1554003 | CIF | C17 H25 F3 N5 O4 S | P 1 21/c 1 | 16.865; 13.1791; 19.9462 90; 90.015; 90 | 4433.35 | Haller, Benjamin C.; Chambers, Dallas; Cheng, Ran; Chemistruck, Victoria; Hom, Timothy F.; Li, Zhengzheng; Nguyen, Jeffrey; Ichimura, Andrew; Brook, David J. R. Oxidation of Electron Donor-Substituted Verdazyls: Building Blocks for Molecular Switches. The journal of physical chemistry. A, 2015, 119, 10750-10760 |
| 1554004 | CIF | C16 H24 N5 O | P 1 21 1 | 8.054; 5.95; 17.507 90; 95.31; 90 | 835.4 | Haller, Benjamin C.; Chambers, Dallas; Cheng, Ran; Chemistruck, Victoria; Hom, Timothy F.; Li, Zhengzheng; Nguyen, Jeffrey; Ichimura, Andrew; Brook, David J. R. Oxidation of Electron Donor-Substituted Verdazyls: Building Blocks for Molecular Switches. The journal of physical chemistry. A, 2015, 119, 10750-10760 |
| 1554031 | CIF | C26 H22 N O | P 1 21/n 1 | 11.6367; 27.4387; 11.7856 90; 95.372; 90 | 3746.6 | Dyar, Scott M.; Margulies, Eric A.; Horwitz, Noah E.; Brown, Kristen E.; Krzyaniak, Matthew D.; Wasielewski, Michael R. Photogenerated Quartet State Formation in a Compact Ring-Fused Perylene-Nitroxide. The journal of physical chemistry. B, 2015, 119, 13560-13569 |
| 1554032 | CIF | C24 H26 N O5 | P -1 | 9.6761; 10.502; 10.8995 76.6369; 80.4476; 76.735 | 1041.37 | Ravat, Prince; Baumgarten, Martin Positional Isomers of Tetramethoxypyrene-based Mono- and Biradicals. The journal of physical chemistry. B, 2015, 119, 13649-13655 |
| 1554033 | CIF | C24 H26 N O5 | P 1 21/c 1 | 8.1986; 21.6402; 11.6933 90; 100.589; 90 | 2039.29 | Ravat, Prince; Baumgarten, Martin Positional Isomers of Tetramethoxypyrene-based Mono- and Biradicals. The journal of physical chemistry. B, 2015, 119, 13649-13655 |
| 1554034 | CIF | C6 Br2 N4 O4 S | P 21 21 21 | 6.57487; 10.21418; 15.22634 90; 90; 90 | 1022.55 | Pavan, Mysore S.; Jana, Ajay Kumar; Natarajan, S.; Guru Row, Tayur N. Halogen Bonding and Chalcogen Bonding in 4,7-Dibromo-5,6-dinitro-2,1,3-benzothiadiazole. The journal of physical chemistry. B, 2015, 119, 11382-11390 |
| 1554035 | CIF | C6 Br2 N4 O4 S | P -1 | 9.167; 10.2561; 11.4773 86.709; 77.084; 76.289 | 1021.78 | Pavan, Mysore S.; Jana, Ajay Kumar; Natarajan, S.; Guru Row, Tayur N. Halogen Bonding and Chalcogen Bonding in 4,7-Dibromo-5,6-dinitro-2,1,3-benzothiadiazole. The journal of physical chemistry. B, 2015, 119, 11382-11390 |
| 1554036 | CIF | C11 H5 N2 O5 a | P c a 21 | 32.1; 4.1188; 9.6966 90; 90; 90 | 1282.02 | Manin, Alex N.; Voronin, Alexander P.; Shishkina, Anastasia V.; Vener, Mikhail V.; Churakov, Andrei V.; Perlovich, German L. Influence of Secondary Interactions on the Structure, Sublimation Thermodynamics, and Solubility of Salicylate:4-Hydroxybenzamide Cocrystals. Combined Experimental and Theoretical Study. The journal of physical chemistry. B, 2015, 119, 10466-10477 |
| 1554037 | CIF | C14 H13 N O5 | P 1 21/c 1 | 13.8869; 8.01874; 12.8184 90; 115.187; 90 | 1291.69 | Manin, Alex N.; Voronin, Alexander P.; Shishkina, Anastasia V.; Vener, Mikhail V.; Churakov, Andrei V.; Perlovich, German L. Influence of Secondary Interactions on the Structure, Sublimation Thermodynamics, and Solubility of Salicylate:4-Hydroxybenzamide Cocrystals. Combined Experimental and Theoretical Study. The journal of physical chemistry. B, 2015, 119, 10466-10477 |
| 1554038 | CIF | C4 H6 O2 | P 1 21/n 1 | 3.614; 16.42; 6.773 90; 90.36; 90 | 401.9 | Marshall, William G.; Urquhart, Andrew J.; Oswald, Iain D. H. Investigation of Methacrylic Acid at High Pressure Using Neutron Diffraction. The journal of physical chemistry. B, 2015, 119, 12147-12154 |
| 1554039 | CIF | C56 H50 Co N6 O7 | P -1 | 16.652; 17.462; 22.655 90.18; 108.31; 116.32 | 5527 | Liu, Qiuhua; Zhang, Xi; Zeng, Wennan; Wang, Jianxiu; Zhou, Zaichun Fine-Tuning of Electronic Structure of Cobalt(II) Ion in Nonplanar Porphyrins and Tracking of a Cross-Hybrid Stage: Implications for the Distortion of Natural Tetrapyrrole Macrocycles. The journal of physical chemistry. B, 2015, 119, 14102-14110 |
| 1554040 | CIF | C59 H56 Co N6 O7 | P -1 | 15.633; 16.027; 16.146 61.61; 63.25; 63.09 | 3027.9 | Liu, Qiuhua; Zhang, Xi; Zeng, Wennan; Wang, Jianxiu; Zhou, Zaichun Fine-Tuning of Electronic Structure of Cobalt(II) Ion in Nonplanar Porphyrins and Tracking of a Cross-Hybrid Stage: Implications for the Distortion of Natural Tetrapyrrole Macrocycles. The journal of physical chemistry. B, 2015, 119, 14102-14110 |
| 1554041 | CIF | C58 H54 Co N6 O7 | P -1 | 14.149; 16.352; 16.598 60.98; 85.09; 65.72 | 3029.6 | Liu, Qiuhua; Zhang, Xi; Zeng, Wennan; Wang, Jianxiu; Zhou, Zaichun Fine-Tuning of Electronic Structure of Cobalt(II) Ion in Nonplanar Porphyrins and Tracking of a Cross-Hybrid Stage: Implications for the Distortion of Natural Tetrapyrrole Macrocycles. The journal of physical chemistry. B, 2015, 119, 14102-14110 |
| 1554042 | CIF | C57 H49 Cl3 Co N6 O6 | P -1 | 18.9824; 21.2118; 28.7759 73.804; 74.979; 67.777 | 10145.2 | Liu, Qiuhua; Zhang, Xi; Zeng, Wennan; Wang, Jianxiu; Zhou, Zaichun Fine-Tuning of Electronic Structure of Cobalt(II) Ion in Nonplanar Porphyrins and Tracking of a Cross-Hybrid Stage: Implications for the Distortion of Natural Tetrapyrrole Macrocycles. The journal of physical chemistry. B, 2015, 119, 14102-14110 |
| 1554053 | CIF | C20 H17 N O2 | P 1 21/c 1 | 10.194; 11.472; 13.683 90; 97.76; 90 | 1585.5 | Hariharan, P. S.; Venkataramanan, N. S.; Moon, Dohyun; Anthony, Savarimuthu Philip Self-Reversible Mechanochromism and Thermochromism of a Triphenylamine-Based Molecule: Tunable Fluorescence and Nanofabrication Studies The Journal of Physical Chemistry C, 2015, 119, 9460 |
| 1554054 | CIF | C8 H18 F6 Li O4 P | P 1 21/n 1 | 6.1967; 12.558; 18.169 90; 95.745; 90 | 1406.8 | Han, Sang-Don; Yun, Sung-Hyun; Borodin, Oleg; Seo, Daniel M.; Sommer, Roger D.; Young, Victor G.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of LiPF6 Electrolytes The Journal of Physical Chemistry C, 2015, 119, 8492 |
| 1554055 | CIF | C5 H10 F3 Li0.5 O3 P0.5 | P n m a | 9.5125; 21.8997; 8.5903 90; 90; 90 | 1789.5 | Han, Sang-Don; Yun, Sung-Hyun; Borodin, Oleg; Seo, Daniel M.; Sommer, Roger D.; Young, Victor G.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of LiPF6 Electrolytes The Journal of Physical Chemistry C, 2015, 119, 8492 |
| 1554056 | CIF | C60 H80 N2 O4 | P -1 | 9.93781; 15.1528; 17.8125 69.7564; 88.9555; 87.1772 | 2513.57 | Kotwica, Kamil; Bujak, Piotr; Wamil, Damian; Pieczonka, Adam; Wiosna-Salyga, Gabriela; Gunka, Piotr A.; Jaroch, Tomasz; Nowakowski, Robert; Luszczynska, Beata; Witkowska, Ewelina; Glowacki, Ireneusz; Ulanski, Jacek; Zagorska, Malgorzata; Pron, Adam Structural, Spectroscopic, Electrochemical, and Electroluminescent Properties of Tetraalkoxydinaphthophenazines: New Solution-Processable Nonlinear Azaacenes The Journal of Physical Chemistry C, 2015, 119, 10700 |
| 1554057 | CIF | C68 H96 N2 O4 | P -1 | 9.8574; 17.6322; 17.7861 68.547; 87.477; 89.776 | 2874.1 | Kotwica, Kamil; Bujak, Piotr; Wamil, Damian; Pieczonka, Adam; Wiosna-Salyga, Gabriela; Gunka, Piotr A.; Jaroch, Tomasz; Nowakowski, Robert; Luszczynska, Beata; Witkowska, Ewelina; Glowacki, Ireneusz; Ulanski, Jacek; Zagorska, Malgorzata; Pron, Adam Structural, Spectroscopic, Electrochemical, and Electroluminescent Properties of Tetraalkoxydinaphthophenazines: New Solution-Processable Nonlinear Azaacenes The Journal of Physical Chemistry C, 2015, 119, 10700 |
| 1554058 | CIF | C12 H18 N4 O | F d d 2 | 12.663; 33.528; 12.2027 90; 90; 90 | 5180.8 | Jeeva, Mani; Prabhu, G. Venkatesa; Boobalan, Maria susai; Rajesh, Chinnaiyan Mahalingam Interactions and Inhibition Effect of Urea-Derived Mannich Bases on a Mild Steel Surface in HCl The Journal of Physical Chemistry C, 2015, 119, 22025 |
| 1554059 | CIF | C11 H16 N4 O2 | F d d 2 | 12.2079; 34.449; 11.8236 90; 90; 90 | 4972.4 | Jeeva, Mani; Prabhu, G. Venkatesa; Boobalan, Maria susai; Rajesh, Chinnaiyan Mahalingam Interactions and Inhibition Effect of Urea-Derived Mannich Bases on a Mild Steel Surface in HCl The Journal of Physical Chemistry C, 2015, 119, 22025 |
| 1554060 | CIF | C25 H13 F6 I6 O P | P 1 21/n 1 | 8.4758; 44.7106; 9.2023 90; 115.97; 90 | 3135.15 | Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C, 2015, 119, 27104 |
| 1554061 | CIF | C30 H15 F8 I4 O P | P -1 | 8.6823; 12.8395; 15.127 90.4885; 97.5416; 105.886 | 1606.12 | Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C, 2015, 119, 27104 |
| 1554062 | CIF | C24 H15 F3 I3 O P | P -1 | 9.7436; 10.7585; 13.5453 113.174; 96.9048; 107.42 | 1198.74 | Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C, 2015, 119, 27104 |
| 1554063 | CIF | C21 H16 F4 I2 N O P | P n m a | 21.9816; 18.0739; 5.8075 90; 90; 90 | 2307.3 | Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C, 2015, 119, 27104 |
| 1554064 | CIF | C30 H15 F8 I4 O P | P 1 21/c 1 | 9.319; 25.4268; 13.8063 90; 103.942; 90 | 3175.1 | Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C, 2015, 119, 27104 |
| 1554147 | CIF | C28 H47 Lu O Si3 | P 1 21/c 1 | 10.4; 15.6; 20 90; 105; 90 | 3134.2 | Du, Gaixia; Long, Yingyun; Xue, Jiaping; Zhang, Shaowen; Dong, Yuping; Li, Xiaofang 1,4-Selective Polymerization of 1,3-Cyclohexadiene and Copolymerization with Styrene by Cationic Half-Sandwich Fluorenyl Rare Earth Metal Alkyl Catalysts Macromolecules, 2015, 48, 1627 |
| 1554148 | CIF | C28 H47 O Si3 Y | P 1 21/c 1 | 10.4; 15.8; 20 90; 104.6; 90 | 3180.3 | Du, Gaixia; Long, Yingyun; Xue, Jiaping; Zhang, Shaowen; Dong, Yuping; Li, Xiaofang 1,4-Selective Polymerization of 1,3-Cyclohexadiene and Copolymerization with Styrene by Cationic Half-Sandwich Fluorenyl Rare Earth Metal Alkyl Catalysts Macromolecules, 2015, 48, 1627 |
| 1554149 | CIF | C46 H38 O8 | P -1 | 5.8035; 12.8761; 13.1702 66.778; 82.336; 86.696 | 896.34 | Wang, Zhihan; Randazzo, Katelyn; Hou, Xiaodong; Simpson, Jeffrey; Struppe, Jochem; Ugrinov, Angel; Kastern, Brent; Wysocki, Erin; Chu, Qianli R. Stereoregular Two-Dimensional Polymers Constructed by Topochemical Polymerization Macromolecules, 2015, 48, 2894 |
| 1554150 | CIF | C18 H14 O4 | C 1 2/c 1 | 15.7822; 5.6013; 16.275 90; 99.255; 90 | 1419.99 | Wang, Zhihan; Randazzo, Katelyn; Hou, Xiaodong; Simpson, Jeffrey; Struppe, Jochem; Ugrinov, Angel; Kastern, Brent; Wysocki, Erin; Chu, Qianli R. Stereoregular Two-Dimensional Polymers Constructed by Topochemical Polymerization Macromolecules, 2015, 48, 2894 |
| 1554151 | CIF | C44 H68 N8 O10 | P 1 21/n 1 | 9.226; 20.5019; 24.273 90; 96.132; 90 | 4565 | Wang, Zhihan; Randazzo, Katelyn; Hou, Xiaodong; Simpson, Jeffrey; Struppe, Jochem; Ugrinov, Angel; Kastern, Brent; Wysocki, Erin; Chu, Qianli R. Stereoregular Two-Dimensional Polymers Constructed by Topochemical Polymerization Macromolecules, 2015, 48, 2894 |
| 1554152 | CIF | C23 H19 O4 | P 1 21/n 1 | 5.5677; 9.2109; 35.394 90; 91.726; 90 | 1814.3 | Wang, Zhihan; Randazzo, Katelyn; Hou, Xiaodong; Simpson, Jeffrey; Struppe, Jochem; Ugrinov, Angel; Kastern, Brent; Wysocki, Erin; Chu, Qianli R. Stereoregular Two-Dimensional Polymers Constructed by Topochemical Polymerization Macromolecules, 2015, 48, 2894 |
| 1554153 | CIF | C54 H46 O8 | P -1 | 5.8334; 14.4688; 14.48 119.601; 90.053; 95.149 | 1056.9 | Wang, Zhihan; Randazzo, Katelyn; Hou, Xiaodong; Simpson, Jeffrey; Struppe, Jochem; Ugrinov, Angel; Kastern, Brent; Wysocki, Erin; Chu, Qianli R. Stereoregular Two-Dimensional Polymers Constructed by Topochemical Polymerization Macromolecules, 2015, 48, 2894 |
| 1554154 | CIF | C8 H7 N O4 | C 1 2/c 1 | 12.6313; 7.672; 16.025 90; 107.02; 90 | 1484.9 | Kriechbaum, Konstantin; Cerrón-Infantes, D. Alonso; Stöger, Berthold; Unterlass, Miriam M. Shape-Anisotropic Polyimide Particles by Solid-State Polycondensation of Monomer Salt Single Crystals Macromolecules, 2015, 48, 8773 |
| 1554155 | CIF | C38 H38 N4 O4 | P 1 21/c 1 | 16.966; 10.138; 19.461 90; 104.447; 90 | 3241.5 | Lee, Young-Gi; Kang, Songsu; Moerdyk, Jonathan P.; Bielawski, Christopher W. Poly(2-imino-4-oxazolidinone)s via the Condensation of Diamidocarbenes with Bis(isocyanate)s Macromolecules, 2015, 48, 9081 |
| 1554156 | CIF | C31 H33 N3 O3 | P 1 21/n 1 | 17.244; 18.378; 19.472 90; 113.868; 90 | 5643.1 | Lee, Young-Gi; Kang, Songsu; Moerdyk, Jonathan P.; Bielawski, Christopher W. Poly(2-imino-4-oxazolidinone)s via the Condensation of Diamidocarbenes with Bis(isocyanate)s Macromolecules, 2015, 48, 9081 |
| 1554159 | CIF | C6 H7 K O8 S2 | P 1 21/n 1 | 7.3917; 5.808; 26.6182 90; 94.1545; 90 | 1139.74 | Potzmann, Paul Michael; Lopez Villanueva, Francisco Javier; Liska, Robert UV-Initiated Bubble-Free Frontal Polymerization in Aqueous Conditions Macromolecules, 2015, 48, 8738 |
| 1554753 | CIF | C31 H26 Cl N O4 | P 21 21 21 | 7.9152; 11.4088; 28.388 90; 90; 90 | 2563.5 | He, Zhao-Lin; Sheong, Fu Kit; Li, Qing-Hua; Lin, Zhenyang; Wang, Chun-Jiang Exoselective 1,3-dipolar [3 + 6] cycloaddition of azomethine ylides with 2-acylcycloheptatrienes: stereoselectivity and mechanistic insight. Organic letters, 2015, 17, 1365-1368 |
| 1554755 | CIF | C22 H25 O5 P | P -1 | 7.8931; 9.4542; 14.3399 89.1605; 82.9814; 69.4905 | 994.29 | Kim, Cheol-Eui; Son, Jeong-Yu; Shin, Seohyun; Seo, Boram; Lee, Phil Ho Alkenylation of phosphacoumarins via aerobic oxidative Heck reactions and their synthetic application to fluorescent benzophosphacoumarins. Organic letters, 2015, 17, 908-911 |
| 1554756 | CIF | C26 H23 B F4 N2 O2 | P 1 21/c 1 | 12.2068; 13.731; 14.626 90; 99.027; 90 | 2421.1 | Luo, Ching-Zong; Jayakumar, Jayachandran; Gandeepan, Parthasarathy; Wu, Yun-Ching; Cheng, Chien-Hong Rhodium(III)-catalyzed vinylic C-H activation: a direct route toward pyridinium salts. Organic letters, 2015, 17, 924-927 |
| 1554764 | CIF | C25 H20 B F4 N O | P 1 21/n 1 | 10.72; 18.331; 12.174 90; 110.527; 90 | 2240.4 | Luo, Ching-Zong; Jayakumar, Jayachandran; Gandeepan, Parthasarathy; Wu, Yun-Ching; Cheng, Chien-Hong Rhodium(III)-catalyzed vinylic C-H activation: a direct route toward pyridinium salts. Organic letters, 2015, 17, 924-927 |
| 1554765 | CIF | C25 H21 B F4 N2 O2 | P 1 21/c 1 | 12.3471; 13.3272; 13.9786 90; 98.588; 90 | 2274.42 | Luo, Ching-Zong; Jayakumar, Jayachandran; Gandeepan, Parthasarathy; Wu, Yun-Ching; Cheng, Chien-Hong Rhodium(III)-catalyzed vinylic C-H activation: a direct route toward pyridinium salts. Organic letters, 2015, 17, 924-927 |
| 1554767 | CIF | C31 H24 Cl N O3 | P 1 21 1 | 7.081; 19.406; 9.491 90; 98.161; 90 | 1290.99 | Jayakumar, Samydurai; Kumarswamyreddy, Nandarapu; Prakash, Muthuraj; Kesavan, Venkitasamy Palladium catalyzed asymmetric allylation of 3-OBoc-oxindoles: an efficient synthesis of 3-allyl-3-hydroxyoxindoles. Organic letters, 2015, 17, 1066-1069 |
| 1554773 | CIF | C49.05 H59.38 Cl5.87 Li0.15 N3 P3 Ti2 | P -1 | 10.3083; 14.3567; 19.2355 75.287; 74.747; 84.913 | 2655.7 | Walker, Whitney K.; Anderson, Diana L.; Stokes, Ryjul W.; Smith, Stacey J.; Michaelis, David J. Allylic aminations with hindered secondary amine nucleophiles catalyzed by heterobimetallic Pd-Ti complexes. Organic letters, 2015, 17, 752-755 |
| 1554774 | CIF | C16 H19 Cl3 N P Ti | P -1 | 8.8951; 9.2936; 13.0036 79.226; 76.069; 64.74 | 939.24 | Walker, Whitney K.; Anderson, Diana L.; Stokes, Ryjul W.; Smith, Stacey J.; Michaelis, David J. Allylic aminations with hindered secondary amine nucleophiles catalyzed by heterobimetallic Pd-Ti complexes. Organic letters, 2015, 17, 752-755 |
| 1554776 | CIF | C35 H26 N1.6 O10 | P 21 21 21 | 13.871; 15.1622; 64.627 90; 90; 90 | 13592 | Cao, Pei; Yang, Jing; Miao, Cui-Ping; Yan, Yijun; Ma, Ya-Tuan; Li, Xiao-Nian; Zhao, Li-Xing; Huang, Sheng-Xiong New duclauxamide from Penicillium manginii YIM PH30375 and structure revision of the duclauxin family. Organic letters, 2015, 17, 1146-1149 |
| 1554782 | CIF | C34 H29 N5 O4 S | P -1 | 9.7972; 10.509; 15.4371 72.931; 74.564; 84.268 | 1464.2 | Du, Zao; Xing, Yanpeng; Lu, Ping; Wang, Yanguang Copper-catalyzed cascade double C3-indolations of 3-diazoindolin-2-imines with indoles: convenient access to 3,3-diaryl-2-iminoindoles. Organic letters, 2015, 17, 1192-1195 |
| 1554783 | CIF | C24 H27 N3 O2 | P 1 21/c 1 | 17.5333; 9.245; 13.3467 90; 107.946; 90 | 2058.18 | Bechara, William S.; Khazhieva, Inna S.; Rodriguez, Elsa; Charette, André B One-pot synthesis of 3,4,5-trisubstituted 1,2,4-triazoles via the addition of hydrazides to activated secondary amides. Organic letters, 2015, 17, 1184-1187 |
| 1554791 | CIF | C21 H15 N3 O | P 1 21/c 1 | 10.5706; 17.3802; 10.1316 90; 96.996; 90 | 1847.5 | Bechara, William S.; Khazhieva, Inna S.; Rodriguez, Elsa; Charette, André B One-pot synthesis of 3,4,5-trisubstituted 1,2,4-triazoles via the addition of hydrazides to activated secondary amides. Organic letters, 2015, 17, 1184-1187 |
| 1554793 | CIF | C24 H21 I N2 O3 S | P 21 21 21 | 10.7482; 12.7229; 16.152 90; 90; 90 | 2208.76 | Fu, Shaomin; Yang, Honghao; Li, Guoqiang; Deng, Yuanfu; Jiang, Huanfeng; Zeng, Wei Copper(II)-catalyzed enantioselective intramolecular cyclization of N-alkenylureas. Organic letters, 2015, 17, 1018-1021 |
| 1554794 | CIF | C19 H24 N2 O | P c a 21 | 12.8993; 10.853; 11.6466 90; 90; 90 | 1630.5 | Li, Bo; Wang, Si-Qing; Liu, Bin; Shi, Bing-Feng Synthesis of oxazolines from amides via palladium-catalyzed functionalization of unactivated C(sp(3))-H bond. Organic letters, 2015, 17, 1200-1203 |
| 1554796 | CIF | C24 H44 B2 N2 O4 | P b a m | 12.939; 13.093; 15.573 90; 90; 90 | 2638.2 | Onuma, Kaoru; Suzuki, Katsunori; Yamashita, Makoto Rhombic cyclobutadiene with a boryl/amino-substitution pattern: boryl group migration induced by reaction with water. Organic letters, 2015, 17, 1212-1215 |
| 1554797 | CIF | C29 H49 B2 Co N2 O4 | F d d 2 | 18.923; 58.36; 11.127 90; 90; 90 | 12288 | Onuma, Kaoru; Suzuki, Katsunori; Yamashita, Makoto Rhombic cyclobutadiene with a boryl/amino-substitution pattern: boryl group migration induced by reaction with water. Organic letters, 2015, 17, 1212-1215 |
| 1554798 | CIF | C24 H46 B2 N2 O5 | P 1 21/n 1 | 10.74; 19.626; 13.066 90; 93.197; 90 | 2749.8 | Onuma, Kaoru; Suzuki, Katsunori; Yamashita, Makoto Rhombic cyclobutadiene with a boryl/amino-substitution pattern: boryl group migration induced by reaction with water. Organic letters, 2015, 17, 1212-1215 |
| 1554802 | CIF | C24 H41 B2 O2 P | P 1 21/n 1 | 8.6014; 17.6656; 16.4517 90; 107.162; 90 | 2388.51 | Bayardon, Jérôme; Bernard, Julie; Rémond, Emmanuelle; Rousselin, Yoann; Malacea-Kabbara, Raluca; Jugé, Sylvain Efficient synthesis of (P-chirogenic) o-boronated phosphines from sec-phosphine boranes. Organic letters, 2015, 17, 1216-1219 |
| 1554803 | CIF | C28 H33 B2 Fe O2 P | P 1 21 1 | 12.674; 9.2986; 12.919 90; 113.497; 90 | 1396.3 | Bayardon, Jérôme; Bernard, Julie; Rémond, Emmanuelle; Rousselin, Yoann; Malacea-Kabbara, Raluca; Jugé, Sylvain Efficient synthesis of (P-chirogenic) o-boronated phosphines from sec-phosphine boranes. Organic letters, 2015, 17, 1216-1219 |
| 1554804 | CIF | C40 H43 B2 Fe P | P 21 21 21 | 10.3874; 17.4963; 18.3521 90; 90; 90 | 3335.3 | Bayardon, Jérôme; Bernard, Julie; Rémond, Emmanuelle; Rousselin, Yoann; Malacea-Kabbara, Raluca; Jugé, Sylvain Efficient synthesis of (P-chirogenic) o-boronated phosphines from sec-phosphine boranes. Organic letters, 2015, 17, 1216-1219 |
| 1554806 | CIF | C13 H12 O4 | P 1 21/n 1 | 10.5408; 14.0223; 15.567 90; 95.216; 90 | 2291.4 | Wang, Hong-Li; Shang, Ming; Sun, Shang-Zheng; Zhou, Zeng-Le; Laforteza, Brian N.; Dai, Hui-Xiong; Yu, Jin-Quan Cu(II)-catalyzed coupling of aromatic C-H bonds with malonates. Organic letters, 2015, 17, 1228-1231 |
| 1554809 | CIF | C19 H18 N O5 S2 | P -1 | 7.9459; 8.3713; 15.0845 98.477; 91.135; 97.754 | 982.54 | Deng, Zhimin; Wei, Jialiang; Liao, Lihao; Huang, Haiyan; Zhao, Xiaodan Organoselenium-catalyzed, hydroxy-controlled regio- and stereoselective amination of terminal alkenes: efficient synthesis of 3-amino allylic alcohols. Organic letters, 2015, 17, 1834-1837 |
| 1554810 | CIF | C24 H22 O3 | C 1 c 1 | 14.8194; 23.1341; 17.3079 90; 104.994; 90 | 5731.7 | Gelat, Fabien; Richard, Vincent; Berger, Olivier; Montchamp, Jean-Luc Development of a new family of chiral auxiliaries. Organic letters, 2015, 17, 1819-1821 |
| 1554813 | CIF | C17 H16 Cl N3 O | P -1 | 8.6811; 13.1015; 15.2298 66.74; 82.416; 77.876 | 1553.57 | Guo, Xiao; Chen, Wenteng; Chen, Binhui; Huang, Wei; Qi, Weixing; Zhang, Guolin; Yu, Yongping One-pot three-component strategy for functionalized 2-aminoimidazoles via ring opening of α-nitro epoxides. Organic letters, 2015, 17, 1157-1159 |
| 1554814 | CIF | C34 H35 N O6 S | P 21 21 21 | 9.4387; 22.551; 28.131 90; 90; 90 | 5987.7 | Peng, Peng; Geng, Yiqun; Göttker-Schnetmann, Inigo; Schmidt, Richard R. 2-Nitro-thioglycosides: α- and β-selective generation and their potential as β-selective glycosyl donors. Organic letters, 2015, 17, 1421-1424 |
| 1554815 | CIF | C19 H21 F2 N O | P 1 21/c 1 | 9.9286; 17.0093; 10.0841 90; 90.259; 90 | 1703 | He, Zhengbiao; Tan, Ping; Ni, Chuanfa; Hu, Jinbo Fluoroalkylative aryl migration of conjugated N-arylsulfonylated amides using easily accessible sodium di- and monofluoroalkanesulfinates. Organic letters, 2015, 17, 1838-1841 |
| 1554822 | CIF | C16 H10 N2 O | P 1 21/n 1 | 6.4176; 20.0965; 9.335 90; 98.274; 90 | 1191.42 | Chen, Xiaopei; Cui, Xiuling; Yang, Fangfang; Wu, Yangjie Base-promoted cross-dehydrogenative coupling of quinoline N-oxides with 1,3-azoles. Organic letters, 2015, 17, 1445-1448 |
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