Crystallography Open Database
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Searching year of publication is 2013
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1513008 | CIF | C39 H41 Cl3 Cr N O4 | P 1 21/c 1 | 13.172; 17.525; 16.41 90; 111.64; 90 | 3521.1 | Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene Inorganica Chimica Acta, 2013, 396, 136-143 |
| 1513009 | CIF | C135 H110 Cr2 N4 O9 | P -1 | 12.7934; 12.8886; 16.6146 103.038; 98.875; 96.789 | 2603.45 | Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene Inorganica Chimica Acta, 2013, 396, 136-143 |
| 1513010 | CIF | C39 H40 Cl2 N O4 V | P -1 | 15.05; 21.834; 22.09 83.905; 70.256; 89.896 | 6789 | Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene Inorganica Chimica Acta, 2013, 396, 136-143 |
| 1513011 | CIF | C31 H23 Cl N O3 V | C 1 c 1 | 10.5834; 15.1756; 16.0379 90; 102.386; 90 | 2515.9 | Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene Inorganica Chimica Acta, 2013, 396, 136-143 |
| 1513012 | CIF | C58 H46 N2 O3 P2 Ru | P -1 | 10.1621; 21.344; 22.796 102.307; 96.644; 100.736 | 4683.7 | Soumik Mandal; Dipravath K. Seth; Parna Gupta A closer look at the formation of bicyclometalated and cyclometalated ruthenium carbonyl complexes Inorganica Chimica Acta, 2013, 397, 10-20 |
| 1513013 | CIF | C51 H40 Cl2 N2 O3 P2 Ru | P 1 21/c 1 | 11.9613; 29.818; 13.3927 90; 114.918; 90 | 4332 | Soumik Mandal; Dipravath K. Seth; Parna Gupta A closer look at the formation of bicyclometalated and cyclometalated ruthenium carbonyl complexes Inorganica Chimica Acta, 2013, 397, 10-20 |
| 1513014 | CIF | C54 H47 N O5 P2 Ru | P -1 | 11.9458; 12.9001; 17.0701 71.556; 72.86; 63.978 | 2204.62 | Soumik Mandal; Dipravath K. Seth; Parna Gupta A closer look at the formation of bicyclometalated and cyclometalated ruthenium carbonyl complexes Inorganica Chimica Acta, 2013, 397, 10-20 |
| 1513015 | CIF | C48 H42 N3 O4 P2 Ru S | P -1 | 12.667; 12.937; 13.4361 89.007; 68.689; 80.316 | 2019.7 | Soumik Mandal; Dipravath K. Seth; Parna Gupta A closer look at the formation of bicyclometalated and cyclometalated ruthenium carbonyl complexes Inorganica Chimica Acta, 2013, 397, 10-20 |
| 1513016 | CIF | C54 H45 Cl4 N O3 P2 Ru S | P 1 21/c 1 | 13.0091; 13.9293; 26.838 90; 91.268; 90 | 4862.1 | Soumik Mandal; Dipravath K. Seth; Parna Gupta A closer look at the formation of bicyclometalated and cyclometalated ruthenium carbonyl complexes Inorganica Chimica Acta, 2013, 397, 10-20 |
| 1513017 | CIF | C31 H37 Cu N7 O10 | P n a 21 | 13.2675; 10.2369; 24.371 90; 90; 90 | 3310 | Yuan-Yuan Gao; Ming-Fang Yang; Ning Han, Yue Ma; Ya-Li Wang; Yu-Zhang Tong; Qing-Lun Wang; Li-Cun Li; Dai-Zheng Liao Synthesis, crystal structures and magneto-structural correlations study of three 3d metal-radical heterospin complexes Inorganica Chimica Acta, 2013, 397, 32-37 |
| 1513018 | CIF | C31 H37 N7 Ni O10 | P n a 21 | 13.169; 10.2444; 24.607 90; 90; 90 | 3319.7 | Yuan-Yuan Gao; Ming-Fang Yang; Ning Han, Yue Ma; Ya-Li Wang; Yu-Zhang Tong; Qing-Lun Wang; Li-Cun Li; Dai-Zheng Liao Synthesis, crystal structures and magneto-structural correlations study of three 3d metal-radical heterospin complexes Inorganica Chimica Acta, 2013, 397, 32-37 |
| 1513019 | CIF | C31 H37 Co N7 O10 | P n a 21 | 13.1567; 10.2929; 24.723 90; 90; 90 | 3348 | Yuan-Yuan Gao; Ming-Fang Yang; Ning Han, Yue Ma; Ya-Li Wang; Yu-Zhang Tong; Qing-Lun Wang; Li-Cun Li; Dai-Zheng Liao Synthesis, crystal structures and magneto-structural correlations study of three 3d metal-radical heterospin complexes Inorganica Chimica Acta, 2013, 397, 32-37 |
| 1513020 | CIF | C28 H32 Ba2 Cd N6 O18 | P 43 21 2 | 17.7647; 17.7647; 13.3815 90; 90; 90 | 4222.99 | Yuan-Yuan Huang; Xin Zhang; Yuan-Gen Yao Employing heterometallic trinuclear cluster as building subunit to construct a new coordination polymer with rare 3D inorganic -Cd-O-Ba- connectivity Inorganica Chimica Acta, 2013, 397, 38-41 |
| 1513021 | CIF | C7.25 H10.25 Br0.25 N3.5 O1.75 Zn0.5 | C 1 2/m 1 | 17.2256; 16.2344; 8.5208 90; 99.01; 90 | 2353.42 | Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta, 2013, 397, 48-59 |
| 1513022 | CIF | C12 H14 N4 O4 Zn | C 1 2/c 1 | 11.2129; 13.7421; 9.452 90; 93.97; 90 | 1453 | Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta, 2013, 397, 48-59 |
| 1513023 | CIF | C7 H9 Mn0.5 N2 O3 | C 1 2/c 1 | 14.1319; 12.057; 14.3037 90; 134.955; 90 | 1724.7 | Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta, 2013, 397, 48-59 |
| 1513024 | CIF | C19 H15 Cd N2 O3.5 | P c c n | 14.1825; 17.9582; 14.9933 90; 90; 90 | 3818.7 | Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta, 2013, 397, 48-59 |
| 1513025 | CIF | C54 H92 Co8 N12 O45 | P 1 | 13.9081; 13.9147; 14.0033 113.529; 111.7; 102.769 | 2081.3 | Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta, 2013, 397, 48-59 |
| 1513026 | CIF | C24 H24 Mn N4 O5 | P 1 21/c 1 | 9.5422; 10.475; 22.8707 90; 95.224; 90 | 2276.54 | Jens Hunger Synthesis and structure of coordination polymers of Mn2+, Cu2+, Ag+, Zn2+ and Cd2+ by combination of bipyrazole and diphenate ligands Inorganica Chimica Acta, 2013, 397, 60-68 |
| 1513027 | CIF | C34 H38 Cu N8 O5 | P 21 21 21 | 8.4769; 18.5949; 22.2123 90; 90; 90 | 3501.3 | Jens Hunger Synthesis and structure of coordination polymers of Mn2+, Cu2+, Ag+, Zn2+ and Cd2+ by combination of bipyrazole and diphenate ligands Inorganica Chimica Acta, 2013, 397, 60-68 |
| 1513028 | CIF | C34 H51.12 Ag2 N12 O5.56 | P b c a | 17.8084; 18.8997; 24.4847 90; 90; 90 | 8240.9 | Jens Hunger Synthesis and structure of coordination polymers of Mn2+, Cu2+, Ag+, Zn2+ and Cd2+ by combination of bipyrazole and diphenate ligands Inorganica Chimica Acta, 2013, 397, 60-68 |
| 1513029 | CIF | C24 H23.21 N4 O4.61 Zn | P 21 21 21 | 11.1779; 13.3676; 16.3999 90; 90; 90 | 2450.5 | Jens Hunger Synthesis and structure of coordination polymers of Mn2+, Cu2+, Ag+, Zn2+ and Cd2+ by combination of bipyrazole and diphenate ligands Inorganica Chimica Acta, 2013, 397, 60-68 |
| 1513030 | CIF | C24 H22 Cd N4 O4 | P 32 2 1 | 12.1793; 12.1793; 26.9353 90; 90; 120 | 3460.2 | Jens Hunger Synthesis and structure of coordination polymers of Mn2+, Cu2+, Ag+, Zn2+ and Cd2+ by combination of bipyrazole and diphenate ligands Inorganica Chimica Acta, 2013, 397, 60-68 |
| 1513031 | CIF | C36 H24 Ce N4 O4 | P 1 21/c 1 | 9.986; 9.778; 16.2 90; 106.783; 90 | 1514.4 | Li Li; Fugen Yuan; Tingting Li; Yuan Zhou; Manman Zhang Synthesis and crystal structures of cerium(IV) complexes with 8-quinolinolate and amine bis(phenolate) ligands Inorganica Chimica Acta, 2013, 397, 69-74 |
| 1513032 | CIF | C74 H122 Ce N4 O6 | P -1 | 18.4201; 21.33; 21.487 100.489; 96.276; 113.286 | 7469.8 | Li Li; Fugen Yuan; Tingting Li; Yuan Zhou; Manman Zhang Synthesis and crystal structures of cerium(IV) complexes with 8-quinolinolate and amine bis(phenolate) ligands Inorganica Chimica Acta, 2013, 397, 69-74 |
| 1513053 | CIF | C21 H24 N2 O14 | P 1 21/c 1 | 6.6876; 25.062; 13.824 90; 98.293; 90 | 2292.7 | Ivanova, Bojidarka; Spiteller, Michael Organometallic silver(I) and zinc(II) catalysing coupling processes of polysubstituted benzoic acids Chemical Engineering Journal, 2013, 232, 118 |
| 1513054 | CIF | C6 H13 Cl2 N O | P -1 | 7.022; 8.236; 8.684 63.397; 85.326; 85.478 | 447.1 | Ivanova, Bojidarka; Spiteller, Michael Factors stabilizing the gas-phase ionic species of crystals of organic salts Experimental and theoretical study Journal of Molecular Structure, 2013, 1036, 226 |
| 1513055 | CIF | C7 H15 Cl2 N | P n m a | 7.078; 8.035; 17.775 90; 90; 90 | 1010.9 | Ivanova, Bojidarka; Spiteller, Michael Factors stabilizing the gas-phase ionic species of crystals of organic salts Experimental and theoretical study Journal of Molecular Structure, 2013, 1036, 226 |
| 1513056 | CIF | C7 H3 Cl2 N | P n m a | 7.1481; 8.076; 18.627 90; 90; 90 | 1075.3 | Ivanova, Bojidarka; Spiteller, Michael Factors stabilizing the gas-phase ionic species of crystals of organic salts Experimental and theoretical study Journal of Molecular Structure, 2013, 1036, 226 |
| 1513057 | CIF | C14 H20 Cl N O6 S | P b c a | 13.526; 15.045; 16.533 90; 90; 90 | 3364.4 | Ivanova, Bojidarka; Spiteller, Michael Factors stabilizing the gas-phase ionic species of crystals of organic salts Experimental and theoretical study Journal of Molecular Structure, 2013, 1036, 226 |
| 1513058 | CIF | C15 H22 Cl N O6 S | P 21 21 21 | 8.598; 13.739; 14.788 90; 90; 90 | 1746.9 | Ivanova, Bojidarka; Spiteller, Michael Factors stabilizing the gas-phase ionic species of crystals of organic salts Experimental and theoretical study Journal of Molecular Structure, 2013, 1036, 226 |
| 1513059 | CIF | C13 H18 Cl N O6 S | P -1 | 8.644; 9.085; 11.673 104.782; 104.882; 105.085 | 802.9 | Ivanova, Bojidarka; Spiteller, Michael Factors stabilizing the gas-phase ionic species of crystals of organic salts Experimental and theoretical study Journal of Molecular Structure, 2013, 1036, 226 |
| 1513060 | CIF | C12 H29 N5 O5 | P 21 21 21 | 6.7864; 12.0208; 22.005 90; 90; 90 | 1795.1 | Ivanova, Bojidarka; Spiteller, Michael Heptachloroepoxides - theoretical versus experimental study of the embedded samples in the matrixes of organic crystals Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2013, 76, 415 |
| 1513061 | CIF | C10 H22 N3 O3 | P c a 21 | 10.9481; 14.463; 8.0063 90; 90; 90 | 1267.7 | Ivanova, Bojidarka; Spiteller, Michael Heptachloroepoxides - theoretical versus experimental study of the embedded samples in the matrixes of organic crystals Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2013, 76, 415 |
| 1513062 | CIF | C14 H15 Cl2 N3 O2 | P 1 | 4.8102; 5.795; 13.462 84.048; 87.302; 83.256 | 370.4 | Ivanova, Bojidarka; Spiteller, Michael Heptachloroepoxides - theoretical versus experimental study of the embedded samples in the matrixes of organic crystals Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2013, 76, 415 |
| 1513068 | CIF | C13 H5 F8 N O3 | C 1 2/c 1 | 25.111; 9.5073; 23.702 90; 99.151; 90 | 5586.5 | Sun, Qi; Li, Jun; Liu, Wan-Nian; Dong, Qing-Jian; Yang, Wen-Chao; Yang, Guang-Fu Non-Peptide-based fluorogenic small-molecule probe for elastase. Analytical chemistry, 2013, 85, 11304-11311 |
| 1513073 | CIF | C30 H27 N4 O8 | P 1 21/c 1 | 4.93; 34.514; 8.152 90; 105; 90 | 1339.8 | Ivanova, Bojidarka; Spiteller, Michael Optical properties of substituted piperidine containing natural quinolizidine-alkaloids theoretical vs. experimental study Natural Products Research, 2013 |
| 1513077 | CIF | C22 H26 O7 | P 1 21 1 | 8.4083; 10.1331; 11.461 90; 94.736; 90 | 973.2 | Ding, Chunyong; Zhang, Yusong; Chen, Haijun; Yang, Zhengduo; Wild, Christopher; Ye, Na; Ester, Corbin D.; Xiong, Ailian; White, Mark A.; Shen, Qiang; Zhou, Jia Oridonin Ring A-Based Diverse Constructions of Enone Functionality: Identification of Novel Dienone Analogues Effective for Highly Aggressive Breast Cancer by Inducing Apoptosis Journal of Medicinal Chemistry, 2013, 56, 8814 |
| 1513078 | CIF | C12 H22 F6 N Na O9 S2 | P -1 | 8.221; 9.012; 15.966 80.724; 88.677; 68.189 | 1083 | Mandai, Toshihiko; Nozawa, Risa; Tsuzuki, Seiji; Yoshida, Kazuki; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Phase diagrams and solvate structures of binary mixtures of glymes and na salts. The journal of physical chemistry. B, 2013, 117, 15072-15085 |
| 1513079 | CIF | C10 H22 Cl Na O9 | P 1 21 1 | 12.539; 9.781; 13.473 90; 91.773; 90 | 1651.6 | Mandai, Toshihiko; Nozawa, Risa; Tsuzuki, Seiji; Yoshida, Kazuki; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Phase diagrams and solvate structures of binary mixtures of glymes and na salts. The journal of physical chemistry. B, 2013, 117, 15072-15085 |
| 1513080 | CIF | C14 H26 F6 N Na O10 S2 | P b c a | 13.5214; 16.1932; 22.1855 90; 90; 90 | 4857.6 | Mandai, Toshihiko; Nozawa, Risa; Tsuzuki, Seiji; Yoshida, Kazuki; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Phase diagrams and solvate structures of binary mixtures of glymes and na salts. The journal of physical chemistry. B, 2013, 117, 15072-15085 |
| 1513081 | CIF | C12 H26 Cl Na O10 | C 1 c 1 | 12.138; 30.924; 15.3413 90; 107.119; 90 | 5503.3 | Mandai, Toshihiko; Nozawa, Risa; Tsuzuki, Seiji; Yoshida, Kazuki; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Phase diagrams and solvate structures of binary mixtures of glymes and na salts. The journal of physical chemistry. B, 2013, 117, 15072-15085 |
| 1513082 | CIF | C12 H26 F6 Na O6 P | P 1 21/n 1 | 9.568; 17.117; 12.039 90; 96.437; 90 | 1959.3 | Mandai, Toshihiko; Nozawa, Risa; Tsuzuki, Seiji; Yoshida, Kazuki; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Phase diagrams and solvate structures of binary mixtures of glymes and na salts. The journal of physical chemistry. B, 2013, 117, 15072-15085 |
| 1513083 | CIF | C23 H18 F6 S8 | P -1 | 8.7188; 11.3511; 14.6792 78.45; 74.701; 89.477 | 1371.4 | Castellanos, Sonia; Grubert, Lutz; Stößer, Reinhard; Hecht, Stefan Diarylethene Photoswitches Featuring Tetrathiafulvalene-Containing Aryl Units The Journal of Physical Chemistry C, 2013, 117, 23529 |
| 1513084 | CIF | C24 H17 F6 N S5 | P 1 21/c 1 | 12.4181; 10.4442; 19.0213 90; 90.457; 90 | 2466.93 | Castellanos, Sonia; Grubert, Lutz; Stößer, Reinhard; Hecht, Stefan Diarylethene Photoswitches Featuring Tetrathiafulvalene-Containing Aryl Units The Journal of Physical Chemistry C, 2013, 117, 23529 |
| 1513085 | CIF | C34 H40 N4 | C 1 2/c 1 | 21.767; 5.973; 23.372 90; 96.26; 90 | 3021 | Qi, Qingkai; Zhang, Jibo; Xu, Bin; Li, Bao; Zhang, Sean Xiao-An; Tian, Wenjing Mechanochromism and Polymorphism-Dependent Emission of Tetrakis(4-(dimethylamino)phenyl)ethylene The Journal of Physical Chemistry C, 2013, 117, 24997 |
| 1513086 | CIF | C34 H40 N4 | P 1 21/c 1 | 11.81; 11.257; 23.291 90; 108.84; 90 | 2930.5 | Qi, Qingkai; Zhang, Jibo; Xu, Bin; Li, Bao; Zhang, Sean Xiao-An; Tian, Wenjing Mechanochromism and Polymorphism-Dependent Emission of Tetrakis(4-(dimethylamino)phenyl)ethylene The Journal of Physical Chemistry C, 2013, 117, 24997 |
| 1513087 | CIF | Fe2 O4 Zn | F d -3 m :1 | 8.4313; 8.4313; 8.4313 90; 90; 90 | 599.35 | Teh, Pei Fen; Pramana, Stevin S.; Kim, Chunjoong; Chen, Chieh-Ming; Chuang, Cheng-Hao; Sharma, Yogesh; Cabana, Jordi; Madhavi, Srinivasan Electrochemical Reactivity with Lithium of Spinel-type ZnFe2‒yCryO4(0 ≤y≤ 2) The Journal of Physical Chemistry C, 2013, 117, 24213 |
| 1513088 | CIF | C10 H4 N4 S4 | P 1 21/c 1 | 5.8139; 5.8101; 17.366 90; 101.604; 90 | 574.6 | Tao, Tao; Geng, Jiao; Hong, Liu; Huang, Wei; Tanaka, Hirofumi; Tanaka, Daisuke; Ogawa, Takuji Temperature-Dependent Current‒Voltage and Photoresponsive Properties for Semiconducting Nanodevices Fabricated from an Oligothiazole Dithiol and Gold Nanoparticles The Journal of Physical Chemistry C, 2013, 117, 25325 |
| 1513089 | CIF | C17 H33 Er O10 | P 1 21/n 1 | 10.4187; 19.6076; 10.9402 90; 91.235; 90 | 2234.4 | Ye, H.-Q.; Peng, Y.; Li, Z.; Wang, C.-C.; Zheng, Y.-X.; Motevalli, M.; Wyatt, P. B.; Gillin, W. P.; Hernández, I. Effect of Fluorination on the Radiative Properties of Er3+Organic Complexes: An Opto-Structural Correlation Study The Journal of Physical Chemistry C, 2013, 117, 23970 |
| 1513090 | CIF | C72 Er F60 N3 O6 P6 | P 1 2/n 1 | 12.3554; 13.8738; 23.392 90; 90.974; 90 | 4009.2 | Ye, H.-Q.; Peng, Y.; Li, Z.; Wang, C.-C.; Zheng, Y.-X.; Motevalli, M.; Wyatt, P. B.; Gillin, W. P.; Hernández, I. Effect of Fluorination on the Radiative Properties of Er3+Organic Complexes: An Opto-Structural Correlation Study The Journal of Physical Chemistry C, 2013, 117, 23970 |
| 1513091 | CIF | C72 H60 Er N3 O6 P6 | P -1 | 14.329; 14.8267; 17.7919 89.86; 76.118; 62.792 | 3238.21 | Ye, H.-Q.; Peng, Y.; Li, Z.; Wang, C.-C.; Zheng, Y.-X.; Motevalli, M.; Wyatt, P. B.; Gillin, W. P.; Hernández, I. Effect of Fluorination on the Radiative Properties of Er3+Organic Complexes: An Opto-Structural Correlation Study The Journal of Physical Chemistry C, 2013, 117, 23970 |
| 1513092 | CIF | C20 H31 N O7 | P 1 21/c 1 | 35.507; 4.9795; 12.075 90; 97.548; 90 | 2116.4 | Janni, D. Sirisha; K. Manheri, Muraleedharan Hierarchical Preferences of Hydroxylated Oxanorbornane-Based Achiral Amphiphiles Langmuir, 2013, 29, 15182 |
| 1513093 | CIF | C31 H39 Cl3 N3 O2 Sc | P 21 21 21 | 12.577; 16.012; 16.519 90; 90; 90 | 3327 | Pan, Yu; Xu, Tieqi; Fu, Song; Yang, Guan-Wen; Lu, Xiao-Bing Remarkable Stereochemistry Control in the Polymerization of α-Olefins Using a Simple Scandium Catalyst System Macromolecules, 2013, 46, 8790 |
| 1513094 | CIF | C26 H36 Cl2 O3 Sc | C 1 2/c 1 | 15.6129; 13.1749; 15.98 90; 118.365; 90 | 2892.4 | Pan, Yu; Xu, Tieqi; Fu, Song; Yang, Guan-Wen; Lu, Xiao-Bing Remarkable Stereochemistry Control in the Polymerization of α-Olefins Using a Simple Scandium Catalyst System Macromolecules, 2013, 46, 8790 |
| 1513095 | CIF | C30 H40 S8 | P -1 | 6.6801; 11.517; 11.5244 99.111; 105.013; 101.559 | 818.02 | Schneider, Julia A.; Dadvand, Afshin; Wen, Wen; Perepichka, Dmitrii F. Tuning the Electronic Properties of Poly(thienothiophene vinylene)s via Alkylsulfanyl and Alkylsulfonyl Substituents Macromolecules, 2013, 46, 9231 |
| 1513097 | CIF | C42 H86 N28 O36 | P 1 21/c 1 | 25.3872; 13.6881; 44.9208 90; 103.268; 90 | 15193.4 | Ma, Wen-Juan; Chen, Jia-Mei; Jiang, Long; Yao, Jia; Lu, Tong-Bu The Delivery of Triamterene by Cucurbit[7]uril: Synthesis, Structures and Pharmacokinetics Study. Molecular pharmaceutics, 2013, 10, 4698-4705 |
| 1513098 | CIF | C54 H107 Cl2 N35 O40 | I 41/a | 35.5457; 35.5457; 29.5785 90; 90; 90 | 37372.3 | Ma, Wen-Juan; Chen, Jia-Mei; Jiang, Long; Yao, Jia; Lu, Tong-Bu The Delivery of Triamterene by Cucurbit[7]uril: Synthesis, Structures and Pharmacokinetics Study. Molecular pharmaceutics, 2013, 10, 4698-4705 |
| 1513100 | CIF | C54 H113 Cl2 N35 O43 | I 41/a | 40.8323; 40.8323; 23.3137 90; 90; 90 | 38870.4 | Ma, Wen-Juan; Chen, Jia-Mei; Jiang, Long; Yao, Jia; Lu, Tong-Bu The Delivery of Triamterene by Cucurbit[7]uril: Synthesis, Structures and Pharmacokinetics Study. Molecular pharmaceutics, 2013, 10, 4698-4705 |
| 1513101 | CIF | C20 H26 O8 S | P 21 21 21 | 9.2491; 14.3509; 15.8699 90; 90; 90 | 2106.5 | Meng, Ling-Hong; Li, Xiao-Ming; Lv, Cui-Ting; Li, Chun-Shun; Xu, Gang-Ming; Huang, Cai-Guo; Wang, Bin-Gui Sulfur-Containing Cytotoxic Curvularin Macrolides from Penicillium sumatrense MA-92, a Fungus Obtained from the Rhizosphere of the Mangrove Lumnitzera racemosa. Journal of natural products, 2013, 76, 2145-2149 |
| 1513102 | CIF | C16 H27 N O | P 21 21 21 | 7.0316; 9.5125; 21.7347 90; 90; 90 | 1453.79 | Jaisamut, Sunan; Prabpai, Samran; Tancharoen, Chompoonuch; Yuenyongsawad, Supreeya; Hannongbua, Supa; Kongsaeree, Palangpon; Plubrukarn, Anuchit Bridged Tricyclic Sesquiterpenes from the Tubercle Nudibranch Phyllidia coelestis Bergh. Journal of natural products, 2013, 76, 2158-2161 |
| 1513103 | CIF | C17 H11 Cl N2 O5 | P 1 21 1 | 12.08; 9.919; 13.7 90; 90.45; 90 | 1641.5 | Li, Xiangmin; Wang, Sinan; Li, Tengfei; Li, Jian; Li, Hao; Wang, Wei Formation of Dihydronaphthalenes via Organocatalytic Enatioselective Michael-Aldol Cascade Reactions with Arylalkanes. Organic letters, 2013, 15, 5634-5637 |
| 1513104 | CIF | C29 H22 F6 N2 O3 S | P 1 21 1 | 10.2357; 8.6902; 14.9501 90; 97.803; 90 | 1317.5 | Elmes, Robert B. P.; Turner, Peter; Jolliffe, Katrina A. Colorimetric and Luminescent Sensors for Chloride: Hydrogen Bonding vs Deprotonation Organic Letters, 2013, 15, 5638 |
| 1513105 | CIF | C28 H23 F3 N2 O3 S | P 1 21/c 1 | 26.7471; 4.739; 19.892 90; 105.737; 90 | 2426.89 | Elmes, Robert B. P.; Turner, Peter; Jolliffe, Katrina A. Colorimetric and Luminescent Sensors for Chloride: Hydrogen Bonding vs Deprotonation Organic Letters, 2013, 15, 5638 |
| 1513106 | CIF | C27 H23 N3 O5 S | P 1 21/c 1 | 10.5208; 32.37; 7.1715 90; 109.702; 90 | 2299.3 | Elmes, Robert B. P.; Turner, Peter; Jolliffe, Katrina A. Colorimetric and Luminescent Sensors for Chloride: Hydrogen Bonding vs Deprotonation Organic Letters, 2013, 15, 5638 |
| 1513107 | CIF | C43 H52 Cl F6 N3 O2 | P 1 21/c 1 | 13.1149; 22.854; 14.9779 90; 113.998; 90 | 4101.2 | Elmes, Robert B. P.; Turner, Peter; Jolliffe, Katrina A. Colorimetric and Luminescent Sensors for Chloride: Hydrogen Bonding vs Deprotonation Organic Letters, 2013, 15, 5638 |
| 1513108 | CIF | C41 H54 Cl N3 O2 | P -1 | 8.677; 21.099; 22.462 64.761; 82.738; 79.399 | 3651 | Elmes, Robert B. P.; Turner, Peter; Jolliffe, Katrina A. Colorimetric and Luminescent Sensors for Chloride: Hydrogen Bonding vs Deprotonation Organic Letters, 2013, 15, 5638 |
| 1513109 | CIF | C28 H40 F16 N8 Sb3 | P -1 | 18.492; 22.225; 26.253 103.873; 95.074; 107.152 | 9860.6 | Betterley, Nolan M.; Surawatanawong, Panida; Prabpai, Samran; Kongsaeree, Palangpon; Kuhakarn, Chutima; Pohmakotr, Manat; Reutrakul, Vichai Electrophilic Difluoro(phenylthio)methylation: Generation, Stability, and Reactivity of α-Fluorocarbocations. Organic letters, 2013, 15, 5666-5669 |
| 1513110 | CIF | C26 H31 N4 O7 | P -1 | 8.057; 9.258; 17.387 80.687; 79.096; 87.104 | 1256.5 | Zhang, Hongbo; Ning, Xin; Hang, Hang; Ru, Xuyan; Li, Haichen; Li, Yonghong; Wang, Lizhong; Zhang, Xiao; Yu, Shujing; Qiao, Yuanyuan; Wang, Xin; Wang, Peng George Total Synthesis of Thaxtomin A and Its Stereoisomers and Findings of Their Biological Activities Organic Letters, 2013, 15, 5670 |
| 1513111 | CIF | C22 H22 N4 O6 | C 1 2 1 | 14.897; 6.8317; 20.38 90; 102.13; 90 | 2027.8 | Zhang, Hongbo; Ning, Xin; Hang, Hang; Ru, Xuyan; Li, Haichen; Li, Yonghong; Wang, Lizhong; Zhang, Xiao; Yu, Shujing; Qiao, Yuanyuan; Wang, Xin; Wang, Peng George Total Synthesis of Thaxtomin A and Its Stereoisomers and Findings of Their Biological Activities Organic Letters, 2013, 15, 5670 |
| 1513112 | CIF | C22 H31 Cl O6 | P 21 21 21 | 9.5078; 10.0045; 22.4594 90; 90; 90 | 2136.36 | Igarashi, Yasuhiro; Zhou, Tao; Sato, Seizo; Matsumoto, Takashi; Yu, Linkai; Oku, Naoya Akaeolide, a carbocyclic polyketide from marine-derived streptomyces. Organic letters, 2013, 15, 5678-5681 |
| 1513113 | CIF | C17 H18 O4 | P 21 21 21 | 6.1571; 7.7921; 31.207 90; 90; 90 | 1497.2 | Wang, Zhenjun; Ren, Jun; Wang, Zhongwen Lewis acids promoted formal intramolecular [3 + 2] parallel and cross-cycloadditions of cyclopropane 1,1-diesters with allenes. Organic letters, 2013, 15, 5682-5685 |
| 1513114 | CIF | C17 H18 O4 | P 1 21/c 1 | 22.456; 7.854; 17.884 90; 111.823; 90 | 2928.2 | Wang, Zhenjun; Ren, Jun; Wang, Zhongwen Lewis acids promoted formal intramolecular [3 + 2] parallel and cross-cycloadditions of cyclopropane 1,1-diesters with allenes. Organic letters, 2013, 15, 5682-5685 |
| 1513115 | CIF | C17 H17 Br O4 | P 1 21/n 1 | 12.112; 8.925; 15.461 90; 109.235; 90 | 1578 | Wang, Zhenjun; Ren, Jun; Wang, Zhongwen Lewis acids promoted formal intramolecular [3 + 2] parallel and cross-cycloadditions of cyclopropane 1,1-diesters with allenes. Organic letters, 2013, 15, 5682-5685 |
| 1513116 | CIF | C17 H17 Cl O4 | P -1 | 7.798; 9.143; 21.383 88.942; 81.965; 85.381 | 1504.6 | Wang, Zhenjun; Ren, Jun; Wang, Zhongwen Lewis acids promoted formal intramolecular [3 + 2] parallel and cross-cycloadditions of cyclopropane 1,1-diesters with allenes. Organic letters, 2013, 15, 5682-5685 |
| 1513117 | CIF | C17 H17 Br O4 | P 1 21/n 1 | 12.112; 8.925; 15.461 90; 109.235; 90 | 1578 | Wang, Zhenjun; Ren, Jun; Wang, Zhongwen Lewis acids promoted formal intramolecular [3 + 2] parallel and cross-cycloadditions of cyclopropane 1,1-diesters with allenes. Organic letters, 2013, 15, 5682-5685 |
| 1513119 | CIF | C27 H20 F2 N2 | P 1 21/c 1 | 10.1525; 11.2182; 18.201 90; 90.051; 90 | 2073 | Kannaboina, Prakash; Anilkumar, K.; Aravinda, S.; Vishwakarma, Ram A.; Das, Parthasarathi Direct C-2 Arylation of 7-Azaindoles: Chemoselective Access to Multiarylated Derivatives Organic Letters, 2013, 15, 5718 |
| 1513120 | CIF | C23 H27.58 Br O8.29 | P 21 21 21 | 6.3073; 11.2135; 32.412 90; 90; 90 | 2292.4 | Riley, Andrew P.; Day, Victor W.; Navarro, Hern A.; Prisinzano, Thomas E. Palladium-Catalyzed Transformations of Salvinorin A, a Neoclerodane Diterpene fromSalvia divinorum Organic Letters, 2013, 15, 5936 |
| 1513121 | CIF | C34 H37 N O2 | P 21 21 21 | 6.2995; 20.109; 21.2319 90; 90; 90 | 2689.6 | Kuwahara, Shunsuke; Nakamura, Masaya; Yamaguchi, Akira; Ikeda, Mari; Habata, Yoichi Combination of a New Chiroptical Probe and Theoretical Calculations for Chirality Detection of Primary Amines Organic Letters, 2013, 15, 5738 |
| 1513122 | CIF | C36 H39 N O2 | P 1 21 1 | 5.8922; 22.0263; 11.1024 90; 96.629; 90 | 1431.27 | Kuwahara, Shunsuke; Nakamura, Masaya; Yamaguchi, Akira; Ikeda, Mari; Habata, Yoichi Combination of a New Chiroptical Probe and Theoretical Calculations for Chirality Detection of Primary Amines Organic Letters, 2013, 15, 5738 |
| 1513123 | CIF | C32 H33 N O2 | P 1 21 1 | 8.5443; 25.924; 11.1528 90; 96.665; 90 | 2453.7 | Kuwahara, Shunsuke; Nakamura, Masaya; Yamaguchi, Akira; Ikeda, Mari; Habata, Yoichi Combination of a New Chiroptical Probe and Theoretical Calculations for Chirality Detection of Primary Amines Organic Letters, 2013, 15, 5738 |
| 1513124 | CIF | C30 H33 Cl N2 O3 S | C 1 2 1 | 37.404; 6.7314; 10.8232 90; 90.249; 90 | 2725.1 | Xu, Qing-Long; Zhuo, Chun-Xiang; Dai, Li-Xin; You, Shu-Li Highly Enantioselective Synthesis of TetrahydrocarbolinesviaIridium-Catalyzed Intramolecular Friedel‒Crafts Type Allylic Alkylation Reactions Organic Letters, 2013, 15, 5909 |
| 1513125 | CIF | C31 H35 Br N2 O3 | P 21 21 21 | 9.9583; 11.9802; 22.9491 90; 90; 90 | 2737.9 | Ryabchuk, Pavel; Edwards, Andrew; Gerasimchuk, Nikolay; Rubina, Marina; Rubin, Michael Dual Control of the Selectivity in the Formal Nucleophilic Substitution of Bromocyclopropanes en Route to Densely Functionalized, Chirally Rich Cyclopropyl Derivatives Organic Letters, 2013, 15, 6010 |
| 1513126 | CIF | C23 H29 N O2 | P 21 21 21 | 9.6721; 19.6189; 21.5843 90; 90; 90 | 4095.7 | Ryabchuk, Pavel; Edwards, Andrew; Gerasimchuk, Nikolay; Rubina, Marina; Rubin, Michael Dual Control of the Selectivity in the Formal Nucleophilic Substitution of Bromocyclopropanes en Route to Densely Functionalized, Chirally Rich Cyclopropyl Derivatives Organic Letters, 2013, 15, 6010 |
| 1513127 | CIF | C17 H16 O2 | P -1 | 5.3111; 11.4886; 11.49 104.545; 103.338; 93.62 | 654.83 | Cui, Chun-Xiao; Li, Hui; Yang, Xian-Jin; Yang, Jun; Li, Xiao-Qiang One-Pot Synthesis of Functionalized 2,5-Dihydrofurans via an Amine-Promoted Petasis Borono‒Mannich Reaction Organic Letters, 2013, 15, 5944 |
| 1513128 | CIF | C28 H25 Br O6 S2 | P b c a | 17.494; 10.8153; 27.104 90; 90; 90 | 5128.2 | Zheng, Jie; Huang, You; Li, Zhengming Phosphine-Catalyzed Domino Reaction: An Efficient Method for the Synthesis of Bicyclo[3.2.0]heptenes Skeleton. Organic letters, 2013, 15, 5758-5761 |
| 1513129 | CIF | C17 H20 N2 | P m m n :2 | 14.1243; 6.7924; 7.1322 90; 90; 90 | 684.25 | Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems Organic Letters, 2013, 15, 5970 |
| 1513130 | CIF | C15 H14 O2 | P n a 21 | 16.7078; 7.0015; 20.3649 90; 90; 90 | 2382.3 | Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems Organic Letters, 2013, 15, 5970 |
| 1513131 | CIF | C19 H32 B2 O4 | F d d 2 | 34.026; 18.078; 6.8131 90; 90; 90 | 4190.9 | Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems Organic Letters, 2013, 15, 5970 |
| 1513132 | CIF | C19 H18 | P n a 21 | 15.9505; 14.6663; 5.851 90; 90; 90 | 1368.75 | Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems Organic Letters, 2013, 15, 5970 |
| 1513133 | CIF | C15 H14 S2 | P c a 21 | 7.5615; 21.1348; 16.2978 90; 90; 90 | 2604.56 | Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems Organic Letters, 2013, 15, 5970 |
| 1513134 | CIF | C29 H27 Cl N4 O3 S | P 1 21/c 1 | 11.8463; 13.189; 17.3532 90; 91.8; 90 | 2709.9 | Zhou, Fenguo; Liu, Xu; Zhang, Ning; Liang, Yongjiu; Zhang, Rui; Xin, Xiaoqing; Dong, Dewen Copper-Catalyzed Three-Component Reaction: Solvent-Controlled Regioselective Synthesis of 4-Amino- and 6-Amino-2-iminopyridines. Organic letters, 2013, 15, 5786-5789 |
| 1513135 | CIF | C32 H34 N4 O2 Ti | C 1 2/c 1 | 16.2081; 13.8771; 25.5319 90; 97.52; 90 | 5693.3 | Chong, Eugene; Schafer, Laurel L. 2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination Organic Letters, 2013, 15, 6002 |
| 1513136 | CIF | C17 H19 N O2 S | P 1 21/c 1 | 9.737; 23.103; 7.481 90; 110.674; 90 | 1574.5 | Chong, Eugene; Schafer, Laurel L. 2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination Organic Letters, 2013, 15, 6002 |
| 1513137 | CIF | C31 H39 N O2 S | P -1 | 10.6913; 11.55; 12.416 73.755; 72.091; 66.422 | 1315.33 | Chong, Eugene; Schafer, Laurel L. 2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination Organic Letters, 2013, 15, 6002 |
| 1513138 | CIF | C17 H25 N O2 S | P 1 21/n 1 | 10.852; 11.501; 12.86 90; 94.93; 90 | 1599.1 | Chong, Eugene; Schafer, Laurel L. 2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination Organic Letters, 2013, 15, 6002 |
| 1513139 | CIF | C24 H34 I N O3 Si | P 1 21 1 | 12.4043; 11.4302; 17.7674 90; 92.4761; 90 | 2516.77 | Schwarzwalder, Gregg M.; Steinhardt, Sarah E.; Pham, Hung V.; Houk, K. N.; Vanderwal, Christopher D. Synthesis of the Tetracyclic Core of Exiguaquinol Organic Letters, 2013, 15, 6014 |
| 1513140 | CIF | C17 H17 N O4 | P 1 21/n 1 | 6.486; 7.921; 27.059 90; 90.113; 90 | 1390.2 | Schwarzwalder, Gregg M.; Steinhardt, Sarah E.; Pham, Hung V.; Houk, K. N.; Vanderwal, Christopher D. Synthesis of the Tetracyclic Core of Exiguaquinol Organic Letters, 2013, 15, 6014 |
| 1513141 | CIF | C16 H23 N O3 | P 21 21 21 | 8.6643; 16.9926; 19.039 90; 90; 90 | 2803.1 | Zeng, Chen; Zheng, Changwu; Zhao, Jingyun; Zhao, Gang Divergent Total Syntheses of (−)-Lycopladine D, (+)-Fawcettidine, and (+)-Lycoposerramine Q Organic Letters, 2013, 15, 5846 |
| 1513142 | CIF | C8 H16 O5 | P 1 21 1 | 5.775; 8.1191; 10.0943 90; 93.44; 90 | 472.45 | Schmalisch, Sebastian; Mahrwald, Rainer Organocatalyzed direct glycosylation of unprotected and unactivated carbohydrates. Organic letters, 2013, 15, 5854-5857 |
| 1513143 | CIF | C16 H16 O3 | P 1 21/c 1 | 13.699; 6.316; 15.3815 90; 108.356; 90 | 1263.14 | Ngatimin, Marsewi; Frey, Raphael; Levens, Alison; Nakano, Yuji; Kowalczyk, Marcin; Konstas, Kristina; Hutt, Oliver E.; Lupton, David W. Iodobenzene-Catalyzed Oxabicyclo[3.2.1]octane and [4.2.1]Nonane Synthesis via Cascade C‒O/C‒C Formation Organic Letters, 2013, 15, 5858 |
| 1513144 | CIF | C17 H16 O4 | P 1 21/c 1 | 14.2105; 12.8932; 7.697 90; 102.363; 90 | 1377.53 | Ngatimin, Marsewi; Frey, Raphael; Levens, Alison; Nakano, Yuji; Kowalczyk, Marcin; Konstas, Kristina; Hutt, Oliver E.; Lupton, David W. Iodobenzene-Catalyzed Oxabicyclo[3.2.1]octane and [4.2.1]Nonane Synthesis via Cascade C‒O/C‒C Formation Organic Letters, 2013, 15, 5858 |
| 1513145 | CIF | C24 H18 O | P 21 21 21 | 7.9684; 11.671; 18.419 90; 90; 90 | 1713 | Yin, Hui-Ying; Liu, Meng-Yuan; Shao, Li-Xiong Two-Component, Three-Molecule Reactions between 2,3-Dihydroinden-1-ones and Aryl Chlorides Catalyzed by anN-Heterocyclic Carbene‒Palladium(II)‒1-Methylimidazole Complex Organic Letters, 2013, 15, 6042 |
| 1513146 | CIF | C13 H11 N O2 S | P 1 21/c 1 | 11.173; 8.197; 14.575 90; 112.89; 90 | 1230 | Singh, Neetu; Singh, Rahul; Raghuvanshi, Dushyant S.; Singh, Krishna Nand Convenient MW-Assisted Synthesis of Unsymmetrical Sulfides Using Sulfonyl Hydrazides as Aryl Thiol Surrogate Organic Letters, 2013, 15, 5874 |
| 1513147 | CIF | C18 H15 N3 S | P 1 21/c 1 | 7.3509; 13.236; 17.3774 90; 96.212; 90 | 1680.83 | Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation. Organic letters, 2013, 15, 5622-5625 |
| 1513148 | CIF | C18 H14 Cl N3 S | P -1 | 10.3005; 13.8761; 14.074 109.27; 103.328; 106.93 | 1693.6 | Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation. Organic letters, 2013, 15, 5622-5625 |
| 1513149 | CIF | C18 H13 Cl2 N3 S | P 1 21/n 1 | 10.441; 12.297; 14.244 90; 92.363; 90 | 1827.3 | Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation. Organic letters, 2013, 15, 5622-5625 |
| 1513150 | CIF | C24 H19 N3 S | P 1 21/c 1 | 8.837; 15.942; 14.955 90; 107.099; 90 | 2013.7 | Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation. Organic letters, 2013, 15, 5622-5625 |
| 1513151 | CIF | C18 H11 Cl N2 S | P -1 | 7.4883; 9.0691; 11.6776 90.666; 103.398; 100.053 | 758.5 | Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation. Organic letters, 2013, 15, 5622-5625 |
| 1513152 | CIF | C26 H30 O7 | P 21 21 21 | 12.0469; 12.5034; 15.3775 90; 90; 90 | 2316.3 | Yuan, Yafei; Feng, Yu; Ren, Fengxia; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng A Botryane Metabolite with a New Hexacyclic Skeleton from an Entomogenous FungusHypocreasp. Organic Letters, 2013, 15, 6050 |
| 1513153 | CIF | C17 H21 N O4 S | P 1 21 1 | 9.255; 8.8201; 10.2868 90; 107.491; 90 | 800.89 | Liu, Yong; Kang, Tai-Ran; Liu, Quan-Zhong; Chen, Lian-Mei; Wang, Ya-Chuan; Liu, Jie; Xie, Yong-Mei; Yang, Jin-Liang; He, Long Enantioselective [4 + 2] Cycloaddition of CyclicN-Sulfimines and Acyclic Enones or Ynones: A Concise Route to Sulfamidate-Fused 2,6-Disubstituted Piperidin-4-ones Organic Letters, 2013, 15, 6090 |
| 1513154 | CIF | C19 H17 Br O2 | P -1 | 8.684; 9.003; 10.901 88.522; 81.148; 76.868 | 820.1 | Li, Xiao-Hui; Zheng, Bao-Hui; Ding, Chang-Hua; Hou, Xue-Long Enantioselective Synthesis of 2,3-Disubstituted Indanones via Pd-Catalyzed Intramolecular Asymmetric Allylic Alkylation of Ketones Organic Letters, 2013, 15, 6086 |
| 1513155 | CIF | C8 H11 N O5 | P 1 21/c 1 | 7.8071; 17.361; 6.722 90; 93.918; 90 | 909 | Schmidt, Christian D.; Kaschel, Johannes; Schneider, Tobias F.; Kratzert, Daniel; Stalke, Dietmar; Werz, Daniel B. Donor-Substituted Nitrocyclopropanes: Immediate Ring-Enlargement to Cyclic Nitronates Organic Letters, 2013, 15, 6098 |
| 1513156 | CIF | C10 H14 N2 O5 | P 1 21/c 1 | 12.4044; 10.3305; 9.007 90; 102.544; 90 | 1126.64 | Schmidt, Christian D.; Kaschel, Johannes; Schneider, Tobias F.; Kratzert, Daniel; Stalke, Dietmar; Werz, Daniel B. Donor-Substituted Nitrocyclopropanes: Immediate Ring-Enlargement to Cyclic Nitronates Organic Letters, 2013, 15, 6098 |
| 1513157 | CIF | C13 H15 N O5 | P b c a | 10.6801; 8.9717; 26.3836 90; 90; 90 | 2528.04 | Schmidt, Christian D.; Kaschel, Johannes; Schneider, Tobias F.; Kratzert, Daniel; Stalke, Dietmar; Werz, Daniel B. Donor-Substituted Nitrocyclopropanes: Immediate Ring-Enlargement to Cyclic Nitronates Organic Letters, 2013, 15, 6098 |
| 1513158 | CIF | C18 H17 N O4 S | P 1 21/c 1 | 14.9906; 7.8091; 14.0672 90; 92.142; 90 | 1645.6 | Sun, Lang; Zhu, Yuanxun; Lu, Ping; Wang, Yanguang Cu-Catalyzed 1,2-Dihydroisoquinolines Synthesis fromo-Ethynyl Benzacetals and Sulfonyl Azides Organic Letters, 2013, 15, 5894 |
| 1513159 | CIF | C17 H15 Cl2 N O4 S | P 1 21/c 1 | 11.6058; 7.0455; 21.6906 90; 95.904; 90 | 1764.2 | Sun, Lang; Zhu, Yuanxun; Lu, Ping; Wang, Yanguang Cu-Catalyzed 1,2-Dihydroisoquinolines Synthesis fromo-Ethynyl Benzacetals and Sulfonyl Azides Organic Letters, 2013, 15, 5894 |
| 1513160 | CIF | C34 H34 N4 O13 S2 | P 1 21/n 1 | 9.9318; 12.1574; 15.0926 90; 104.533; 90 | 1764 | Sun, Lang; Zhu, Yuanxun; Lu, Ping; Wang, Yanguang Cu-Catalyzed 1,2-Dihydroisoquinolines Synthesis fromo-Ethynyl Benzacetals and Sulfonyl Azides Organic Letters, 2013, 15, 5894 |
| 1513161 | CIF | C17 H25 N3 O2 | P 1 21/a 1 | 11.62; 8.989; 15.81 90; 96.74; 90 | 1640 | Mercalli, Valentina; Meneghetti, Fiorella; Tron, Gian Cesare Isocyanide-Mediated Multicomponent Synthesis of C-Oximinoamidines Organic Letters, 2013, 15, 5902 |
| 1513162 | CIF | C9 H18 O2 | F d d 2 | 15.3408; 44.262; 5.177 90; 90; 90 | 3515.3 | Tong, Benny Meng Kiat; Chen, Hui; Chong, Sin Yee; Heng, Yi Li; Chiba, Shunsuke Formal [4 + 1]- and [5 + 1]-Annulation by an SN2‒Conjugate Addition Sequence: Stereoselective Synthesis of Highly Substituted Carbocyles Organic Letters, 2013, 15, 6111 |
| 1513170 | CIF | C8 H10 N5 O | P 1 c 1 | 16.512; 5.3679; 10.385 90; 94.041; 90 | 918.2 | Ivanova, Bojidarka; Spiteller, Michael A novel UV-MALDI-MS analytical approach for determination of halogenated phenyl-containing pesticides Ecotoxicology and Environmental Safety, 2013, 91, 86-95 |
| 1513171 | CIF | C12 H2 N2 O | P b c a | 10.5942; 9.8494; 19.646 90; 90; 90 | 2050 | Ivanova, Bojidarka; Spiteller, Michael A novel UV-MALDI-MS analytical approach for determination of halogenated phenyl-containing pesticides Ecotoxicology and Environmental Safety, 2013, 91, 86-95 |
| 1513175 | CIF | C44 H40 Cu N2 O8 | P -1 | 8.4849; 10.2733; 11.8111 89.973; 90.088; 111.135 | 960.29 | Sema Caglar; Ekrem Adiguzel; Bulent Caglar; Tuba Saykal; Ertan Sahin; Orhan Buyukgungor Synthesis, crystal structure, spectroscopic, thermal, catechol oxidase and catalase-like studies: New copper(II) complexes of 2-benzoylbenzoate and 2-pyridilpropanol ligands Inorganica Chimica Acta, 2013, 397, 101-109 |
| 1513176 | CIF | C22 H19 Cu N O4 | P 1 21/n 1 | 10.821; 15.026; 12.219 90; 99.168; 90 | 1961.4 | Sema Caglar; Ekrem Adiguzel; Bulent Caglar; Tuba Saykal; Ertan Sahin; Orhan Buyukgungor Synthesis, crystal structure, spectroscopic, thermal, catechol oxidase and catalase-like studies: New copper(II) complexes of 2-benzoylbenzoate and 2-pyridilpropanol ligands Inorganica Chimica Acta, 2013, 397, 101-109 |
| 1513177 | CIF | C22 H28 Cl4 Mn2 N2 O6 | P 1 21/c 1 | 10.295; 17.826; 7.705 90; 101.897; 90 | 1383.6 | Yasemin Yahsi; Hulya Kara Synthesis, structural analysis and magnetic properties of two novel doubly oxygen bridged binuclear manganese(III) and copper(II) complexes with ONO tridentate ligands Inorganica Chimica Acta, 2013, 397, 110-116 |
| 1513178 | CIF | C13 H7 Cl2 Cu N O2 | P 1 21/c 1 | 5.2082; 15.8065; 15.2221 90; 106.717; 90 | 1200.17 | Yasemin Yahsi; Hulya Kara Synthesis, structural analysis and magnetic properties of two novel doubly oxygen bridged binuclear manganese(III) and copper(II) complexes with ONO tridentate ligands Inorganica Chimica Acta, 2013, 397, 110-116 |
| 1513179 | CIF | C16 H12 Cl N3 O3 Zn | P b c n | 20.452; 7.2803; 21.203 90; 90; 90 | 3157.1 | Fei Yuan; Qiao-E Zhu; Huai-Ming Hu; Juan Xie; Bing Xu; Chun-Mei Yuan; Meng-Lin Yang; Fa-Xin Dong; Gang-Lin Xue Three novel coordination polymers based on bifunctionalized ligand 4'-carboxy-4,2':6',4'-terpyridine Inorganica Chimica Acta, 2013, 397, 117-123 |
| 1513180 | CIF | C20 H12 N3 O4 Zn | P -1 | 7.769; 9.854; 11.197 82.189; 80.792; 73.98 | 809.5 | Fei Yuan; Qiao-E Zhu; Huai-Ming Hu; Juan Xie; Bing Xu; Chun-Mei Yuan; Meng-Lin Yang; Fa-Xin Dong; Gang-Lin Xue Three novel coordination polymers based on bifunctionalized ligand 4'-carboxy-4,2':6',4'-terpyridine Inorganica Chimica Acta, 2013, 397, 117-123 |
| 1513181 | CIF | C20 H12 Cu N3 O4 | P 1 21/n 1 | 9.5561; 16.1623; 11.506 90; 101.398; 90 | 1742 | Fei Yuan; Qiao-E Zhu; Huai-Ming Hu; Juan Xie; Bing Xu; Chun-Mei Yuan; Meng-Lin Yang; Fa-Xin Dong; Gang-Lin Xue Three novel coordination polymers based on bifunctionalized ligand 4'-carboxy-4,2':6',4'-terpyridine Inorganica Chimica Acta, 2013, 397, 117-123 |
| 1513182 | CIF | C12 H11 I2 N2 O Rh | P -1 | 6.9968; 8.4323; 13.606 75.395; 81.482; 75.678 | 749.51 | Kimberly A. Manbeck; William W. Brennessel; William D. Jones Examination of a dicationic rhodium methyl aquo complex Inorganica Chimica Acta, 2013, 397, 140-143 |
| 1513183 | CIF | C68 H76.75 Cd5 Cl4 N36 O29.5 | C 1 2 1 | 45.815; 13.88; 16.375 90; 106.948; 90 | 9961 | Saugata Konar; Atanu Jana; Kinsuk Das; Sangita Ray; James A. Golen; Arnold L. Rheingold; Susanta Kumar Kar A rare pentanuclear cadmium(II) complex and two new mononuclear zinc(II) complexes of pyrazole derived ditopic ligands - Synthesis, crystal structures and spectral studies Inorganica Chimica Acta, 2013, 397, 144-151 |
| 1513184 | CIF | C22 H26 Cl2 N12 O11 Zn | P -1 | 11.4714; 12.0739; 13.8484 95.29; 96.499; 108.485 | 1790.6 | Saugata Konar; Atanu Jana; Kinsuk Das; Sangita Ray; James A. Golen; Arnold L. Rheingold; Susanta Kumar Kar A rare pentanuclear cadmium(II) complex and two new mononuclear zinc(II) complexes of pyrazole derived ditopic ligands - Synthesis, crystal structures and spectral studies Inorganica Chimica Acta, 2013, 397, 144-151 |
| 1513185 | CIF | C22 H30 Cl2 N14 O12 Zn | P -1 | 11.7107; 12.015; 12.1097 101.593; 97.933; 94.924 | 1641.79 | Saugata Konar; Atanu Jana; Kinsuk Das; Sangita Ray; James A. Golen; Arnold L. Rheingold; Susanta Kumar Kar A rare pentanuclear cadmium(II) complex and two new mononuclear zinc(II) complexes of pyrazole derived ditopic ligands - Synthesis, crystal structures and spectral studies Inorganica Chimica Acta, 2013, 397, 144-151 |
| 1513186 | CIF | C104 H92 Co4 N16 O19 | P 1 21/c 1 | 27.993; 10.587; 33.716 90; 107.199; 90 | 9545 | Xiu-Li Wang; Li-Li Hou; Ju-Wen Zhang; Guo-Cheng Liu; Bao Mu; Hong-Yan Lin Two different dimensional bbbm-based cobalt(II) coordination polymers tuned by benzenedicarboxylates: Assembly, structures and properties Inorganica Chimica Acta, 2013, 397, 89-93 |
| 1513187 | CIF | C26 H22 Co N4 O4 | C 1 2/c 1 | 16.225; 18.445; 16.083 90; 108.718; 90 | 4559 | Xiu-Li Wang; Li-Li Hou; Ju-Wen Zhang; Guo-Cheng Liu; Bao Mu; Hong-Yan Lin Two different dimensional bbbm-based cobalt(II) coordination polymers tuned by benzenedicarboxylates: Assembly, structures and properties Inorganica Chimica Acta, 2013, 397, 89-93 |
| 1513188 | CIF | C22 H32 Cu2 N6 O14 | C 1 2/c 1 | 20.619; 12.2601; 16.954 90; 134.5; 90 | 3056.9 | Soledad Betanzos-Lara; Isabel Gracia-Mora; Pilar Granada-Macias; Marcos Flores-Alamo; Norah Barba-Behrens Synthesis, characterization, and biological activity of cobalt(II), nickel(II), copper(II), and zinc(II) complexes of secnidazole Inorganica Chimica Acta, 2013, 397, 94-100 |
| 1513189 | CIF | C20 H12 F N6 Pt S4 | P -1 | 11.8501; 13.8162; 16.364 71.002; 69.183; 68.885 | 2275.4 | Wen-Bo Pei; Jian-Sheng Wu; Wei-Hua Ning; Zheng-Fang Tian; Jian-Lan Liu; Xiao-Ming Ren One-dimensional metal-bis-dithiolene compounds with diverse ion-pair arrangements, various magnetic properties and intense near-infrared absorption Inorganica Chimica Acta, 2013, 398, 28-39 |
| 1513190 | CIF | C20 H12 Br N6 Pt S4 | P 1 21/c 1 | 7.4383; 26.45; 12.688 90; 105.54; 90 | 2405 | Wen-Bo Pei; Jian-Sheng Wu; Wei-Hua Ning; Zheng-Fang Tian; Jian-Lan Liu; Xiao-Ming Ren One-dimensional metal-bis-dithiolene compounds with diverse ion-pair arrangements, various magnetic properties and intense near-infrared absorption Inorganica Chimica Acta, 2013, 398, 28-39 |
| 1513191 | CIF | C20 H12 I N6 Pt S4 | P 1 21/c 1 | 7.6015; 26.647; 12.5645 90; 104.974; 90 | 2458.6 | Wen-Bo Pei; Jian-Sheng Wu; Wei-Hua Ning; Zheng-Fang Tian; Jian-Lan Liu; Xiao-Ming Ren One-dimensional metal-bis-dithiolene compounds with diverse ion-pair arrangements, various magnetic properties and intense near-infrared absorption Inorganica Chimica Acta, 2013, 398, 28-39 |
| 1513192 | CIF | C21 H12 F3 N6 Pt S4 | P -1 | 7.5936; 11.6602; 14.6201 69.291; 84.595; 88.04 | 1205.48 | Wen-Bo Pei; Jian-Sheng Wu; Wei-Hua Ning; Zheng-Fang Tian; Jian-Lan Liu; Xiao-Ming Ren One-dimensional metal-bis-dithiolene compounds with diverse ion-pair arrangements, various magnetic properties and intense near-infrared absorption Inorganica Chimica Acta, 2013, 398, 28-39 |
| 1513193 | CIF | C21 H12 F3 N6 Ni S4 | P -1 | 7.605; 11.701; 14.586 68.276; 84.803; 88.484 | 1200.8 | Wen-Bo Pei; Jian-Sheng Wu; Wei-Hua Ning; Zheng-Fang Tian; Jian-Lan Liu; Xiao-Ming Ren One-dimensional metal-bis-dithiolene compounds with diverse ion-pair arrangements, various magnetic properties and intense near-infrared absorption Inorganica Chimica Acta, 2013, 398, 28-39 |
| 1513194 | CIF | C16 H12 Co N8 | P -1 | 7.093; 7.2931; 9.3585 78.721; 69.955; 65.168 | 411.983 | Sumitava Khan; Subhasis Roy; Kishalay Bhar; Rajarshi Ghosh; Chia-Her Lin; Joan Ribas; Barindra Kumar Ghosh Syntheses, structures and magnetic properties of two neutral coordination polymers of cobalt(II) containing a tailored aromatic diamine and pseudohalides as bridging units: Control of dimensionality by varying pseudohalide Inorganica Chimica Acta, 2013, 398, 40-45 |
| 1513195 | CIF | C12 H12 Co N8 | P 1 21/c 1 | 12.004; 5.4438; 10.4886 90; 111.489; 90 | 637.76 | Sumitava Khan; Subhasis Roy; Kishalay Bhar; Rajarshi Ghosh; Chia-Her Lin; Joan Ribas; Barindra Kumar Ghosh Syntheses, structures and magnetic properties of two neutral coordination polymers of cobalt(II) containing a tailored aromatic diamine and pseudohalides as bridging units: Control of dimensionality by varying pseudohalide Inorganica Chimica Acta, 2013, 398, 40-45 |
| 1513196 | CIF | C41 H32 Cl Fe N O3 P2 Pd S | P 21 21 21 | 10.4176; 16.197; 21.507 90; 90; 90 | 3629 | Subhi A. Al-Jibori; Amina I.A. Al-Nassiry; Graeme Hogarth; Luca Salassa Platinum and palladium bis(diphenylphosphino)ferrocene (dppf) complexes with heterocyclic N-acetamide ligands: Synthesis and molecular structures of [MCl(sac)(k2-dppf)] (M = Pt, Pd, sac = saccharinate), [PtCl(ata)(k2-dppf)] and [Pt(ata)2(k2-dppf)] (ataH = N-(2-thiazolyl)acetamide Inorganica Chimica Acta, 2013, 398, 46-53 |
| 1513197 | CIF | C41 H32 Cl Fe N O3 P2 Pt S | P 21 21 21 | 10.422; 16.2327; 21.504 90; 90; 90 | 3638 | Subhi A. Al-Jibori; Amina I.A. Al-Nassiry; Graeme Hogarth; Luca Salassa Platinum and palladium bis(diphenylphosphino)ferrocene (dppf) complexes with heterocyclic N-acetamide ligands: Synthesis and molecular structures of [MCl(sac)(k2-dppf)] (M = Pt, Pd, sac = saccharinate), [PtCl(ata)(k2-dppf)] and [Pt(ata)2(k2-dppf)] (ataH = N-(2-thiazolyl)acetamide Inorganica Chimica Acta, 2013, 398, 46-53 |
| 1513198 | CIF | C39 H33 Cl Fe N2 O P2 Pt S | P -1 | 10.3891; 10.5578; 17.298 77.669; 85.18; 69.84 | 1739.9 | Subhi A. Al-Jibori; Amina I.A. Al-Nassiry; Graeme Hogarth; Luca Salassa Platinum and palladium bis(diphenylphosphino)ferrocene (dppf) complexes with heterocyclic N-acetamide ligands: Synthesis and molecular structures of [MCl(sac)(k2-dppf)] (M = Pt, Pd, sac = saccharinate), [PtCl(ata)(k2-dppf)] and [Pt(ata)2(k2-dppf)] (ataH = N-(2-thiazolyl)acetamide Inorganica Chimica Acta, 2013, 398, 46-53 |
| 1513199 | CIF | C44 H38 Fe N4 O2 P2 Pt S2 | P 1 21 1 | 12.422; 23.007; 17.388 90; 100.469; 90 | 4886.6 | Subhi A. Al-Jibori; Amina I.A. Al-Nassiry; Graeme Hogarth; Luca Salassa Platinum and palladium bis(diphenylphosphino)ferrocene (dppf) complexes with heterocyclic N-acetamide ligands: Synthesis and molecular structures of [MCl(sac)(k2-dppf)] (M = Pt, Pd, sac = saccharinate), [PtCl(ata)(k2-dppf)] and [Pt(ata)2(k2-dppf)] (ataH = N-(2-thiazolyl)acetamide Inorganica Chimica Acta, 2013, 398, 46-53 |
| 1513200 | CIF | C25 H29 Cl P2 Pd | P -1 | 9.2242; 9.4337; 15.2031 89.97; 81.774; 74.289 | 1259.41 | Yong-Joo Kim; Hyun-Kyung Kim; Jung-Hyun Lee; Zhen Nu Zheng; Soon W. Lee Synthesis and structures of n1-allenyl and/or -propargyl Pd(II) complexes and their reactivity toward trimethylsilyl pseudohalides, organic thiols, and N-heterocyclic carbene ligands Inorganica Chimica Acta, 2013, 398, 54-63 |
| 1513201 | CIF | C21 H37 Cl P2 Pd | P 1 21/c 1 | 12.1748; 14.5911; 14.2045 90; 100.889; 90 | 2477.91 | Yong-Joo Kim; Hyun-Kyung Kim; Jung-Hyun Lee; Zhen Nu Zheng; Soon W. Lee Synthesis and structures of n1-allenyl and/or -propargyl Pd(II) complexes and their reactivity toward trimethylsilyl pseudohalides, organic thiols, and N-heterocyclic carbene ligands Inorganica Chimica Acta, 2013, 398, 54-63 |
| 1513202 | CIF | C10 H21 N P2 Pd S | P 1 21/c 1 | 8.6682; 9.8587; 18.9137 90; 95.411; 90 | 1609.11 | Yong-Joo Kim; Hyun-Kyung Kim; Jung-Hyun Lee; Zhen Nu Zheng; Soon W. Lee Synthesis and structures of n1-allenyl and/or -propargyl Pd(II) complexes and their reactivity toward trimethylsilyl pseudohalides, organic thiols, and N-heterocyclic carbene ligands Inorganica Chimica Acta, 2013, 398, 54-63 |
| 1513203 | CIF | C12 H23 Cl P2 Pd S | P 1 21/c 1 | 14.0682; 11.0519; 11.8852 90; 107.039; 90 | 1766.8 | Yong-Joo Kim; Hyun-Kyung Kim; Jung-Hyun Lee; Zhen Nu Zheng; Soon W. Lee Synthesis and structures of n1-allenyl and/or -propargyl Pd(II) complexes and their reactivity toward trimethylsilyl pseudohalides, organic thiols, and N-heterocyclic carbene ligands Inorganica Chimica Acta, 2013, 398, 54-63 |
| 1513204 | CIF | C39 H52 Cl N2 P Pd | P 1 21/n 1 | 12.7346; 15.8979; 19.299 90; 98.601; 90 | 3863.21 | Yong-Joo Kim; Hyun-Kyung Kim; Jung-Hyun Lee; Zhen Nu Zheng; Soon W. Lee Synthesis and structures of n1-allenyl and/or -propargyl Pd(II) complexes and their reactivity toward trimethylsilyl pseudohalides, organic thiols, and N-heterocyclic carbene ligands Inorganica Chimica Acta, 2013, 398, 54-63 |
| 1513205 | CIF | C21 H15 N O | P 1 21/n 1 | 10.393; 5.8516; 11.833 90; 99.555; 90 | 709.6 | Animesh Sahana; Arnab Banerjee; Sisir Lohar; Sudipta Das; Ipsit Hauli; Subhra Kanti Mukhopadhyay; Jesus Sanmartin Matalobos; Debasis Das Naphthalene based highly selective OFF-ON-OFF type fluorescent probe for Al3+ and NO2- ions for living cell imaging at physiological pH Inorganica Chimica Acta, 2013, 398, 64-71 |
| 1513206 | CIF | C41 H45 N2 O9 P Ru | P 21 21 21 | 12.091; 12.663; 24.743 90; 90; 90 | 3788 | Soumik Mandal; Santanu Mandal; Dipravath K. Seth; Balaram Mukhopadhyay; Parna Gupta Ruthenium and osmium complexes of novel carbohydrate derived salen ligands: Synthesis, characterization and in situ ligand reduction Inorganica Chimica Acta, 2013, 398, 83-88 |
| 1513207 | CIF | C47 H45 N2 O6 Os P | P 21 21 21 | 13.595; 16.977; 19.141 90; 90; 90 | 4418 | Soumik Mandal; Santanu Mandal; Dipravath K. Seth; Balaram Mukhopadhyay; Parna Gupta Ruthenium and osmium complexes of novel carbohydrate derived salen ligands: Synthesis, characterization and in situ ligand reduction Inorganica Chimica Acta, 2013, 398, 83-88 |
| 1513208 | CIF | C2 H16 N10 Ni O2 | P 1 21/n 1 | 8.0122; 7.3011; 8.5625 90; 110.03; 90 | 470.59 | Vinod P. Singh; Monika Mishra; Karishma Tiwari Structural investigations on bis-(semicarbazido)dihydrazine nickel(II) complex synthesized by using uracil and hydrazine hydrate Inorganica Chimica Acta, 2013, 398, 89-97 |
| 1513209 | CIF HKL | H3 Na5 O19 S4 U | P -1 | 5.3232; 11.5105; 13.5562 102.864; 97.414; 91.461 | 801.743 | J. Plášil; A. R. Kampf; A. V. Kasatkin; J. Marty; R. Škoda; S. Silva; J. Čejka Meisserite, Na5(UO2)(SO4)3(SO3OH)(H2O), a new uranyl sulfate mineral from the Blue Lizard mine, San Juan County, Utah, USA Mineralogical Magazine, 2013, 77, 2975-2988 |
| 1513214 | CIF | C20 H26 B10 Cu2 N4 | C 1 c 1 | 15.5479; 10.6631; 14.845 90; 101.674; 90 | 2410.2 | Vologzhanina, Anna V.; Korlyukov, Alexander A.; Avdeeva, Varvara V.; Polyakova, Irina N.; Malinina, Elena A.; Kuznetsov, Nikolai T. Theoretical QTAIM, ELI-D, and Hirshfeld Surface Analysis of the Cu-(H)B Interaction in [Cu2(bipy)2B10H10]. The journal of physical chemistry. A, 2013, 117, 13138-13150 |
| 1513215 | CIF | C34 H26 F12 N6 P2 Ru | P -1 | 10.2377; 11.7776; 15.0852 98.004; 99.653; 97.468 | 1753.65 | Albani, Bryan A.; Durr, Christopher B.; Turro, Claudia Selective Photoinduced Ligand Exchange in a New Tris-Heteroleptic Ru(II) Complex. The journal of physical chemistry. A, 2013, 117, 13885-13892 |
| 1513216 | CIF | C41.55 H38.36 F12 N6 O P2 Ru | P -1 | 9.9878; 11.866; 18.5529 98.583; 92.11; 99.059 | 2142.96 | Albani, Bryan A.; Durr, Christopher B.; Turro, Claudia Selective Photoinduced Ligand Exchange in a New Tris-Heteroleptic Ru(II) Complex. The journal of physical chemistry. A, 2013, 117, 13885-13892 |
| 1513217 | CIF | C15 H14 Br F3 O3 S2 | P 1 21/n 1 | 11.7897; 10.584; 13.6153 90; 97.989; 90 | 1682.46 | Ahmed, Maqsood; Yar, Muhammad; Nassour, Ayoub; Guillot, Benoit; Lecomte, Claude; Jelsch, Christian Experimental and theoretical charge density analysis of a bromoethyl sulfonium salt. The journal of physical chemistry. A, 2013, 117, 14267-14275 |
| 1513218 | CIF | C26 H38 O12 | P 21 21 21 | 11.2384; 12.0287; 19.6185 90; 90; 90 | 2652.09 | Zheng, Yong; Zhang, Shu-Wei; Cong, Hai-Jian; Huang, Yu-Jie; Xuan, Li-Jiang Caesalminaxins A‒L, Cassane Diterpenoids from the Seeds ofCaesalpinia minax Journal of Natural Products, 2013, 76, 2210 |
| 1513219 | CIF | C28 H40 O11 | P 21 21 21 | 11.6397; 11.7388; 19.9846 90; 90; 90 | 2730.62 | Zheng, Yong; Zhang, Shu-Wei; Cong, Hai-Jian; Huang, Yu-Jie; Xuan, Li-Jiang Caesalminaxins A‒L, Cassane Diterpenoids from the Seeds ofCaesalpinia minax Journal of Natural Products, 2013, 76, 2210 |
| 1513220 | CIF | C26 H38 O12 | P 21 21 21 | 11.3438; 14.0817; 16.2703 90; 90; 90 | 2599 | Zheng, Yong; Zhang, Shu-Wei; Cong, Hai-Jian; Huang, Yu-Jie; Xuan, Li-Jiang Caesalminaxins A‒L, Cassane Diterpenoids from the Seeds ofCaesalpinia minax Journal of Natural Products, 2013, 76, 2210 |
| 1513221 | CIF | C29 H44 O11 | P 21 21 21 | 11.3539; 11.8861; 21.7292 90; 90; 90 | 2932.43 | Zheng, Yong; Zhang, Shu-Wei; Cong, Hai-Jian; Huang, Yu-Jie; Xuan, Li-Jiang Caesalminaxins A‒L, Cassane Diterpenoids from the Seeds ofCaesalpinia minax Journal of Natural Products, 2013, 76, 2210 |
| 1513222 | CIF | C29 H44 O11 | C 1 2 1 | 20.3979; 9.6961; 16.0481 90; 99.429; 90 | 3131.11 | Zheng, Yong; Zhang, Shu-Wei; Cong, Hai-Jian; Huang, Yu-Jie; Xuan, Li-Jiang Caesalminaxins A‒L, Cassane Diterpenoids from the Seeds ofCaesalpinia minax Journal of Natural Products, 2013, 76, 2210 |
| 1513223 | CIF | C22 H36 O8 | P 1 21 1 | 8.5553; 7.058; 18.5846 90; 94.668; 90 | 1118.48 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513224 | CIF | C23 H38 O8 | P 21 21 21 | 8.4307; 11.7779; 23.1333 90; 90; 90 | 2297.04 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513225 | CIF | C22 H32 O7 | P 21 21 21 | 7.5784; 10.6565; 26.4145 90; 90; 90 | 2133.21 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513226 | CIF | C20 H28 O5 | P 2 21 21 | 6.506; 13.7; 20.624 90; 90; 90 | 1838.26 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513227 | CIF | C22 H32 O7 | P 21 21 21 | 7.5766; 10.629; 26.1402 90; 90; 90 | 2105.11 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513228 | CIF | C23 H34 O7 | P 21 21 21 | 6.7118; 13.4388; 23.6639 90; 90; 90 | 2134.45 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513229 | CIF | C24 H36 O7 | P 1 21 1 | 12.0609; 6.8263; 29.7481 90; 98.082; 90 | 2424.87 | Zheng, Heng; Chen, Qiong; Zhang, Mengke; Lai, Yongji; Lei, Liang; Shu, Penghua; Zhang, Jinwen; Xue, Yongbo; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui Cytotoxic ent-Kaurane Diterpenoids from Salvia cavaleriei. Journal of natural products, 2013, 76, 2253-2262 |
| 1513230 | CIF | C33 H33 N O2 Si | P 1 21 1 | 7.9327; 11.455; 14.741 90; 91.991; 90 | 1338.7 | Clark, Robert W.; Deaton, T. Maxwell; Zhang, Yan; Moore, Maggie I.; Wiskur, Sheryl L. Silylation-Based Kinetic Resolution of α-Hydroxy Lactones and Lactams. Organic letters, 2013, 15, 6132-6135 |
| 1513231 | CIF | C29 H30 Br N O5 | P 1 21/n 1 | 10.1046; 10.2534; 27.1451 90; 98.586; 90 | 2780.9 | Ma, Chaoqun; Xing, Dong; Zhai, Changwei; Che, Jiuwei; Liu, Shunying; Wang, Jue; Hu, Wenhao Iron Porphyrin-Catalyzed Three-Component Reaction of Ethyl Diazoacetate with Aliphatic Amines and β,γ-Unsaturated α-Keto Esters. Organic letters, 2013, 15, 6140-6143 |
| 1513232 | CIF | C13 H10 I N O3 | C 1 2 1 | 20.2766; 11.0112; 13.5295 90; 123.314; 90 | 2524.3 | Murata, Yusuke; Takahashi, Masaki; Yagishita, Fumitoshi; Sakamoto, Masami; Sengoku, Tetsuya; Yoda, Hidemi Construction of Spiro-Fused 2-Oxindole/α-Methylene- γ-Butyrolactone Systems with Extremely High Enantioselectivity via Indium-Catalyzed Amide Allylation of N-Methyl Isatin. Organic letters, 2013, 15, 6182-6185 |
| 1513233 | CIF | C13 H10 N2 O3 | P 1 21/n 1 | 4.5247; 28.9366; 9.1022 90; 99.297; 90 | 1176.09 | Haas, Diana; Mosrin, Marc; Knochel, Paul Regioselective Functionalization of the Oxazole Scaffold Using TMP-Bases of Mg and Zn. Organic letters, 2013, 15, 6162-6165 |
| 1513234 | CIF | C28 H25 N O3 S | P 1 21 1 | 11.138; 7.0903; 14.392 90; 95.354; 90 | 1131.6 | Ma, Chao; Gu, Jing; Teng, Bin; Zhou, Qing-Qing; Li, Rui; Chen, Ying-Chun 1-azadienes as regio- and chemoselective dienophiles in aminocatalytic asymmetric diels-alder reaction. Organic letters, 2013, 15, 6206-6209 |
| 1513235 | CIF | C21 H26 F3 N O11 | P 1 21 1 | 7.3343; 20.6369; 7.8664 90; 104.127; 90 | 1154.63 | Malik, Michał; Witkowski, Grzegorz; Ceborska, Magdalena; Jarosz, Sławomir Synthesis of Polyhydroxylated Quinolizidines and Azaspiro[4.5]decanes from d-Xylose. Organic letters, 2013, 15, 6214-6217 |
| 1513236 | CIF | C16 H12 F3 N O2 S | P 1 21/c 1 | 8.891; 16.505; 10.648 90; 101.244; 90 | 1532.6 | Sun, Xiaoqian; Lyu, Youran; Zhang-Negrerie, Daisy; Du, Yunfei; Zhao, Kang Formation of Functionalized 2H-Azirines through PhIO-Mediated Trifluoroethoxylation and Azirination of Enamines. Organic letters, 2013, 15, 6222-6225 |
| 1513237 | CIF | C29 H26 | P -1 | 6.2651; 11.9132; 14.2495 92.588; 94.143; 97.956 | 1048.92 | Sinu, C. R.; Suresh, Eringathodi; Nair, Vijay N-heterocyclic carbene catalyzed reaction of cinnamils leading to the formation of 2,3,8-triaryl vinyl fulvenes: an uncommon transformation. Organic letters, 2013, 15, 6230-6233 |
| 1513238 | CIF | C26 H17 Cl3 | P -1 | 11.5918; 11.6391; 16.613 98.401; 104.892; 91.752 | 2137.4 | Sinu, C. R.; Suresh, Eringathodi; Nair, Vijay N-heterocyclic carbene catalyzed reaction of cinnamils leading to the formation of 2,3,8-triaryl vinyl fulvenes: an uncommon transformation. Organic letters, 2013, 15, 6230-6233 |
| 1513239 | CIF | C54 H46 B2 S | P 1 21 1 | 14.544; 26.44; 25.33 90; 93.68; 90 | 9720 | Shuto, Ayumi; Kushida, Tomokatsu; Fukushima, Tatsuya; Kaji, Hironori; Yamaguchi, Shigehiro π-Extended Planarized Triphenylboranes with Thiophene Spacers. Organic letters, 2013, 15, 6234-6237 |
| 1513240 | CIF | C58 H48 B2 S2 | P 1 21/c 1 | 15.74; 8.443; 16.49 90; 101.67; 90 | 2146 | Shuto, Ayumi; Kushida, Tomokatsu; Fukushima, Tatsuya; Kaji, Hironori; Yamaguchi, Shigehiro π-Extended Planarized Triphenylboranes with Thiophene Spacers. Organic letters, 2013, 15, 6234-6237 |
| 1513241 | CIF | C24 H44 O3 Si | P 21 21 2 | 14.8863; 25.4284; 6.6202 90; 90; 90 | 2505.98 | Ravindar, Kontham; Caron, Pierre-Yves; Deslongchamps, Pierre Total synthesis of (+)-cassaine utilizing an anionic polycyclization strategy. Organic letters, 2013, 15, 6270-6273 |
| 1513242 | CIF | C18 H15 F3 O2 S2 | P -1 | 7.6211; 9.961; 12.646 102.593; 106.1; 96.22 | 885.5 | Liu, Xiao; Pan, Ling; Dong, Jinhuan; Xu, Xianxiu; Zhang, Qian; Liu, Qun 1,3-Carbothiolation of 4-(Trifluoromethyl)-p-Quinols: A New Access to Functionalized (Trifluoromethyl)arenes. Organic letters, 2013, 15, 6242-6245 |
| 1513243 | CIF | C16 H13 F3 O S | P 1 21/n 1 | 9.275; 5.21; 30.144 90; 92.211; 90 | 1455.56 | Liu, Xiao; Pan, Ling; Dong, Jinhuan; Xu, Xianxiu; Zhang, Qian; Liu, Qun 1,3-Carbothiolation of 4-(Trifluoromethyl)-p-Quinols: A New Access to Functionalized (Trifluoromethyl)arenes. Organic letters, 2013, 15, 6242-6245 |
| 1513244 | CIF | C28 H31 Br O5 | P 1 21 1 | 11.248; 10.106; 11.44 90; 104.724; 90 | 1257.7 | Hong, Bor-Cherng; Lin, Cheng-Wei; Liao, Wei-Kai; Lee, Gene-Hsiang Sequential asymmetric catalysis in Michael-Michael-Michael-aldol reactions: merging organocatalysis with photoredox catalysis in a one-pot enantioselective synthesis of highly functionalized decalines bearing a quaternary carbon stereocenter. Organic letters, 2013, 15, 6258-6261 |
| 1513245 | CIF | C11 H14 O2 | P b c n | 44.087; 7.0736; 6.2427 90; 90; 90 | 1946.8 | Cornella, Josep; Martin, Ruben Ni-Catalyzed Stereoselective Arylation of Inert C-O bonds at Low Temperatures. Organic letters, 2013, 15, 6298-6301 |
| 1513246 | CIF | C14 H12 O | P 1 21/n 1 | 7.6358; 5.6352; 11.9802 90; 101.788; 90 | 504.63 | Cornella, Josep; Martin, Ruben Ni-Catalyzed Stereoselective Arylation of Inert C-O bonds at Low Temperatures. Organic letters, 2013, 15, 6298-6301 |
| 1513247 | CIF | C19 H16 N2 O3 | P -1 | 6.2622; 10.5075; 12.874 82.787; 80.414; 73.332 | 797.5 | Zhou, Bing; Du, Juanjuan; Yang, Yaxi; Feng, Huijin; Li, Yuanchao Rhodium-catalyzed direct addition of aryl C-h bonds to nitrosobenzenes at room temperature. Organic letters, 2013, 15, 6302-6305 |
| 1513248 | CIF | C12 H12 N2 O | P c a 21 | 14.893; 8.972; 7.742 90; 90; 90 | 1034.5 | Markey, Sophie J.; Lewis, William; Moody, Christopher J. A New Route to α-Carbolines Based on 6π-Electrocyclization of Indole-3-alkenyl Oximes. Organic letters, 2013, 15, 6306-6308 |
| 1513249 | CIF | C13 H10 N2 O2 | P 1 21/c 1 | 16.051; 4.7507; 15.792 90; 119.12; 90 | 1052 | Markey, Sophie J.; Lewis, William; Moody, Christopher J. A New Route to α-Carbolines Based on 6π-Electrocyclization of Indole-3-alkenyl Oximes. Organic letters, 2013, 15, 6306-6308 |
| 1513250 | CIF | C13 H12 N2 O | P 1 21/n 1 | 9.9779; 5.7825; 18.2629 90; 101.762; 90 | 1031.59 | Markey, Sophie J.; Lewis, William; Moody, Christopher J. A New Route to α-Carbolines Based on 6π-Electrocyclization of Indole-3-alkenyl Oximes. Organic letters, 2013, 15, 6306-6308 |
| 1513339 | CIF | C33 H28 N2 O4 | P -1 | 8.441; 10.983; 13.892 90.769; 90.334; 94.472 | 1283.8 | Niu, Dawen; Hoye, Thomas R. The aromatic ene reaction Nature Chemistry, 2013, 6, 34 |
| 1513340 | CIF | C18 H19 N3 O S2 | P 1 21 1 | 6.0514; 30.4883; 9.9339 90; 94.478; 90 | 1827.18 | Kate, Anup N.; Kumbhar, Anupa A.; Khan, Ayesha A.; Joshi, Pranaya V.; Puranik, Vedavati G. Monitoring Cellular Uptake and Cytotoxicity of Copper(II) Complex Using a Fluorescent Anthracene Thiosemicarbazone Ligand. Bioconjugate chemistry, 2013, 25, 102 |
| 1513346 | CIF | C47 H32 Cl2 N4 | P 1 21/n 1 | 9.3295; 21.719; 17.834 90; 98.47; 90 | 3574.2 | Yamaguchi, Tetsuo; Hatano, Sayaka; Abe, Jiro Multistate Photochromism of 1-Phenylnaphthalene-Bridged Imidazole Dimer That Has Three Colorless Isomers and Two Colored Isomers. The journal of physical chemistry. A, 2013, 118, 134 |
| 1513347 | CIF | C48 H33 N5 | P -1 | 9.512; 11.533; 16.99 96.062; 94.541; 104.431 | 1784.1 | Yamaguchi, Tetsuo; Hatano, Sayaka; Abe, Jiro Multistate Photochromism of 1-Phenylnaphthalene-Bridged Imidazole Dimer That Has Three Colorless Isomers and Two Colored Isomers. The journal of physical chemistry. A, 2013, 118, 134 |
| 1513348 | CIF | C46 H30 N4 | P 1 21/n 1 | 10.145; 25.68; 12.867 90; 94.357; 90 | 3342 | Yamaguchi, Tetsuo; Hatano, Sayaka; Abe, Jiro Multistate Photochromism of 1-Phenylnaphthalene-Bridged Imidazole Dimer That Has Three Colorless Isomers and Two Colored Isomers. The journal of physical chemistry. A, 2013, 118, 134 |
| 1513349 | CIF | C46 H30 N4 | P -1 | 9.72; 11.606; 15.241 82.64; 87.985; 75.216 | 1648.7 | Yamaguchi, Tetsuo; Hatano, Sayaka; Abe, Jiro Multistate Photochromism of 1-Phenylnaphthalene-Bridged Imidazole Dimer That Has Three Colorless Isomers and Two Colored Isomers. The journal of physical chemistry. A, 2013, 118, 134 |
| 1513895 | CIF | C34.5 H45 Cl N8 O4 Tb | P -1 | 9.229; 13.79; 14.984 86.64; 72.5; 88.62 | 1816 | Gusev, Alexey N.; Hasegawa, Miki; Shimizu, Tomohito; Fukawa, Tomonori; Sakurai, Shoya; Nishchymenko, Galyna A.; Shul'gin, Victor F.; Meshkova, Svetlana B.; Linert, Wolfgang Synthesis, structure and luminescence studies of Eu(III), Tb(III), Sm(III), Dy(III) cationic complexes with acetylacetone and bis(5-(pyridine-2-yl)-1,2,4-triazol-3-yl)propane Inorganica Chimica Acta, 2013, 406, 279-284 |
| 1513896 | CIF | C26 H28 Cu F2 N4 O2 S2 | I 41/a :2 | 19.894; 19.894; 13.562 90; 90; 90 | 5367.4 | Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands Inorganica Chimica Acta, 2013, 405, 387-394 |
| 1513897 | CIF | C26 H28 Cu F2 N4 O2 S2 | P -1 | 8.346; 8.575; 10.271 100.237; 107.28; 106.761 | 643.6 | Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands Inorganica Chimica Acta, 2013, 405, 387-394 |
| 1513898 | CIF | C34 H30 Cu2 F4 N2 O10 | P 1 21/n 1 | 10.575; 10.434; 16.122 90; 93.338; 90 | 1775.9 | Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands Inorganica Chimica Acta, 2013, 405, 387-394 |
| 1514235 | CIF | Mn2 O3 | R -3 :H | 10.3043; 10.3043; 25.7688 90; 90; 120 | 2369.53 | Ovsyannikov, Sergey V.; Abakumov, Artem M.; Tsirlin, Alexander A.; Schnelle, Walter; Egoavil, Ricardo; Verbeeck, Jo; Van Tendeloo, Gustaaf; Glazyrin, Konstantin V.; Hanfland, Michael; Dubrovinsky, Leonid Perovskite-like Mn2 O3: a path to new manganites Angewandte Chemie. International Edition, 2013, 52, 1494-1498 |
| 1514367 | CIF | C37 H38 Cl2 N4 O3 | P 1 21/c 1 | 13.066; 9.757; 29.525 90; 116; 90 | 3383 | Men, Guangwen; Zhang, Guirong; Liang, Chunshuang; Liu, Huiling; Yang, Bing; Pan, Yuyu; Wang, Zhenyu; Jiang, Shimei A dual channel optical detector for trace water chemodosimetry and imaging of live cells. The Analyst, 2013, 138, 2847-2857 |
| 1514368 | CIF | C51 H48 O6 Si2 | P 1 21/c 1 | 16.849; 17.6362; 15.7254 90; 114.22; 90 | 4261.5 | Ghosh, Kumaresh; Kar, Debasis; Fröhlich, Roland; Chattopadhyay, Asoke P.; Samadder, Asmita; Khuda-Bukhsh, Anisur Rahman O-tert-butyldiphenylsilyl coumarin and dicoumarol: a case toward selective sensing of F- ions in organic and aqueous environments. The Analyst, 2013, 138, 3038-3045 |
| 1514369 | CIF | C62 H46 Cl N16 O14 Ru2 | C 1 2/c 1 | 19.9067; 20.3667; 18.4436 90; 117.057; 90 | 6659.3 | Kumar, Anup; Singh, Alok K.; Gupta, Tarkeshwar A stimuli-responsive "smart probe" for selective monitoring of multiple-cations via differential analyses. The Analyst, 2013, 138, 3356-3359 |
| 1514370 | CIF | C39 H31 N3 S2 | P 1 21/c 1 | 19.681; 8.3397; 21.489 90; 110.841; 90 | 3296.3 | Jin, Jiayu; Zhang, Junji; Zou, Lei; Tian, He Near-infrared photochromic behavior in a donor-acceptor type diarylethene modulated by the cyanide anion. The Analyst, 2013, 138, 1641-1644 |
| 1514371 | CIF | C29 H27 N3 S2 | P 1 21/c 1 | 24.443; 8.3483; 12.521 90; 99.817; 90 | 2517.6 | Jin, Jiayu; Zhang, Junji; Zou, Lei; Tian, He Near-infrared photochromic behavior in a donor-acceptor type diarylethene modulated by the cyanide anion. The Analyst, 2013, 138, 1641-1644 |
| 1514372 | CIF | C23 H27 B F2 N2 O | P 1 21/n 1 | 10.5132; 10.5783; 19.315 90; 97.647; 90 | 2129 | Hecht, Mandy; Kraus, Werner; Rurack, Knut A highly fluorescent pH sensing membrane for the alkaline pH range incorporating a BODIPY dye. The Analyst, 2013, 138, 325-332 |
| 1514373 | CIF | C39 H42 Cl F6 N3 O4 P2 Ru | P -1 | 10.2059; 12.2904; 16.59 88.423; 79.612; 67.58 | 1890.2 | Sharma, Hemant; Guadalupe, Hernández J.; Narayanan, Jayanthi; Hofeld, Herbert; Pandiyan, Thangarasu; Singh, Narinder Pyridyl- and benzimidazole-based ruthenium(iii) complex for selective chloride recognition through fluorescence spectroscopy Analytical Methods, 2013, 5, 3880 |
| 1514378 | CIF | C55 H42 B F22 N P2 Pt | P 1 21/n 1 | 15.6555; 18.868; 18.2423 90; 98.761; 90 | 5325.7 | DeMott, Jessica C.; Bhuvanesh, Nattamai; Ozerov, Oleg V. Frustrated Lewis pair-like splitting of aromatic C‒H bonds and abstraction of halogen atoms by a cationic [(FPNP)Pt]+ species Chemical Science, 2013, 4, 642 |
| 1514379 | CIF | C54 H39 B F23 N P2 Pt | P 1 21/c 1 | 15.495; 18.673; 22.444 90; 125.955; 90 | 5256.7 | DeMott, Jessica C.; Bhuvanesh, Nattamai; Ozerov, Oleg V. Frustrated Lewis pair-like splitting of aromatic C‒H bonds and abstraction of halogen atoms by a cationic [(FPNP)Pt]+ species Chemical Science, 2013, 4, 642 |
| 1514380 | CIF | C25 H35 B11 Cl12 F2 N P2 Pt | P 1 21/c 1 | 19.446; 15.82; 15.256 90; 107.781; 90 | 4469 | DeMott, Jessica C.; Bhuvanesh, Nattamai; Ozerov, Oleg V. Frustrated Lewis pair-like splitting of aromatic C‒H bonds and abstraction of halogen atoms by a cationic [(FPNP)Pt]+ species Chemical Science, 2013, 4, 642 |
| 1514381 | CIF | C30 H22 B F2 N5 | P -1 | 11.9663; 12.5933; 19.2781 76.089; 85.2516; 62.9902 | 2511.2 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514382 | CIF | C30.5 H24 B Cl F2 N4 | C 1 2/c 1 | 33.428; 11.5134; 13.9925 90; 111.419; 90 | 5013.4 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514383 | CIF | C32 H27 B F2 N4 | P -1 | 12.0332; 14.8026; 15.5572 89.0111; 83.545; 72.8575 | 2630.8 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514384 | CIF | C40 H43 B F2 N4 | P -1 | 10.7533; 13.3999; 24.5025 91.7881; 95.0164; 100.258 | 3457 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514385 | CIF | C36 H35 B F2 N4 | P 1 21/n 1 | 15.7903; 11.9086; 15.8933 90; 94.469; 90 | 2979.5 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514386 | CIF | C28.5 H18 B Cl3 F2 N4 | I 1 2/a 1 | 14.0731; 11.5359; 31.2056 90; 93.7226; 90 | 5055.41 | Nawn, Graeme; Oakley, Simon R.; Majewski, Marek B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G. Redox-active, near-infrared dyes based on ‘Nindigo’ (indigo-N,N′-diarylimine) boron chelate complexes Chemical Science, 2013, 4, 612 |
| 1514387 | CIF | C45 H68 Ca Cl2 F3 Fe N4 O15 S4 | P -1 | 14.2376; 14.5557; 16.0245 112.035; 96.1392; 107.982 | 2832.94 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514388 | CIF | C45 H68 Cl2 F3 Fe N4 O15 S4 Sr | P 1 21/c 1 | 8.7949; 28.7099; 22.444 90; 98.6131; 90 | 5603.2 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514389 | CIF | C50 H78 Ba F3 Fe N4 O17 S4 | P -1 | 12.9433; 14.8169; 18.2751 110.991; 91.9057; 105.868 | 3113.7 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514390 | CIF | C46 H70 Cl4 F3 Mn N4 O15 S4 Sr | P -1 | 13.9061; 15.1055; 16.262 68.7445; 75.3429; 74.3805 | 3019.7 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514391 | CIF | C45 H68 Ca Cl2 F3 Ga N4 O15 S4 | P -1 | 14.3885; 14.7196; 15.8403 112.801; 97.8526; 106.385 | 2850.07 | Park, Young Jun; Cook, Sarah A.; Sickerman, Nathaniel S.; Sano, Yohei; Ziller, Joseph W.; Borovik, A. S. Heterobimetallic Complexes with M(III)-(μ-OH)-M(II) Cores (M(III) = Fe, Mn, Ga; M(II) = Ca, Sr, and Ba): Structural, Kinetic, and Redox Properties. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 717-726 |
| 1514392 | CIF | C42 H56 Cl N O5 | P 1 21/c 1 | 11.4992; 24.3436; 15.0944 90; 112.268; 90 | 3910.3 | Huang, Li; Zhao, Wenjun; Staples, Richard J.; Wulff, William D. Multifaceted interception of 2-chloro-2-oxoacetic anhydrides: a catalytic asymmetric synthesis of β-lactams Chemical Science, 2013, 4, 622 |
| 1514393 | CIF | C16 H20 Cl N O | P 21 21 21 | 5.1885; 14.53; 19.501 90; 90; 90 | 1470.2 | Huang, Li; Zhao, Wenjun; Staples, Richard J.; Wulff, William D. Multifaceted interception of 2-chloro-2-oxoacetic anhydrides: a catalytic asymmetric synthesis of β-lactams Chemical Science, 2013, 4, 622 |
| 1514394 | CIF | C24 H18 Cl N O4 | P 21 21 21 | 7.8652; 13.56; 19.207 90; 90; 90 | 2048.5 | Huang, Li; Zhao, Wenjun; Staples, Richard J.; Wulff, William D. Multifaceted interception of 2-chloro-2-oxoacetic anhydrides: a catalytic asymmetric synthesis of β-lactams Chemical Science, 2013, 4, 622 |
| 1514395 | CIF | C51 H33 N7 O20 Zn3 | P -3 1 c | 16.49; 16.49; 14.05 90; 90; 120 | 3308.6 | Park, Hye Jeong; Suh, Myunghyun Paik Enhanced isosteric heat, selectivity, and uptake capacity of CO2 adsorption in a metal-organic framework by impregnated metal ions Chemical Science, 2013, 4, 685 |
| 1514396 | CIF | C84 H90 N2 Pt | P 1 21/c 1 | 19.1854; 19.6691; 24.6274 90; 108.482; 90 | 8814.1 | Lohr, Tracy L.; Piers, Warren E.; Parvez, Masood Arene C‒H bond activation across Pt(ii)‒OH bonds: catalyzed vs. uncatalyzed pathways Chemical Science, 2013, 4, 770 |
| 1514397 | CIF | C102.5 H113 Cl N2 Pt | P -1 | 12.0941; 15.39; 25.2421 101.259; 98.6734; 111.101 | 4171.5 | Lohr, Tracy L.; Piers, Warren E.; Parvez, Masood Arene C‒H bond activation across Pt(ii)‒OH bonds: catalyzed vs. uncatalyzed pathways Chemical Science, 2013, 4, 770 |
| 1514398 | CIF | C75 H81 Cu3 N16 O3 Y | P -1 | 14.2953; 18.3037; 20.8565 75.534; 71.127; 74.087 | 4887.5 | Lionetti, Davide; Day, Michael W.; Agapie, Theodor Metal-Templated Ligand Architectures for Trinuclear Chemistry: Tricopper Complexes and Their O2 Reactivity. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 785-790 |
| 1514399 | CIF | C12 H20 O6 | P 1 21/c 1 | 6.0689; 11.699; 19.4385 90; 98.695; 90 | 1364.3 | Ley, David; Gerbig, Dennis; Schreiner, Peter R. Tunneling control of chemical reactions: C‒H insertion versus H-tunneling in tert-butylhydroxycarbene Chemical Science, 2013, 4, 677 |
| 1514400 | CIF | C48 F40 N4 U | C 1 2/c 1 | 23.5319; 12.9011; 16.0719 90; 106.846; 90 | 4669.8 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514401 | CIF | C48 H20 F20 N4 U | C 1 2/c 1 | 38.651; 12.3736; 19.957 90; 99.992; 90 | 9399.7 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514402 | CIF | C44 H16 F30 N3 O2 U | P -1 | 11.0728; 11.7379; 20.3378 79.419; 80.189; 84.54 | 2554.81 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514403 | CIF | C88.5 H66 F18 N3 O2 P2 U | P -1 | 13.4814; 16.1925; 19.0979 76.559; 87.948; 84.674 | 4036.9 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514404 | CIF | C14 H9 F6 N | P c a 21 | 10.0174; 15.9406; 7.9776 90; 90; 90 | 1273.89 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514405 | CIF | C26 H32 F6 K N O3 | P -1 | 10.8866; 11.9211; 12.8559 111.365; 100.052; 109.196 | 1382.79 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514406 | CIF | C16 H10 F10 K N O | P -1 | 8.4008; 10.5747; 11.1333 77.131; 69.962; 75.663 | 889.84 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514407 | CIF | C66 H42 F25 K N6 U | P 1 21/c 1 | 24.2328; 12.7508; 24.1585 90; 109.123; 90 | 7052.8 | Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J. Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions Chemical Science, 2013, 4, 798 |
| 1514408 | CIF | C34 H18 Ir0.11 N4 O8 Zn2 | P -1 | 14.0368; 15.1189; 15.1242 85.358; 85.555; 86.35 | 3184.2 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514409 | CIF | C26 H8 N10 O8 Rh Zn2 | P 4/m m m | 15.093; 15.093; 9.62 90; 90; 90 | 2191.4 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514410 | CIF | C36 H21 N4 O8 Rh0.15 Zn2 | P -1 | 14.0869; 15.1333; 15.1402 86.517; 87.286; 86.896 | 3213.8 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514411 | CIF | C24 H8 Ir0.29 N6 O8 Zn2 | P 4/m m m | 15.093; 15.093; 9.62 90; 90; 90 | 2191.4 | Dau, Phuong V.; Kim, Min; Cohen, Seth M. Site-selective cyclometalation of a metal‒organic framework Chemical Science, 2013, 4, 601 |
| 1514412 | CIF | C25 H23 P Si | P -1 | 11.2823; 16.8988; 22.9869 81.236; 79.739; 81.615 | 4230.32 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514413 | CIF | C50 H70 Li2 N2 P2 Si4 | C 1 c 1 | 18.8666; 22.2888; 25.4992 90; 100.652; 90 | 10538 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514414 | CIF | C64 H86 Ca N2 P2 Si4 | C 1 2/c 1 | 30.6079; 12.39475; 22.0579 90; 128.948; 90 | 6508.1 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514415 | CIF | C31 H52 N2 P Si4 Y | P 1 21/c 1 | 11.1459; 20.7732; 16.6276 90; 100.782; 90 | 3781.92 | Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science, 2013, 4, 691 |
| 1514416 | CIF | C159 H60 I2 N2 O20 | P -1 | 11.569; 12.623; 20.413 97.57; 102.49; 113.57 | 2587.1 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514417 | CIF | C71 H17 Cl6 N O8 | P -1 | 14.3061; 14.457; 15.4664 76.592; 66.58; 61.681 | 2580.3 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514418 | CIF | C65 H5 N O5 | P 1 2/c 1 | 18.742; 13.442; 18.553 90; 114.4; 90 | 4256.6 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514419 | CIF | C67 H6 Cl6 I N O5 | P -1 | 12.754; 12.843; 14.63 78.32; 82.27; 68.22 | 2174.6 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514420 | CIF | C68 H9 N O7 | P 1 2/c 1 | 19.163; 13.468; 18.553 90; 114.32; 90 | 4363 | Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science, 2013, 4, 814 |
| 1514421 | CIF | C80 H114 N8 O8 S4 Yb2 | P 1 21/n 1 | 11.3252; 14.7748; 24.3057 90; 90.686; 90 | 4066.7 | Kwong, Wai-Lun; Wai-Yin Sun, Raymond; Lok, Chun-Nam; Siu, Fung-Ming; Wong, Suk-Yu; Low, Kam-Hung; Che, Chi-Ming An ytterbium(iii) porphyrin induces endoplasmic reticulum stress and apoptosis in cancer cells: cytotoxicity and transcriptomics studies Chemical Science, 2013, 4, 747 |
| 1514422 | CIF | C36 H40 Co K O4 | P 1 21/c 1 | 15.4085; 20.2602; 21.0264 90; 102.87; 90 | 6399.1 | Gülak, Samet; Stepanek, Ondrej; Malberg, Jennifer; Rad, Babak Rezaei; Kotora, Martin; Wolf, Robert; Jacobi von Wangelin, Axel Highly chemoselective cobalt-catalyzed biaryl coupling reactions Chemical Science, 2013, 4, 776 |
| 1514423 | CIF | C136 Cl16 Dy2 N8 O74 Si2 W20 | P 1 21/n 1 | 15.3062; 47.6192; 15.6327 90; 108.576; 90 | 10800.6 | Suzuki, Kosuke; Sato, Rinta; Mizuno, Noritaka Reversible switching of single-molecule magnet behaviors by transformation of dinuclear dysprosium cores in polyoxometalates Chemical Science, 2013, 4, 596 |
| 1514424 | CIF | C136 Cl16 Gd2 N8 O74 Si2 W20 | P 1 21/n 1 | 15.2981; 47.7123; 15.6288 90; 108.609; 90 | 10811.2 | Suzuki, Kosuke; Sato, Rinta; Mizuno, Noritaka Reversible switching of single-molecule magnet behaviors by transformation of dinuclear dysprosium cores in polyoxometalates Chemical Science, 2013, 4, 596 |
| 1514425 | CIF | C32 H41 Au Cl2 N2 O2 | P 1 21/n 1 | 12.2769; 12.2829; 22.2697 90; 91.868; 90 | 3356.4 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1514426 | CIF | C35 H46 Au Cl2 N3 O | P 1 21/n 1 | 10.2357; 12.3159; 28.5345 90; 96.224; 90 | 3575.91 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1514427 | CIF | C36.25 H47.5 Au Cl F3 N3 O4 S | P 41 | 27.6; 27.6; 21.2131 90; 90; 90 | 16159.3 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1514428 | CIF | C66 H74 F6 N6 O10 P2 | P -1 | 14.9639; 16.2074; 16.6904 68.074; 65.602; 86.227 | 3400.9 | Liu, Li; Liu, Yuanyuan; Liu, Pingying; Wu, Jie; Guan, Yangfan; Hu, Xiaoyu; Lin, Chen; Yang, Yang; Sun, Xiaoqiang; Ma, Jing; Wang, Leyong Phosphine oxide functional group based three-station molecular shuttle Chemical Science, 2013, 4, 1701 |
| 1514429 | CIF | C14 H10 Br N O4 | P 1 21 1 | 11.8419; 6.5568; 20.7441 90; 102.819; 90 | 1570.53 | Lathrop, Stephen P.; Rovis, Tomislav A photoisomerization-coupled asymmetric Stetter reaction: application to the total synthesis of three diastereomers of (-)-cephalimysin A. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 1668 |
| 1514430 | CIF | C66 H111 Cu3 N19 O35 | I 4/m | 30.926; 30.926; 45.103 90; 90; 90 | 43137 | Yan, Yong; Suyetin, Mikhail; Bichoutskaia, Elena; Blake, Alexander J.; Allan, David R.; Barnett, Sarah A.; Schröder, Martin Modulating the packing of [Cu24(isophthalate)24] cuboctahedra in a triazole-containing metal‒organic polyhedral framework Chemical Science, 2013, 4, 1731 |
| 1514431 | CIF | C62 H44 Br4 N8 O7 | P b c a | 19.744; 19.587; 32.31 90; 90; 90 | 12495 | Song, Na Ri; Moon, Jong Hun; Choi, Jiyoung; Jun, Eun Jin; Kim, Youngmee; Kim, Sung-Jin; Lee, Jin Yong; Yoon, Juyoung Cyclic benzobisimidazolium derivative for the selective fluorescent recognition of HSO4−via a combination of C‒H hydrogen bonds and charge interactions Chemical Science, 2013, 4, 1765 |
| 1514432 | CIF | C46 H48 F24 N8 O2 P4 | C 1 2/c 1 | 22.03; 27.145; 10.285 90; 116.38; 90 | 5510 | Song, Na Ri; Moon, Jong Hun; Choi, Jiyoung; Jun, Eun Jin; Kim, Youngmee; Kim, Sung-Jin; Lee, Jin Yong; Yoon, Juyoung Cyclic benzobisimidazolium derivative for the selective fluorescent recognition of HSO4−via a combination of C‒H hydrogen bonds and charge interactions Chemical Science, 2013, 4, 1765 |
| 1514433 | CIF | C11 H16 Co N6 O3 | I 41/a :2 | 17.243; 17.243; 20.157 90; 90; 90 | 5993 | Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L. Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues Chemical Science, 2013, 4, 1746 |
| 1514434 | CIF | C9 H15 Co N5 O3 | I 41/a :2 | 15.7869; 15.7869; 22.328 90; 90; 90 | 5564.7 | Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L. Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues Chemical Science, 2013, 4, 1746 |
| 1514435 | CIF | C10 H14 Co N5 O2.5 | I 41/a :2 | 15.852; 15.852; 22.346 90; 90; 90 | 5615 | Li, Tao; Chen, De-Li; Sullivan, Jeanne E.; Kozlowski, Mark T.; Johnson, J. Karl; Rosi, Nathaniel L. Systematic modulation and enhancement of CO2 : N2 selectivity and water stability in an isoreticular series of bio-MOF-11 analogues Chemical Science, 2013, 4, 1746 |
| 1514436 | CIF | C37 H58 Mg N2 O | P -1 | 9.1792; 12.119; 15.8077 85.527; 77.912; 87.404 | 1713.51 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514437 | CIF | C38 H59 Mg N3 | P 1 21/n 1 | 9.0121; 20.1333; 19.8758 90; 91.504; 90 | 3605.09 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514438 | CIF | C40 H53 Mg N3 O2 | R 3 m :H | 32.394; 32.394; 11.017 90; 90; 120 | 10012 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514439 | CIF | C78 H104 Mg2 N6 S2 | P 1 21/n 1 | 13.5757; 14.4034; 18.932 90; 92.2137; 90 | 3699.1 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514440 | CIF | C48 H60 Mg N4 O1.25 S2 | P 1 21/n 1 | 18.964; 12.505; 38.624 90; 96.385; 90 | 9103 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514441 | CIF | C80 H110 Mg2 N8 | P 1 21/n 1 | 12.703; 21.654; 13.282 90; 90.01; 90 | 3653.5 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514442 | CIF | C42.5 H61.5 Mg N4 | P 1 21/n 1 | 14.0179; 13.5976; 21.7756 90; 96.842; 90 | 4121.08 | Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases Chemical Science, 2013, 4, 1895 |
| 1514443 | CIF | C72 H43 N6 Ni3 O13 | R -3 c :H | 29.36; 29.36; 20.776 90; 90; 120 | 15510 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514444 | CIF | C72 H43 N6 Ni3 O13 | R -3 c :H | 29.87; 29.87; 12.0337 90; 90; 120 | 9298 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514445 | CIF | C72 H43 N6 Ni3 O13 | R -3 c :H | 29.884; 29.884; 11.8868 90; 90; 120 | 9193 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514446 | CIF | C82 H83 N6 Ni3 O23 | R -3 c :H | 29.347; 29.347; 21.287 90; 90; 120 | 15877 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514447 | CIF | C90 H115 N6 Ni3 O31 | R -3 c :H | 29.368; 29.368; 20.868 90; 90; 120 | 15586.9 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514448 | CIF | C108 H127 N18 Ni3 O25 | R -3 c :H | 29.05; 29.05; 24.502 90; 90; 120 | 17907 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514449 | CIF | C108 H127 N18 Ni3 O25 | R -3 c :H | 29.106; 29.106; 23.417 90; 90; 120 | 17180 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514450 | CIF | C108 H127 N18 Ni3 O25 | R -3 c :H | 29.151; 29.151; 23.07 90; 90; 120 | 16978 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514451 | CIF | C109.5 H80.5 N13.5 Ni3 O13 | R -3 c :H | 28.548; 28.548; 26.592 90; 90; 120 | 18769 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514452 | CIF | C57 H34 Co3 N3 O13 | R -3 c :H | 19.4312; 19.4312; 45.631 90; 90; 120 | 14920.7 | Wei, Yong-Sheng; Chen, Kai-Jie; Liao, Pei-Qin; Zhu, Bao-Yong; Lin, Rui-Biao; Zhou, Hao-Long; Wang, Bao-Ying; Xue, Wei; Zhang, Jie-Peng; Chen, Xiao-Ming Turning on the flexibility of isoreticular porous coordination frameworks for drastically tunable framework breathing and thermal expansion Chemical Science, 2013, 4, 1539 |
| 1514453 | CIF | C29 H30 O3 Si | P c a 21 | 25.2196; 11.8584; 8.5478 90; 90; 90 | 2556.34 | Zhao, Jinbo; Liu, Shasha; Marino, Nadia; Clark, Daniel A. Regio- and stereoselective trans-silylvinylation of internal alkynes catalyzed by RuHCl(CO)(PCy3)2 Chemical Science, 2013, 4, 1547 |
| 1514454 | CIF | C18 H32 Cl3 Gd N4 O10 | P -1 | 8.8714; 11.147; 14.5317 102.922; 93.887; 91.677 | 1395.96 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514455 | CIF | C19 H24 Er N7 O14 | P 1 21/c 1 | 13.0075; 14.8207; 13.9166 90; 102.653; 90 | 2617.7 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514456 | CIF | C9 H12 N5 O12 Y | P -1 | 7.4349; 10.63; 11.657 68.02; 88.31; 87.44 | 853.4 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514457 | CIF | C18 H32 Cl3 N4 O10 Tb | P -1 | 8.849; 11.157; 14.564 103.13; 93.56; 91.72 | 1396.1 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514458 | CIF | C18 H32 Cl3 Dy N4 O10 | P -1 | 8.846; 11.148; 14.527 102.85; 93.52; 91.86 | 1392.5 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514459 | CIF | C18 H32 Cl3 Ho N4 O10 | P -1 | 8.87; 11.12; 14.439 102.36; 93.95; 91.96 | 1386.1 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514460 | CIF | C18 H32 Cl3 Er N4 O10 | P -1 | 8.8067; 11.1745; 14.5412 103.075; 93.297; 91.942 | 1389.98 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514461 | CIF | C18 H32 Cl3 N4 O10 Y | P -1 | 8.819; 11.149; 14.491 102.91; 93.47; 91.88 | 1384.7 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514462 | CIF | C19 H24 N7 O14 Tb | P 1 21/c 1 | 13.0909; 14.851; 13.916 90; 102.875; 90 | 2637.4 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514463 | CIF | C19 H24 Dy N7 O14 | P 1 21/c 1 | 13.09; 14.792; 13.965 90; 102.88; 90 | 2636 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514464 | CIF | C19 H24 Ho N7 O14 | P 1 21/c 1 | 13.0407; 14.8401; 13.9335 90; 102.721; 90 | 2630.3 | Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Soncini, Alessandro; Batten, Stuart R.; Murray, Keith S. Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry Chemical Science, 2013, 4, 1719 |
| 1514465 | CIF | C10 H24 Br2 Ni P2 | P 1 21/c 1 | 8.707; 13.3165; 13.7802 90; 100.665; 90 | 1570.17 | Bryan, Zachary J.; McNeil, Anne J. Evidence for a preferential intramolecular oxidative addition in Ni-catalyzed cross-coupling reactions and their impact on chain-growth polymerizations Chemical Science, 2013, 4, 1620 |
| 1514466 | CIF | C22 H24 Cl2 N2 O Os S | P 1 21/c 1 | 14.4797; 11.9305; 13.1126 90; 98.591; 90 | 2239.8 | Meier, Samuel M.; Hanif, Muhammad; Adhireksan, Zenita; Pichler, Verena; Novak, Maria; Jirkovsky, Elisabeth; Jakupec, Michael A.; Arion, Vladimir B.; Davey, Curt A.; Keppler, Bernhard K.; Hartinger, Christian G. Novel metal(ii) arene 2-pyridinecarbothioamides: a rationale to orally active organometallic anticancer agents Chemical Science, 2013, 4, 1837 |
| 1514467 | CIF | C25 H29 Cl2 F N2 O Ru S | P 1 21/n 1 | 14.0346; 8.6278; 22.7026 90; 90.353; 90 | 2749 | Meier, Samuel M.; Hanif, Muhammad; Adhireksan, Zenita; Pichler, Verena; Novak, Maria; Jirkovsky, Elisabeth; Jakupec, Michael A.; Arion, Vladimir B.; Davey, Curt A.; Keppler, Bernhard K.; Hartinger, Christian G. Novel metal(ii) arene 2-pyridinecarbothioamides: a rationale to orally active organometallic anticancer agents Chemical Science, 2013, 4, 1837 |
| 1514468 | CIF | C108 H116 Br6 Co4 N11 O16 | P 21 21 21 | 12.6611; 19.0777; 47.5848 90; 90; 90 | 11493.8 | Zhu, Yuan-Yuan; Cui, Chang; Zhang, Yi-Quan; Jia, Jun-Hua; Guo, Xiao; Gao, Chen; Qian, Kang; Jiang, Shang-Da; Wang, Bing-Wu; Wang, Zhe-Ming; Gao, Song Zero-field slow magnetic relaxation from single Co(ii) ion: a transition metal single-molecule magnet with high anisotropy barrier Chemical Science, 2013, 4, 1802 |
| 1514469 | CIF | C132 H136 B8 Cl28 Fe4 N32 O36 Re4 | P -1 | 16.163; 20.152; 20.252 93.07; 90.55; 110.44 | 6169 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514470 | CIF | C42 H48 B2 Fe N8 O6 | C 1 2/c 1 | 23.705; 9.3657; 20.454 90; 118.68; 90 | 3983.9 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514471 | CIF | C56 H70 B4 Cl10 Fe2 N14 O12 | P -1 | 10.235; 10.862; 16.008 97.163; 98.93; 93.02 | 1739.6 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514472 | CIF | C56 H48 B2 Fe N8 O14 Zn2 | C 1 2/m 1 | 24.166; 18.52; 21.805 90; 105.6; 90 | 9399 | Wise, Matthew D.; Ruggi, Albert; Pascu, Mirela; Scopelliti, Rosario; Severin, Kay Clathrochelate-based bipyridyl ligands of nanoscale dimensions: easy-to-access building blocks for supramolecular chemistry Chemical Science, 2013, 4, 1658 |
| 1514473 | CIF | C7 H5 Cu2 I N4 S | I a -3 d | 41.856; 41.856; 41.856 90; 90; 90 | 73329 | Shan, Xiao-chen; Jiang, Fei-long; Yuan, Da-qiang; Zhang, Hua-bin; Wu, Ming-yan; Chen, Lian; Wei, Jing; Zhang, Shu-quan; Pan, Jie; Hong, Mao-chun A multi-metal-cluster MOF with Cu4I4 and Cu6S6 as functional groups exhibiting dual emission with both thermochromic and near-IR character Chemical Science, 2013, 4, 1484 |
| 1514474 | CIF | C15 H18 O6 | C 1 2/c 1 | 13.7664; 9.367; 10.8858 90; 99.268; 90 | 1385.4 | Urabe, Daisuke; Nagatomo, Masanori; Hagiwara, Koji; Masuda, Kengo; Inoue, Masayuki Symmetry-driven synthesis of 9-demethyl-10,15-dideoxyryanodol Chemical Science, 2013, 4, 1615 |
| 1514475 | CIF | C19 H32 O7 | P 1 21/c 1 | 9.1857; 10.7306; 17.807 90; 94.071; 90 | 1750.8 | Urabe, Daisuke; Nagatomo, Masanori; Hagiwara, Koji; Masuda, Kengo; Inoue, Masayuki Symmetry-driven synthesis of 9-demethyl-10,15-dideoxyryanodol Chemical Science, 2013, 4, 1615 |
| 1514476 | CIF | C31 H28 Cl0 Co F12 N6 P2 | P -1 | 11.462; 12.501; 13.164 109.79; 108.38; 90.82 | 1668.73 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514477 | CIF | C53 H45 B Co N5 | P -1 | 10.9829; 13.7142; 17.0064 102.458; 107.971; 101.25 | 2282.8 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514478 | CIF | C33 H28 Cl0 Co F6 N5 O8 S2 | P -1 | 11.94; 12.822; 15.328 65.696; 78.915; 66.557 | 1960.99 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514479 | CIF | C144 H130 B4 Co4 F40 N30 O24 S8 | C 1 c 1 | 17.791; 16.341; 27.415 90; 97.47; 90 | 7902.52 | King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science, 2013, 4, 1578 |
| 1514480 | CIF | C55 H68 B4 F16 N16 O4 | P 1 21/n 1 | 15.7015; 12.8679; 18.0196 90; 105.064; 90 | 3515.66 | Cai, Jiajia; Hay, Benjamin P.; Young, Neil J.; Yang, Xiaoping; Sessler, Jonathan L. A pyrrole-based triazolium-phane with NH and cationic CH donor groups as a receptor for tetrahedral oxyanions that functions in polar media Chemical Science, 2013, 4, 1560 |
| 1514481 | CIF | C54 H64 B F4 N16 O7 P2 | P 1 21/c 1 | 19.726; 15.697; 22.564 90; 101.404; 90 | 6849 | Cai, Jiajia; Hay, Benjamin P.; Young, Neil J.; Yang, Xiaoping; Sessler, Jonathan L. A pyrrole-based triazolium-phane with NH and cationic CH donor groups as a receptor for tetrahedral oxyanions that functions in polar media Chemical Science, 2013, 4, 1560 |
| 1514482 | CIF | C162 H200 B8 F32 N48 O16 P4 | P 1 21/n 1 | 20.554; 16.552; 31.568 90; 93.445; 90 | 10720 | Cai, Jiajia; Hay, Benjamin P.; Young, Neil J.; Yang, Xiaoping; Sessler, Jonathan L. A pyrrole-based triazolium-phane with NH and cationic CH donor groups as a receptor for tetrahedral oxyanions that functions in polar media Chemical Science, 2013, 4, 1560 |
| 1514483 | CIF | C57 H74 Cl4 Cu2 N4 S2 | C 2 2 21 | 14.073; 21.02; 19.083 90; 90; 90 | 5645 | Zhang, Shiyu; Warren, Timothy H. Three coordinate models for the binuclear CuA electron-transfer site Chemical Science, 2013, 4, 1786 |
| 1514484 | CIF | C58 H76 Cl4 Cu2 N4 S2 | C 1 2/c 1 | 52.089; 8.9421; 35.545 90; 129.297; 90 | 12813 | Zhang, Shiyu; Warren, Timothy H. Three coordinate models for the binuclear CuA electron-transfer site Chemical Science, 2013, 4, 1786 |
| 1514485 | CIF | C35 H43 Cl2 Cu N2 S | P 1 21/c 1 | 9.26; 24.43; 15.506 90; 100.133; 90 | 3453 | Zhang, Shiyu; Warren, Timothy H. Three coordinate models for the binuclear CuA electron-transfer site Chemical Science, 2013, 4, 1786 |
| 1514486 | CIF | C18 H18 Cl D2 N3 O2 | P b c a | 18.9604; 9.3522; 19.2687 90; 90; 90 | 3416.8 | Collett, Christopher J.; Massey, Richard S.; Maguire, Oliver R.; Batsanov, Andrei S.; O'Donoghue, AnnMarie C.; Smith, Andrew D. Mechanistic insights into the triazolylidene-catalysed Stetter and benzoin reactions: role of the N-aryl substituent Chemical Science, 2013, 4, 1514 |
| 1514487 | CIF | C19 H20 Cl D2 N3 O2 | P b c a | 19.2697; 9.5129; 19.6896 90; 90; 90 | 3609.3 | Collett, Christopher J.; Massey, Richard S.; Maguire, Oliver R.; Batsanov, Andrei S.; O'Donoghue, AnnMarie C.; Smith, Andrew D. Mechanistic insights into the triazolylidene-catalysed Stetter and benzoin reactions: role of the N-aryl substituent Chemical Science, 2013, 4, 1514 |
| 1514488 | CIF | C18 H17 Cl D2 F N3 O2 | P b c a | 18.8845; 9.4266; 19.2915 90; 90; 90 | 3434.2 | Collett, Christopher J.; Massey, Richard S.; Maguire, Oliver R.; Batsanov, Andrei S.; O'Donoghue, AnnMarie C.; Smith, Andrew D. Mechanistic insights into the triazolylidene-catalysed Stetter and benzoin reactions: role of the N-aryl substituent Chemical Science, 2013, 4, 1514 |
| 1514489 | CIF | C35 H48 Cl2 Fe N O2 | P 1 21/n 1 | 10.1903; 12.5783; 27.2498 90; 96.4952; 90 | 3470.4 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514490 | CIF | C40 H76 Fe N3 O2 Si4 | P 1 21/c 1 | 11.9269; 17.5744; 24.1583 90; 111.583; 90 | 4708.7 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514491 | CIF | C75.5 H98 Cl8 Fe2 N2 O8 | P -1 | 14.8709; 15.747; 17.9214 94.0663; 111.428; 95.5142 | 3863 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514492 | CIF | C43 H55 Cl4 Fe N2 O5 | P 1 21/n 1 | 12.6068; 24.431; 16.6177 90; 111.803; 90 | 4752.1 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514493 | CIF | C66 H90 Fe2 N4 O4 | P 1 21/c 1 | 14.1943; 14.2798; 17.1104 90; 113.995; 90 | 3168.4 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514494 | CIF | C45 H58 Fe N5 O2 | P 1 21 1 | 14.0101; 15.7187; 19.934 90; 97.6912; 90 | 4350.4 | Wong, Janice L.; Sánchez, Raúl Hernández; Logan, Jennifer Glancy; Zarkesh, Ryan A.; Ziller, Joseph W.; Heyduk, Alan F. Disulfide reductive elimination from an iron(iii) complex Chemical Science, 2013, 4, 1906 |
| 1514495 | CIF | C26 H27 Cu3 N8 O0 | P -1 | 11.4287; 11.7031; 12.918 64.005; 89.783; 71.129 | 1450.1 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514496 | CIF | C20 H21 Cu3 N8 O0 | P -1 | 11.4262; 11.4509; 12.5243 66.62; 89.182; 69.908 | 1398.37 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514497 | CIF | C22 H26 Cu3 N8 O2 | P -1 | 11.4964; 11.3571; 12.9352 115.386; 91.133; 69.305 | 1409.92 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514498 | CIF | C22 H26 Cu3 N8 O2 | P -1 | 11.5152; 11.312; 12.6953 114.171; 91.497; 68.347 | 1386.93 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514499 | CIF | C24 H29 Cu3 N8 O2 | P -1 | 11.4723; 11.4569; 13.1199 64.295; 89.824; 110.147 | 1434.83 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514500 | CIF | C26 H33 Cu3 N8 | P -1 | 11.4507; 11.6026; 13.2025 65.36; 71.368; 71.461 | 1475.62 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514501 | CIF | C22 H24 Cu3 N9 O | P -1 | 11.37; 11.4274; 12.1912 67.952; 87.743; 69.803 | 1370.45 | Wang, Jun-Hao; Li, Mian; Li, Dan A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour Chemical Science, 2013, 4, 1793 |
| 1514503 | CIF | C15 Cl2 N5 Ni O8 | P 4/n m m :2 | 9.2584; 9.2584; 14.1473 90; 90; 90 | 1212.68 | Cho, Jaeheung; Kang, Hye Yeon; Liu, Lei V.; Sarangi, Ritimukta; Solomon, Edward I.; Nam, Wonwoo Mononuclear nickel(II)-superoxo and nickel(III)-peroxo complexes bearing a common macrocyclic TMC ligand. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 1502-1508 |
| 1514504 | CIF | C15 H33 Cl N5 Ni O6 | P 1 c 1 | 7.7299; 7.7263; 17.8514 90; 100.673; 90 | 1047.7 | Cho, Jaeheung; Kang, Hye Yeon; Liu, Lei V.; Sarangi, Ritimukta; Solomon, Edward I.; Nam, Wonwoo Mononuclear nickel(II)-superoxo and nickel(III)-peroxo complexes bearing a common macrocyclic TMC ligand. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 1502-1508 |
| 1514505 | CIF | C42 H44 F6 Ir N2 O2 P2 | P 63 | 19.437; 19.437; 18.1371 90; 90; 120 | 5934.13 | Schramm, York; Barrios-Landeros, Fabiola; Pfaltz, Andreas Discovery of an iridacycle catalyst with improved reactivity and enantioselectivity in the hydrogenation of dialkyl ketimines Chemical Science, 2013, 4, 2760 |
| 1514506 | CIF | C26 H19 Br N2 O2 S | P 21 21 21 | 8.6182; 12.4254; 20.8694 90; 90; 90 | 2234.79 | Li, Meiling; Woods, Philip A.; Smith, Martin D. Cation-directed enantioselective synthesis of quaternary-substituted indolenines Chemical Science, 2013, 4, 2907 |
| 1514507 | CIF | C27 H19 N3 | P 1 21/c 1 | 12.6892; 9.9361; 16.3936 90; 102.515; 90 | 2017.81 | Li, Meiling; Woods, Philip A.; Smith, Martin D. Cation-directed enantioselective synthesis of quaternary-substituted indolenines Chemical Science, 2013, 4, 2907 |
| 1514508 | CIF | C72 H2 Cl16 | P -1 | 11.049; 13.43; 18.364 105.567; 91.091; 106.254 | 2507 | Tan, Yuan-Zhi; Li, Jia; Du, Ming-Yue; Lin, Shui-Chao; Xie, Su-Yuan; Lu, Xin; Huang, Rong-Bin; Zheng, Lan-Sun Exohedrally stabilized C70 isomer with adjacent pentagons characterized by crystallography Chemical Science, 2013, 4, 2967 |
| 1514509 | CIF | C368 H360 B16 Co8 F64 N72 O40 | C 1 2/c 1 | 27.658; 39.485; 42.581 90; 106.741; 90 | 44531 | Whitehead, Martina; Turega, Simon; Stephenson, Andrew; Hunter, Christopher A.; Ward, Michael D. Quantification of solvent effects on molecular recognition in polyhedral coordination cage hosts Chemical Science, 2013, 4, 2744 |
| 1514510 | CIF | C23 H21 N O6 | P 1 21 1 | 16.5029; 7.0004; 17.5337 90; 103.817; 90 | 1967 | Corbett, Michael T.; Johnson, Jeffrey S. Enantioselective synthesis of hindered cyclic dialkyl ethers via catalytic oxa-Michael/Michael desymmetrization. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2828-2832 |
| 1514511 | CIF | C28 H40 O6 | P 21 21 21 | 11.3881; 13.7611; 15.9461 90; 90; 90 | 2499 | Liffert, Raphael; Hoecker, Johannes; Jana, Chandan K.; Woods, Tom M.; Burch, Patrick; Jessen, Henning J.; Neuburger, Markus; Gademann, Karl Withanolide A: synthesis and structural requirements for neurite outgrowth Chemical Science, 2013, 4, 2851 |
| 1514512 | CIF | C27 H29 Br2 N O4 | P 21 21 21 | 6.4731; 9.867; 41.104 90; 90; 90 | 2625.3 | Wang, Hengbin; Guptill, David M.; Alvarez, Adrian Varela; Musaev, Djamaladdin G.; Davies, Huw M. L. Rhodium-catalyzed enantioselective cyclopropanation of electron deficient alkenes. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2844-2850 |
| 1514513 | CIF | C21 H21 Br O4 | P 21 21 21 | 6.0402; 15.4144; 20.729 90; 90; 90 | 1930 | Wang, Hengbin; Guptill, David M.; Alvarez, Adrian Varela; Musaev, Djamaladdin G.; Davies, Huw M. L. Rhodium-catalyzed enantioselective cyclopropanation of electron deficient alkenes. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2844-2850 |
| 1514514 | CIF | C40 H52 Cl4 F24 N3 O8 P4 Rh2 | P 1 21/n 1 | 12.7242; 20.3878; 23.2389 90; 97.497; 90 | 5977.1 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514515 | CIF | C25 H26 Cl2 F25 N3 O8 P4 Rh2 | P 1 | 10.1595; 10.386; 12.0283 73.962; 69.049; 71.477 | 1104.74 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514516 | CIF | C26 H29 Cl2 F24 N3 O9 P4 Rh2 | P 1 21/c 1 | 12.0403; 19.3984; 20.6248 90; 106.961; 90 | 4607.7 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514517 | CIF | C25 H26 Cl4 F25 N3 O8 P4 Rh2 | P 1 21/c 1 | 12.2025; 21.385; 20.398 90; 98.351; 90 | 5266.4 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514518 | CIF | C33 H37 Cl4 F24 N3 O9 P4 Rh2 | P -1 | 10.7825; 15.2029; 18.7253 87.983; 80.065; 73.223 | 2894.5 | Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2880 |
| 1514519 | CIF | C62 H135 Mn Mo6 N6 O26 | P c c a | 23.3192; 28.2; 30.215 90; 90; 90 | 19869 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514520 | CIF | C94 H152 Mn Mo6 N9 O26 | P -1 | 18.0136; 26.3164; 26.5199 113.089; 102.13; 100.729 | 10790.7 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514521 | CIF | C80 H153 Mn Mo6 N8 O28 | P 1 21/c 1 | 27.455; 29.007; 24.974 90; 94.45; 90 | 19829 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514522 | CIF | C80 H155 Mn Mo6 N8 O29 | P n m a | 28.257; 21.8128; 16.5796 90; 90; 90 | 10219.1 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1514523 | CIF | C19 H25 N O4 | P 1 21 1 | 8.3357; 11.294; 9.9646 90; 103.551; 90 | 912 | Wasil, Zahida; Pahirulzaman, Khomaizon A. K.; Butts, Craig; Simpson, Thomas J.; Lazarus, Colin M.; Cox, Russell J. One pathway, many compounds: heterologous expression of a fungal biosynthetic pathway reveals its intrinsic potential for diversity Chemical Science, 2013, 4, 3845 |
| 1514524 | CIF | C19 H23 N O4 | P 1 21 1 | 7.3372; 22.647; 20.618 90; 90.112; 90 | 3426 | Wasil, Zahida; Pahirulzaman, Khomaizon A. K.; Butts, Craig; Simpson, Thomas J.; Lazarus, Colin M.; Cox, Russell J. One pathway, many compounds: heterologous expression of a fungal biosynthetic pathway reveals its intrinsic potential for diversity Chemical Science, 2013, 4, 3845 |
| 1514525 | CIF | C13 H19 N O3 | P 1 21 1 | 9.0939; 30.695; 9.139 90; 94.405; 90 | 2543.5 | Wasil, Zahida; Pahirulzaman, Khomaizon A. K.; Butts, Craig; Simpson, Thomas J.; Lazarus, Colin M.; Cox, Russell J. One pathway, many compounds: heterologous expression of a fungal biosynthetic pathway reveals its intrinsic potential for diversity Chemical Science, 2013, 4, 3845 |
| 1514526 | CIF | C17 H17 Cl3 N2 O3 | P -1 | 9.7614; 10.2988; 10.4722 80.745; 71.023; 89.009 | 981.91 | Cui, Sunliang; Zhang, Yan; Wang, Dahai; Wu, Qifan Rh(iii)-catalyzed C‒H activation/[4 + 3] cycloaddition of benzamides and vinylcarbenoids: facile synthesis of azepinones Chemical Science, 2013, 4, 3912 |
| 1514527 | CIF | C35 H61 B11 Br6 F P Ru Si | P -1 | 11.8239; 14.7954; 15.4075 99.322; 110.839; 91.577 | 2475.17 | Fasulo, Meg E.; Lipke, Mark C.; Tilley, T. Don Structural and mechanistic investigation of a cationic hydrogen-substituted ruthenium silylene catalyst for alkene hydrosilation Chemical Science, 2013, 4, 3882 |
| 1514528 | CIF | C30.5 H23.25 Co F6 N5.75 O6 S2 | P -1 | 9.8107; 12.2952; 13.4212 93.235; 91.814; 91.35 | 1615.01 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514529 | CIF | C33 H30.5 B0.5 F11 N7 Ni O0.5 P1.5 | P 1 21/n 1 | 11.605; 26.456; 12.584 90; 114.443; 90 | 3517.3 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514530 | CIF | C33 H27 Cu F6 N7 O6 S2 | P -1 | 9.9247; 13.1783; 14.849 66.577; 80.638; 81.873 | 1752.01 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514531 | CIF | C31 H24 F6 N6 O6 S2 Zn | P -1 | 9.829; 12.2969; 13.4196 92.874; 91.805; 91.232 | 1618.7 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514532 | CIF | C32 H23 Co F9 N6 O6 S2 | P -1 | 10.1178; 10.1848; 18.5692 93.06; 101.838; 106.548 | 1782.45 | Nippe, Michael; Khnayzer, Rony S.; Panetier, Julien A.; Zee, David Z.; Olaiya, Babatunde S.; Head-Gordon, Martin; Chang, Christopher J.; Castellano, Felix N.; Long, Jeffrey R. Catalytic proton reduction with transition metal complexes of the redox-active ligand bpy2PYMe Chemical Science, 2013, 4, 3934 |
| 1514533 | CIF | C27 H23 Br2 N O6 | P 21 21 21 | 6.939; 18.9; 19.529 90; 90; 90 | 2561 | Frazier, Charles P.; Sandoval, David; Palmer, Leoni I.; Read de Alaniz, Javier Electrophilic α-oxygenation reaction of β-ketoesters using N-hydroxycarbamates: control of the ambident reactivity of nitrosoformate intermediates Chemical Science, 2013, 4, 3857 |
| 1514534 | CIF | C16 H25 N O6 | P 1 21/c 1 | 9.8524; 15.9675; 10.5673 90; 92.813; 90 | 1660.43 | Frazier, Charles P.; Sandoval, David; Palmer, Leoni I.; Read de Alaniz, Javier Electrophilic α-oxygenation reaction of β-ketoesters using N-hydroxycarbamates: control of the ambident reactivity of nitrosoformate intermediates Chemical Science, 2013, 4, 3857 |
| 1514535 | CIF | C37 H60 O6 | P 21 21 21 | 10.4149; 13.7246; 24.603 90; 90; 90 | 3516.8 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514536 | CIF | C38 H62 O9 | P 1 | 8.7254; 9.5176; 12.415 89.65; 80.46; 70.65 | 958 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514537 | CIF | C41 H71 Cl O5 Si | P 21 21 21 | 9.3808; 13.5353; 32.994 90; 90; 90 | 4189.3 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514538 | CIF | C34.5 H57 Cl O5 | P 1 21 1 | 11.2356; 11.9742; 24.8296 90; 93.447; 90 | 3334.46 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
| 1514539 | CIF | C43 H57 N5 Ni | P -1 | 10.911; 12.339; 15.869 103.994; 97.621; 107.921 | 1922.2 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514540 | CIF | C56 H77 N5 Ni | P 21 21 21 | 13.207; 17.694; 21.9242 90; 90; 90 | 5123.3 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514541 | CIF | C146 H136 B2 F40 N10 Ni2 | P -1 | 14.779; 15.5; 16.733 92.788; 98.247; 100.522 | 3718.6 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514542 | CIF | C27 H44 N4 Ni | F d d 2 | 17.8294; 42.047; 17.6823 90; 90; 90 | 13256 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514543 | CIF | C31 H49 N7 Ni | P -1 | 12.174; 26.324; 31.697 112.359; 99.666; 92.719 | 9191.6 | Harrold, Nicole D.; Hillhouse, Gregory L. Strongly bent nickel imides supported by a chelating bis(N-heterocyclic carbene) ligand Chemical Science, 2013, 4, 4011 |
| 1514544 | CIF | C19 H20 Cl2 O4 | P 21 21 21 | 7.8057; 10.1854; 23.4262 90; 90; 90 | 1862.5 | Hussain, Nusrah; Hussain, Mahmud M.; Carroll, Patrick J.; Walsh, Patrick J. Chemo- and diastereoselective tandem dual oxidation of B(pin)-substituted allylic alcohols: synthesis of B(pin)-substituted epoxy alcohols, 2-keto-anti-1,3-diols and dihydroxy-tetrahydrofuran-3-ones Chemical Science, 2013, 4, 3946 |
| 1514545 | CIF | C70.65 H64.63 Mn4 N7 O14.09 | P 1 21/c 1 | 19.5671; 12.5184; 27.8828 90; 106.461; 90 | 6549.9 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514546 | CIF | C65.42 H49.25 F4.75 Mn4 N6 O15.58 S1.58 | P 1 21/n 1 | 12.305; 15.5248; 37.6815 90; 98.567; 90 | 7118.1 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514547 | CIF | C72 H69 Mn4 N9 O14 | P -1 | 12.6007; 13.0991; 20.5699 99.263; 95.161; 94.247 | 3323.8 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514548 | CIF | C78 H61 F3 Mn4 N10 O14 S | P 1 21/n 1 | 15.41; 24.64; 19.23 90; 103.16; 90 | 7110 | Kanady, Jacob S.; Tran, Rosalie; Stull, Jamie A.; Lu, Luo; Stich, Troy A.; Day, Michael W.; Yano, Junko; Britt, R. David; Agapie, Theodor Role of Oxido Incorporation and Ligand Lability in Expanding Redox Accessibility of Structurally Related Mn4 Clusters. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3986-3996 |
| 1514549 | CIF | C24 H20 N4 O3 Pd | P -1 | 9.1886; 10.6165; 11.5601 81.563; 81.84; 72.521 | 1058.25 | Chen, Kai; Hu, Fang; Zhang, Shuo-Qing; Shi, Bing-Feng Pd(ii)-catalyzed alkylation of unactivated C(sp3)‒H bonds: efficient synthesis of optically active unnatural α-amino acids Chemical Science, 2013, 4, 3906 |
| 1514550 | CIF | C27 H32 O11 | P 1 | 9.4188; 9.7589; 15.1515 96.812; 97.849; 109.187 | 1282.95 | Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science, 2013, 4, 3979 |
| 1514551 | CIF | C45 H63 B O10 Si Sn | P -1 | 11.9576; 12.6539; 16.2477 96.233; 98.572; 100.371 | 2367.98 | Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science, 2013, 4, 3979 |
| 1514552 | CIF | C29 H40 O9 Si | P 21 21 21 | 10.7843; 14.0454; 19.3783 90; 90; 90 | 2935.23 | Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science, 2013, 4, 3979 |
| 1514553 | CIF | C118 H206 B2 Fe2 O P6 | C 1 2/c 1 | 28.3106; 21.7915; 22.8536 90; 126.572; 90 | 11323.1 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C‒O cleavage versus C‒C coupling Chemical Science, 2013, 4, 4042 |
| 1514554 | CIF | C124 H208 B2 Cl4 Fe2 N2 O2 P6 | P 1 21/c 1 | 22.7338; 15.5757; 17.6503 90; 110.288; 90 | 5862.1 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C‒O cleavage versus C‒C coupling Chemical Science, 2013, 4, 4042 |
| 1514555 | CIF | C54 H106 B2 Fe2 O P6 | P 1 21 1 | 14.199; 14.985; 14.939 90; 103.184; 90 | 3094.8 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C‒O cleavage versus C‒C coupling Chemical Science, 2013, 4, 4042 |
| 1514556 | CIF | C102 H94 B2 Fe2 O P6 | I -4 2 d | 33.2834; 33.2834; 16.7509 90; 90; 90 | 18556.4 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C‒O cleavage versus C‒C coupling Chemical Science, 2013, 4, 4042 |
| 1514557 | CIF | C67 H81 B Fe Na O7 P3 | P 31 | 13.1184; 13.1184; 31.059 90; 90; 120 | 4628.9 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C‒O cleavage versus C‒C coupling Chemical Science, 2013, 4, 4042 |
| 1514558 | CIF | C91 H82 B2 Fe2 O3 P6 | P -1 | 13.7605; 16.3419; 22.5111 96.665; 106.719; 103.489 | 4622.3 | Saouma, Caroline T.; Lu, Connie C.; Day, Michael W.; Peters, Jonas C. CO2 reduction by Fe(i): solvent control of C‒O cleavage versus C‒C coupling Chemical Science, 2013, 4, 4042 |
| 1514559 | CIF | C48 H62 O4 W | P -1 | 12.5307; 18.2485; 19.5913 91.056; 93.582; 109.527 | 4210.28 | McGowan, Kevin P.; O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Compelling mechanistic data and identification of the active species in tungsten-catalyzed alkyne polymerizations: conversion of a trianionic pincer into a new tetraanionic pincer-type ligand Chemical Science, 2013, 4, 1145 |
| 1514560 | CIF | C45 H56 O3.5 W | P -1 | 9.4199; 12.183; 17.6797 93.621; 100.409; 102.237 | 1939.34 | McGowan, Kevin P.; O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Compelling mechanistic data and identification of the active species in tungsten-catalyzed alkyne polymerizations: conversion of a trianionic pincer into a new tetraanionic pincer-type ligand Chemical Science, 2013, 4, 1145 |
| 1514561 | CIF | C50 H55 O2.5 W | P 1 21/c 1 | 9.6683; 40.736; 21.0306 90; 97.047; 90 | 8220.3 | McGowan, Kevin P.; O'Reilly, Matthew E.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Compelling mechanistic data and identification of the active species in tungsten-catalyzed alkyne polymerizations: conversion of a trianionic pincer into a new tetraanionic pincer-type ligand Chemical Science, 2013, 4, 1145 |
| 1514562 | CIF | C70.11 H51.07 Cl4.87 N8 O4.24 Zn2 | P -1 | 11.1564; 16.8638; 17.2397 94.315; 93.4125; 108.645 | 3052.51 | Maeda, Hiromitsu; Nishimura, Takuma; Akuta, Ryo; Takaishi, Kazuto; Uchiyama, Masanobu; Muranaka, Atsuya Two double helical modes of bidipyrrin‒ZnII complexes Chemical Science, 2013, 4, 1204 |
| 1514563 | CIF | C32 H24 Br2 N4 Ni | P 1 21/n 1 | 12.324; 8.833; 25.104 90; 94.105; 90 | 2725.8 | Maeda, Hiromitsu; Nishimura, Takuma; Akuta, Ryo; Takaishi, Kazuto; Uchiyama, Masanobu; Muranaka, Atsuya Two double helical modes of bidipyrrin‒ZnII complexes Chemical Science, 2013, 4, 1204 |
| 1514564 | CIF | C34 H25 Eu F18 N4 O7 | P 1 21/c 1 | 12.4834; 18.5861; 20.5491 90; 117.547; 90 | 4227.24 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514565 | CIF | C69 H50 Eu2 F36 N8 O14 | P 1 21/c 1 | 21.9162; 18.3619; 24.8681 90; 122.872; 90 | 8405.1 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514566 | CIF | C119 H90.5 Eu3 F54 N18.5 O20 | P -1 | 17.6614; 19.7308; 23.4654 95.2886; 96.678; 114.691 | 7288.8 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514567 | CIF | C38 H31 F18 Lu N6 O7 | P -1 | 12.2354; 14.4044; 14.8029 77.3039; 72.1925; 68.6551 | 2296.17 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514568 | CIF | C66 H54 F30 La2 N10 O14 | P -1 | 11.6721; 15.7298; 22.3967 78.307; 87.1599; 87.3088 | 4018.88 | Zaïm, Amir; Favera, Natalia Dalla; Guénée, Laure; Nozary, Homayoun; Hoang, Thi Nhu Y.; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Lanthanide hexafluoroacetylacetonates vs. nitrates for the controlled loading of luminescent polynuclear single-stranded oligomers Chemical Science, 2013, 4, 1125 |
| 1514569 | CIF | C23 H25 N O4 | P 1 21/c 1 | 18.485; 5.944; 18.057 90; 92.841; 90 | 1982 | Xie, Jin; Xue, Qicai; Jin, Hongming; Li, Huamin; Cheng, Yixiang; Zhu, Chengjian A visible-light-promoted aerobic C‒H/C‒N cleavage cascade to isoxazolidine skeletons Chemical Science, 2013, 4, 1281 |
| 1514570 | CIF | C47 H53 La O2 P3 Se6 | P 42/n m c :2 | 31.601; 31.601; 10.671 90; 90; 90 | 10656 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514571 | CIF | C44 H46 Ce O2 P3 Se6 | P -1 | 9.8457; 13.0684; 19.024 88.6; 85.615; 70.493 | 2300.5 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514572 | CIF | C47 H53 Nd O2 P3 Se6 | P 42/n m c :2 | 31.4695; 31.4695; 10.6442 90; 90; 90 | 10541.3 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514573 | CIF | C40 H36 La N2 P3 Se6 | P 1 21/c 1 | 13.5653; 9.0111; 35.576 90; 91.945; 90 | 4346.2 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514574 | CIF | C44 H46 N0 O2 P3 Pu Se6 | P -1 | 13.344; 18.862; 20.428 79.465; 89.356; 70.12 | 4746 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514575 | CIF | C60 H68 Ce N O P4 Se8 | P 21 21 21 | 12.6878; 21.9927; 22.9089 90; 90; 90 | 6392.5 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514576 | CIF | C60 H68 N O P4 Pu Se8 | P 21 21 21 | 12.7053; 21.997; 22.902 90; 90; 90 | 6400.6 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514577 | CIF | C48 H40 P4 Se8 U | P 1 21 1 | 13.8131; 9.7933; 18.8547 90; 91.597; 90 | 2549.6 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514578 | CIF | C48 H40 Np P4 Se8 | P 1 21 1 | 13.8899; 9.9688; 18.862 90; 91.609; 90 | 2610.7 | Jones, Matthew B.; Gaunt, Andrew J.; Gordon, John C.; Kaltsoyannis, Nikolas; Neu, Mary P.; Scott, Brian L. Uncovering f-element bonding differences and electronic structure in a series of 1 : 3 and 1 : 4 complexes with a diselenophosphinate ligand Chemical Science, 2013, 4, 1189 |
| 1514579 | CIF | C54 H78 Cl Ir N2 O2 | P 21 21 2 | 25.5236; 13.7422; 14.3634 90; 90; 90 | 5038 | Barnard, Jonathan H.; Wang, Chao; Berry, Neil G.; Xiao, Jianliang Long-range metal‒ligand bifunctional catalysis: cyclometallated iridium catalysts for the mild and rapid dehydrogenation of formic acid Chemical Science, 2013, 4, 1234 |
| 1514580 | CIF | C20 H26 Cl3 N2 Rh | P -1 | 10.499; 10.5404; 11.0455 63.986; 85.787; 69.884 | 1027.14 | Barnard, Jonathan H.; Wang, Chao; Berry, Neil G.; Xiao, Jianliang Long-range metal‒ligand bifunctional catalysis: cyclometallated iridium catalysts for the mild and rapid dehydrogenation of formic acid Chemical Science, 2013, 4, 1234 |
| 1514581 | CIF | C28 H27 N3 O3 | P 1 | 9.552; 10.569; 13.458 71.185; 76.497; 77.422 | 1235.4 | Uraguchi, Daisuke; Ueki, Yusuke; Sugiyama, Atsushi; Ooi, Takashi Highly stereoselective Michael addition of azlactones to electron-deficient triple bonds under P-spiro chiral iminophosphorane catalysis: importance of protonation pathway Chemical Science, 2013, 4, 1308 |
| 1514582 | CIF | C28 H28 N2 O4 | P 21 21 21 | 11.118; 16.129; 26.837 90; 90; 90 | 4812 | Uraguchi, Daisuke; Ueki, Yusuke; Sugiyama, Atsushi; Ooi, Takashi Highly stereoselective Michael addition of azlactones to electron-deficient triple bonds under P-spiro chiral iminophosphorane catalysis: importance of protonation pathway Chemical Science, 2013, 4, 1308 |
| 1514583 | CIF | C7 H18 Ca N O8 P | P 21 21 21 | 6.8101; 9.5015; 21.2601 90; 90; 90 | 1375.66 | Liang, Xiaoqiang; Zhang, Feng; Feng, Wei; Zou, Xiaoqin; Zhao, Chengji; Na, Hui; Liu, Cong; Sun, Fuxing; Zhu, Guangshan From metal‒organic framework (MOF) to MOF‒polymer composite membrane: enhancement of low-humidity proton conductivity Chemical Science, 2013, 4, 983 |
| 1514584 | CIF | C33 H50 Au N3 | P 1 21/c 1 | 12.5384; 13.4689; 19.1735 90; 93.373; 90 | 3232.4 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514585 | CIF | C33 H51 Au B F4 N3 | P 21 21 21 | 12.0547; 14.2387; 20.0505 90; 90; 90 | 3441.5 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514586 | CIF | C37 H50 Au N3 O | P 1 21/n 1 | 12.5675; 19.0611; 14.9662 90; 108.971; 90 | 3390.4 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514587 | CIF | C36 H53 Au N4 | P 1 21/c 1 | 10.8111; 20.7615; 16.2556 90; 103.247; 90 | 3551.6 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514588 | CIF | C45 H58 Au N2 P | P b c a | 14.8187; 19.5498; 28.0267 90; 90; 90 | 8119.4 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514589 | CIF | C45 H59 Au B F4 N2 P | P 1 2/n 1 | 11.8034; 8.9229; 50.327 90; 92.992; 90 | 5293.2 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514590 | CIF | C37 H59 Au B Cl4 F4 N2 P | P -1 | 11.9915; 12.2396; 16.7165 96.555; 108.386; 105.096 | 2195.7 | Johnson, Miles W.; Shevick, Sophia L.; Toste, F. Dean; Bergman, Robert G. Preparation and reactivity of terminal gold(i) amides and phosphides Chemical Science, 2013, 4, 1023 |
| 1514591 | CIF | C45 H59 Cl N P Pd | P -1 | 10.1656; 13.4105; 15.503 97.346; 101.171; 101.772 | 1998.7 | Bruno, Nicholas C.; Tudge, Matthew T.; Buchwald, Stephen L. Design and Preparation of New Palladium Precatalysts for C-C and C-N Cross-Coupling Reactions. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 916-920 |
| 1514592 | CIF | C57.5 H45 Cl4 N P2 Pd | P 1 21/n 1 | 14.55; 13.7601; 23.806 90; 94.469; 90 | 4751.7 | Bruno, Nicholas C.; Tudge, Matthew T.; Buchwald, Stephen L. Design and Preparation of New Palladium Precatalysts for C-C and C-N Cross-Coupling Reactions. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 916-920 |
| 1514593 | CIF | C50 H72 N O4 P Pd S | P -1 | 12.3071; 13.5653; 14.7831 102.455; 94.481; 98.654 | 2366.8 | Bruno, Nicholas C.; Tudge, Matthew T.; Buchwald, Stephen L. Design and Preparation of New Palladium Precatalysts for C-C and C-N Cross-Coupling Reactions. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 916-920 |
| 1514594 | CIF | C44 H62 Cl4 N O3 P Pd S | P -1 | 10.8288; 13.3096; 17.347 110.42; 93.341; 103.421 | 2252.3 | Bruno, Nicholas C.; Tudge, Matthew T.; Buchwald, Stephen L. Design and Preparation of New Palladium Precatalysts for C-C and C-N Cross-Coupling Reactions. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 916-920 |
| 1514595 | CIF | C48 H66 N O5 P Pd S | P 1 21/n 1 | 15.5569; 17.0797; 16.7243 90; 94.222; 90 | 4431.7 | Bruno, Nicholas C.; Tudge, Matthew T.; Buchwald, Stephen L. Design and Preparation of New Palladium Precatalysts for C-C and C-N Cross-Coupling Reactions. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 916-920 |
| 1514596 | CIF | C60.5 H52 Cl7 N O3 P2 Pd S | P -1 | 13.9763; 20.426; 21.29 75.424; 85.472; 76.307 | 5713.9 | Bruno, Nicholas C.; Tudge, Matthew T.; Buchwald, Stephen L. Design and Preparation of New Palladium Precatalysts for C-C and C-N Cross-Coupling Reactions. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 916-920 |
| 1514597 | CIF | C15 H19 I N4 O4 | P 1 21/n 1 | 12.572; 9.3235; 15.1484 90; 90.258; 90 | 1775.6 | Wang, Minyan; Fu, Chunling; Ma, Shengming Cleavage of oxygen‒sulfur double bonds and carbon‒sulfur bonds: unusual highly selective electrophilic addition of allenylic sulfoxides Chemical Science, 2013, 4, 1016 |
| 1514598 | CIF | C17 H15 I N4 O4 | P -1 | 7.1296; 7.4865; 17.896 87.393; 84.501; 71.105 | 899.5 | Wang, Minyan; Fu, Chunling; Ma, Shengming Cleavage of oxygen‒sulfur double bonds and carbon‒sulfur bonds: unusual highly selective electrophilic addition of allenylic sulfoxides Chemical Science, 2013, 4, 1016 |
| 1514599 | CIF | C31 H22 Cl2 F4 Ir N2 O | P 1 21/n 1 | 10.3467; 11.3394; 23.95 90; 92.079; 90 | 2808.1 | Maity, Ayan; Anderson, Bryce Lane; Deligonul, Nihal; Gray, Thomas G. Room-temperature synthesis of cyclometalated iridium(iii) complexes: kinetic isomers and reactive functionalities Chemical Science, 2013, 4, 1175 |
| 1514600 | CIF | C30 H19 F4 Ir N2 O | P 1 21/n 1 | 9.7368; 16.1179; 15.8357 90; 91.275; 90 | 2484.6 | Maity, Ayan; Anderson, Bryce Lane; Deligonul, Nihal; Gray, Thomas G. Room-temperature synthesis of cyclometalated iridium(iii) complexes: kinetic isomers and reactive functionalities Chemical Science, 2013, 4, 1175 |
| 1514601 | CIF | C8 H10 O4 | P -1 | 6.6342; 7.2435; 9.0416 101.074; 109.754; 99.964 | 387.76 | Huang, Xueliang; Klimczyk, Sebastian; Veiros, Luís F.; Maulide, Nuno Stereoselective intramolecular cyclopropanation through catalytic olefin activation Chemical Science, 2013, 4, 1105 |
| 1514602 | CIF | C8 H15 F6 N2 P | P b c a | 9.3855; 9.7769; 26.717 90; 90; 90 | 2451.58 | Saouane, Sofiane; Norman, Sarah E.; Hardacre, Christopher; Fabbiani, Francesca P. A. Pinning down the solid-state polymorphism of the ionic liquid [bmim][PF6] Chemical Science, 2013, 4, 1270 |
| 1514603 | CIF | C8 H15 F6 N2 P | P b c a | 9.4924; 9.8406; 26.8817 90; 90; 90 | 2511 | Saouane, Sofiane; Norman, Sarah E.; Hardacre, Christopher; Fabbiani, Francesca P. A. Pinning down the solid-state polymorphism of the ionic liquid [bmim][PF6] Chemical Science, 2013, 4, 1270 |
| 1514604 | CIF | C8 H15 F6 N2 P | P -1 | 9.3869; 9.5879; 14.4964 98.492; 98.354; 101.089 | 1245.85 | Saouane, Sofiane; Norman, Sarah E.; Hardacre, Christopher; Fabbiani, Francesca P. A. Pinning down the solid-state polymorphism of the ionic liquid [bmim][PF6] Chemical Science, 2013, 4, 1270 |
| 1514605 | CIF | C8 H15 F6 N2 P | P -1 | 9.5818; 9.5826; 14.5801 99.219; 99.252; 99.667 | 1278.2 | Saouane, Sofiane; Norman, Sarah E.; Hardacre, Christopher; Fabbiani, Francesca P. A. Pinning down the solid-state polymorphism of the ionic liquid [bmim][PF6] Chemical Science, 2013, 4, 1270 |
| 1514606 | CIF | C8 H15 F6 N2 P | P -1 | 8.8215; 9.0796; 9.0381 96.671; 114.768; 103.071 | 621.82 | Saouane, Sofiane; Norman, Sarah E.; Hardacre, Christopher; Fabbiani, Francesca P. A. Pinning down the solid-state polymorphism of the ionic liquid [bmim][PF6] Chemical Science, 2013, 4, 1270 |
| 1514607 | CIF | C16 H16 N2 O5 S | P 1 21 1 | 4.92063; 15.6607; 10.4554 90; 99.6328; 90 | 794.34 | Iwai, Yuri; Ozaki, Takashi; Takita, Ryo; Uchiyama, Masanobu; Shimokawa, Jun; Fukuyama, Tohru Modified McFadyen‒Stevens reaction for a versatile synthesis of aliphatic/aromatic aldehydes: design, optimization, and mechanistic investigations Chemical Science, 2013, 4, 1111 |
| 1514608 | CIF | C108 H71 F30 N6 O8 S4 | P -1 | 12.2352; 16.6412; 25.9304 76.808; 80.972; 74.261 | 4922.1 | Higashino, Tomohiro; Osuka, Atsuhiro 2,3,17,18-Tetraethylsulfanyl [30]hexaphyrin(1.1.1.1.1.1) as the first aromatic isophlorin-type free-base Chemical Science, 2013, 4, 1087 |
| 1514609 | CIF | C75 H32 Cl4 F30 N6 S4 | P -1 | 12.2654; 15.3627; 24.8758 101.432; 93.5605; 112.749 | 4186.74 | Higashino, Tomohiro; Osuka, Atsuhiro 2,3,17,18-Tetraethylsulfanyl [30]hexaphyrin(1.1.1.1.1.1) as the first aromatic isophlorin-type free-base Chemical Science, 2013, 4, 1087 |
| 1514610 | CIF | C75.78 H37.56 Cl3.56 F30 N6 S4 | P 1 21/n 1 | 16.133; 7.8286; 29.837 90; 102.318; 90 | 3681.6 | Higashino, Tomohiro; Osuka, Atsuhiro 2,3,17,18-Tetraethylsulfanyl [30]hexaphyrin(1.1.1.1.1.1) as the first aromatic isophlorin-type free-base Chemical Science, 2013, 4, 1087 |
| 1514611 | CIF | C119 H162 F3 Fe5 N17 O41 S Yb3 | P -1 | 16.483; 19.8976; 20.2276 76.119; 74.622; 81.57 | 6185.3 | Baniodeh, Amer; Anson, Christopher E.; Powell, Annie K. Ringing the changes in Feiii/Ybiii cyclic coordination clusters Chemical Science, 2013, 4, 4354 |
| 1514612 | CIF | C85 H111 Fe4 N7 O29 Yb2 | P -1 | 14.2113; 18.558; 19.2 84.231; 70.788; 83.144 | 4737.3 | Baniodeh, Amer; Anson, Christopher E.; Powell, Annie K. Ringing the changes in Feiii/Ybiii cyclic coordination clusters Chemical Science, 2013, 4, 4354 |
| 1514613 | CIF | C72 H94 Fe3 N5 O25 Yb2 | P 1 21/c 1 | 19.9227; 19.679; 22.0382 90; 108.184; 90 | 8208.8 | Baniodeh, Amer; Anson, Christopher E.; Powell, Annie K. Ringing the changes in Feiii/Ybiii cyclic coordination clusters Chemical Science, 2013, 4, 4354 |
| 1514614 | CIF | C61 H115 Fe4 N7 O27 S2 Yb2 | P 1 21/c 1 | 14.449; 24.951; 23.76 90; 101.82; 90 | 8384 | Baniodeh, Amer; Anson, Christopher E.; Powell, Annie K. Ringing the changes in Feiii/Ybiii cyclic coordination clusters Chemical Science, 2013, 4, 4354 |
| 1514615 | CIF | C182 H353 Fe10 N51 O90 Yb10 | P -1 | 16.553; 20.5964; 21.1312 108.791; 101.118; 95.993 | 6583.9 | Baniodeh, Amer; Anson, Christopher E.; Powell, Annie K. Ringing the changes in Feiii/Ybiii cyclic coordination clusters Chemical Science, 2013, 4, 4354 |
| 1514616 | CIF | C46 H60 N2 O14 Yb2 | P 1 21/n 1 | 9.898; 14.2365; 17.039 90; 94.369; 90 | 2394 | Baniodeh, Amer; Anson, Christopher E.; Powell, Annie K. Ringing the changes in Feiii/Ybiii cyclic coordination clusters Chemical Science, 2013, 4, 4354 |
| 1514617 | CIF | C17 H31 Cl N2 O6 | P 31 | 32.591; 32.591; 5.1877 90; 90; 120 | 4772 | Merkx, Remco; de Bruin, Gerjan; Kruithof, Art; van den Bergh, Toine; Snip, Erwin; Lutz, Martin; El Oualid, Farid; Ovaa, Huib Scalable synthesis of γ-thiolysine starting from lysine and a side by side comparison with δ-thiolysine in non-enzymatic ubiquitination Chemical Science, 2013, 4, 4494 |
| 1514618 | CIF | C52 H62 N4 O10 S2 | P -1 | 7.5487; 12.3687; 13.3085 86.885; 79.43; 78.079 | 1194.98 | Wu, Guanglu; Verwilst, Peter; Liu, Kai; Smet, Mario; Faul, Charl F. J.; Zhang, Xi Controlling the self-assembly of cationic bolaamphiphiles: counterion-directed transitions from 0D/1D to exclusively 2D planar structures Chemical Science, 2013, 4, 4486 |
| 1514619 | CIF | C65 H88 Mg2 N4 O3 | P 21 21 21 | 10.8296; 22.4623; 24.9069 90; 90; 90 | 6058.8 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514620 | CIF | C59 H82 Mg2 N4 O3 | C 1 2/c 1 | 48.559; 13.67; 17.5247 90; 103.46; 90 | 11313.4 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514621 | CIF | C60 H82 Mg2 N4 O4 | P c c n | 14.5246; 15.621; 25.9215 90; 90; 90 | 5881.3 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514622 | CIF | C58 H84 Mg2 N4 O2 | C 1 2/c 1 | 22.886; 14.823; 16.196 90; 90.65; 90 | 5494 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514623 | CIF | C72 H104 Mg2 N4 O3 | P -1 | 12.168; 12.6241; 13.176 98.046; 111.433; 109.68 | 1692.2 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514624 | CIF | C73 H106 Mg2 N4 O4 | P 1 21/n 1 | 12.749; 14.372; 18.802 90; 95.03; 90 | 3431.8 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514625 | CIF | C59 H82 Mg2 N4 O S2 | P b c a | 14.86; 17.21; 45.3 90; 90; 90 | 11585 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514626 | CIF | C83 H116 Mg2 N6 O | P 31 2 1 | 12.0374; 12.0374; 44.799 90; 90; 120 | 5621.7 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514627 | CIF | C63 H92 Mg2 N4 O2 S2 | P -1 | 13.1816; 16.205; 31.9827 79.216; 83.332; 68.828 | 6249.3 | Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science, 2013, 4, 4383 |
| 1514628 | CIF | C26 H23 N O3 S | P 1 21 1 | 8.6436; 12.2137; 10.588 90; 100.721; 90 | 1098.27 | Nishimura, Takahiro; Nagamoto, Midori; Ebe, Yusuke; Hayashi, Tamio Enantioselective [3 + 2] annulation via C‒H activation between cyclic N-acyl ketimines and 1,3-dienes catalyzed by iridium/chiral diene complexes Chemical Science, 2013, 4, 4499 |
| 1514629 | CIF | C15 H16 N4 O4 | P 1 21/c 1 | 11.2358; 9.1056; 15.9131 90; 104.579; 90 | 1575.6 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514630 | CIF | C15 H15 F N4 O4 | P 1 21/c 1 | 11.30697; 9.06586; 15.94455 90; 105.28; 90 | 1576.66 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514631 | CIF | C15 H15 F N4 O4 | P -1 | 8.78113; 10.06607; 10.5609 105.871; 72.7172; 71.1516 | 769.83 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514632 | CIF | C15 H14 F2 N4 O4 | P 1 21/c 1 | 11.39598; 9.15968; 15.8701 90; 104.025; 90 | 1607.2 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514633 | CIF | C15 H14 F2 N4 O4 | P 1 21/c 1 | 11.36104; 9.11522; 15.8828 90; 101.777; 90 | 1610.2 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514634 | CIF | C15 H14 F2 N4 O4 | P 1 21/c 1 | 11.33562; 9.12362; 15.9442 90; 104.26; 90 | 1598.17 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514635 | CIF | C15 H12 F4 N4 O4 | P 1 21/c 1 | 14.263; 8.13716; 16.0129 90; 121.214; 90 | 1589.4 | Bučar, Dejan-Krešimir; Day, Graeme M.; Halasz, Ivan; Zhang, Geoff G. Z.; Sander, John R. G.; Reid, David G.; MacGillivray, Leonard R.; Duer, Melinda J.; Jones, William The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystal Chemical Science, 2013, 4, 4417 |
| 1514636 | CIF | C36 H20 N4 S4 | P 1 21/c 1 | 13.2146; 8.7249; 26.334 90; 98.44; 90 | 3003.32 | Mouri, Kazuhiro; Saito, Shohei; Hisaki, Ichiro; Yamaguchi, Shigehiro Thermal 8π electrocyclic reaction of heteroarene tetramers: new efficient access to π-extended cyclooctatetraenes Chemical Science, 2013, 4, 4465 |
| 1514637 | CIF | C42 H46 B2 F12 N10 O Rh2 | P 1 21/c 1 | 11.042; 32.589; 14.243 90; 100.66; 90 | 5036.9 | Li, Zhanyong; Chifotides, Helen T.; Dunbar, Kim R. Unprecedented partial paddlewheel dirhodium methyl isocyanide compounds with unusual structural and electronic properties: a comprehensive experimental and theoretical study Chemical Science, 2013, 4, 4470 |
| 1514638 | CIF | C40 H46 B2 F8 N12 Rh2 | P b c a | 14.135; 21.331; 31.17 90; 90; 90 | 9398 | Li, Zhanyong; Chifotides, Helen T.; Dunbar, Kim R. Unprecedented partial paddlewheel dirhodium methyl isocyanide compounds with unusual structural and electronic properties: a comprehensive experimental and theoretical study Chemical Science, 2013, 4, 4470 |
| 1514639 | CIF | C42 H48 B2 F8 N10 Rh2 | P b c a | 14.338; 21.619; 31.136 90; 90; 90 | 9651 | Li, Zhanyong; Chifotides, Helen T.; Dunbar, Kim R. Unprecedented partial paddlewheel dirhodium methyl isocyanide compounds with unusual structural and electronic properties: a comprehensive experimental and theoretical study Chemical Science, 2013, 4, 4470 |
| 1514640 | CIF | C42 H46 B2 F12 N10 O Rh2 | P 1 21/c 1 | 11.11; 31.777; 14.195 90; 101.13; 90 | 4917.2 | Li, Zhanyong; Chifotides, Helen T.; Dunbar, Kim R. Unprecedented partial paddlewheel dirhodium methyl isocyanide compounds with unusual structural and electronic properties: a comprehensive experimental and theoretical study Chemical Science, 2013, 4, 4470 |
| 1514641 | CIF | C40 H46 B2 F8 N12 Rh2 | P b c a | 14.126; 21.399; 31.434 90; 90; 90 | 9502 | Li, Zhanyong; Chifotides, Helen T.; Dunbar, Kim R. Unprecedented partial paddlewheel dirhodium methyl isocyanide compounds with unusual structural and electronic properties: a comprehensive experimental and theoretical study Chemical Science, 2013, 4, 4470 |
| 1514642 | CIF | C48 H46 B2 F8 N6 P2 Rh2 | P 1 21/c 1 | 22.272; 22.161; 22.409 90; 119.43; 90 | 9633 | Li, Zhanyong; Chifotides, Helen T.; Dunbar, Kim R. Unprecedented partial paddlewheel dirhodium methyl isocyanide compounds with unusual structural and electronic properties: a comprehensive experimental and theoretical study Chemical Science, 2013, 4, 4470 |
| 1514643 | CIF | C22 H20 O | P 1 21/c 1 | 16.0527; 5.5303; 20.7663 90; 115.425; 90 | 1665 | Franzoni, Ivan; Guénée, Laure; Mazet, Clément Access to congested quaternary centers by Pd-catalyzed intermolecular γ-arylation of unactivated α,β-unsaturated aldehydes Chemical Science, 2013, 4, 2619 |
| 1514644 | CIF | C20 H24 O2 | P b c a | 9.79459; 10.18235; 34.1007 90; 90; 90 | 3400.93 | Franzoni, Ivan; Guénée, Laure; Mazet, Clément Access to congested quaternary centers by Pd-catalyzed intermolecular γ-arylation of unactivated α,β-unsaturated aldehydes Chemical Science, 2013, 4, 2619 |
| 1514645 | CIF | C28 H27 Br F3 N O8 S | P 1 21 1 | 11.663; 5.822; 21.566 90; 100.89; 90 | 1438 | Zhang, Wei; Liu, Na; Schienebeck, Casi M.; Zhou, Xin; Izhar, Izarin I.; Guzei, Ilia A.; Tang, Weiping Enantioselective intermolecular bromoesterification of allylic sulfonamides Chemical Science, 2013, 4, 2652 |
| 1514646 | CIF | C19 H13 F2 N4 O3 Pt | P 1 21/m 1 | 6.9645; 25.7559; 9.9824 90; 99.152; 90 | 1767.82 | Li, Kai; Cheng, Gang; Ma, Chensheng; Guan, Xiangguo; Kwok, Wai-Ming; Chen, Yong; Lu, Wei; Che, Chi-Ming Light-emitting platinum(ii) complexes supported by tetradentate dianionic bis(N-heterocyclic carbene) ligands: towards robust blue electrophosphors Chemical Science, 2013, 4, 2630 |
| 1514647 | CIF | C20 H14 Cl2 F2 N4 O2 Pt | P 1 21/c 1 | 11.5589; 8.2655; 22.3063 90; 111.907; 90 | 1977.3 | Li, Kai; Cheng, Gang; Ma, Chensheng; Guan, Xiangguo; Kwok, Wai-Ming; Chen, Yong; Lu, Wei; Che, Chi-Ming Light-emitting platinum(ii) complexes supported by tetradentate dianionic bis(N-heterocyclic carbene) ligands: towards robust blue electrophosphors Chemical Science, 2013, 4, 2630 |
| 1514648 | CIF | C20.5 H13 Cl N3 | P -1 | 8.1851; 8.5344; 13.5521 94.129; 99.175; 114.976 | 836.84 | Koenig, Matthias; Bottari, Giovanni; Brancato, Giuseppe; Barone, Vincenzo; Guldi, Dirk M.; Torres, Tomás Unraveling the peculiar modus operandi of a new class of solvatochromic fluorescent molecular rotors by spectroscopic and quantum mechanical methods Chemical Science, 2013, 4, 2502 |
| 1514649 | CIF | C22 H28 O6 | P -1 | 5.0348; 14.3242; 15.1715 115.546; 90.919; 98.363 | 972.89 | Riener, Michelle; Nicewicz, David A. Synthesis of cyclobutane lignans via an organic single electron oxidant-electron relay system. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2625 |
| 1514650 | CIF | C54 H95 Fe N10 O6 | P 1 21 1 | 21.267; 11.483; 26.049 90; 111.875; 90 | 5903.4 | Jeon, Ie-Rang; Calancea, Sergiu; Panja, Anangamohan; Piñero Cruz, Dalice M.; Koumousi, Evangelia S.; Dechambenoit, Pierre; Coulon, Claude; Wattiaux, Alain; Rosa, Patrick; Mathonière, Corine; Clérac, Rodolphe Spin crossover or intra-molecular electron transfer in a cyanido-bridged Fe/Co dinuclear dumbbell: a matter of state Chemical Science, 2013, 4, 2463 |
| 1514651 | CIF | C29 H27 B2 Co F8 N5 O | C 1 2/c 1 | 21.346; 12.362; 12.855 90; 120.033; 90 | 2936.7 | Jeon, Ie-Rang; Calancea, Sergiu; Panja, Anangamohan; Piñero Cruz, Dalice M.; Koumousi, Evangelia S.; Dechambenoit, Pierre; Coulon, Claude; Wattiaux, Alain; Rosa, Patrick; Mathonière, Corine; Clérac, Rodolphe Spin crossover or intra-molecular electron transfer in a cyanido-bridged Fe/Co dinuclear dumbbell: a matter of state Chemical Science, 2013, 4, 2463 |
| 1514652 | CIF | C22 H15 F0 Fe N8 O | P 1 21/c 1 | 10.9398; 22.107; 16.8809 90; 92.003; 90 | 4080.1 | Jeon, Ie-Rang; Calancea, Sergiu; Panja, Anangamohan; Piñero Cruz, Dalice M.; Koumousi, Evangelia S.; Dechambenoit, Pierre; Coulon, Claude; Wattiaux, Alain; Rosa, Patrick; Mathonière, Corine; Clérac, Rodolphe Spin crossover or intra-molecular electron transfer in a cyanido-bridged Fe/Co dinuclear dumbbell: a matter of state Chemical Science, 2013, 4, 2463 |
| 1514653 | CIF | C107 H92 Co2 Fe2 N26 O5 | P 1 21/c 1 | 13.5995; 14.2091; 24.965 90; 103.148; 90 | 4697.7 | Jeon, Ie-Rang; Calancea, Sergiu; Panja, Anangamohan; Piñero Cruz, Dalice M.; Koumousi, Evangelia S.; Dechambenoit, Pierre; Coulon, Claude; Wattiaux, Alain; Rosa, Patrick; Mathonière, Corine; Clérac, Rodolphe Spin crossover or intra-molecular electron transfer in a cyanido-bridged Fe/Co dinuclear dumbbell: a matter of state Chemical Science, 2013, 4, 2463 |
| 1514654 | CIF | C107 H92 Co2 Fe2 N26 O5 | P 1 21/c 1 | 13.6545; 14.348; 25.328 90; 102.313; 90 | 4848 | Jeon, Ie-Rang; Calancea, Sergiu; Panja, Anangamohan; Piñero Cruz, Dalice M.; Koumousi, Evangelia S.; Dechambenoit, Pierre; Coulon, Claude; Wattiaux, Alain; Rosa, Patrick; Mathonière, Corine; Clérac, Rodolphe Spin crossover or intra-molecular electron transfer in a cyanido-bridged Fe/Co dinuclear dumbbell: a matter of state Chemical Science, 2013, 4, 2463 |
| 1514655 | CIF | C39 H17 B F15 P | P 1 21/n 1 | 9.9184; 20.5507; 17.2472 90; 101.677; 90 | 3442.74 | Ekkert, Olga; Miera, Greco González; Wiegand, Thomas; Eckert, Hellmut; Schirmer, Birgitta; Petersen, Jeffrey L.; Daniliuc, Constantin G.; Fröhlich, Roland; Grimme, Stefan; Kehr, Gerald; Erker, Gerhard Remarkable coordination behavior of alkyl isocyanides toward unsaturated vicinal frustrated P/B Lewis pairs Chemical Science, 2013, 4, 2657 |
| 1514656 | CIF | C34 H20 B F10 P | P 1 21/c 1 | 8.3314; 23.9142; 14.7962 90; 90.618; 90 | 2947.8 | Ekkert, Olga; Miera, Greco González; Wiegand, Thomas; Eckert, Hellmut; Schirmer, Birgitta; Petersen, Jeffrey L.; Daniliuc, Constantin G.; Fröhlich, Roland; Grimme, Stefan; Kehr, Gerald; Erker, Gerhard Remarkable coordination behavior of alkyl isocyanides toward unsaturated vicinal frustrated P/B Lewis pairs Chemical Science, 2013, 4, 2657 |
| 1514657 | CIF | C44 H26 B F15 N P | P 1 21/c 1 | 13.8351; 11.5678; 30.569 90; 101.896; 90 | 4787.2 | Ekkert, Olga; Miera, Greco González; Wiegand, Thomas; Eckert, Hellmut; Schirmer, Birgitta; Petersen, Jeffrey L.; Daniliuc, Constantin G.; Fröhlich, Roland; Grimme, Stefan; Kehr, Gerald; Erker, Gerhard Remarkable coordination behavior of alkyl isocyanides toward unsaturated vicinal frustrated P/B Lewis pairs Chemical Science, 2013, 4, 2657 |
| 1514658 | CIF | C39 H29 B F10 N P | P -1 | 10.1806; 10.4896; 17.7612 94.693; 95.33; 112.36 | 1732.34 | Ekkert, Olga; Miera, Greco González; Wiegand, Thomas; Eckert, Hellmut; Schirmer, Birgitta; Petersen, Jeffrey L.; Daniliuc, Constantin G.; Fröhlich, Roland; Grimme, Stefan; Kehr, Gerald; Erker, Gerhard Remarkable coordination behavior of alkyl isocyanides toward unsaturated vicinal frustrated P/B Lewis pairs Chemical Science, 2013, 4, 2657 |
| 1514659 | CIF | C46 H30 B Cl4 F15 N P | P 1 21/n 1 | 17.6472; 14.6343; 18.4267 90; 103.288; 90 | 4631.4 | Ekkert, Olga; Miera, Greco González; Wiegand, Thomas; Eckert, Hellmut; Schirmer, Birgitta; Petersen, Jeffrey L.; Daniliuc, Constantin G.; Fröhlich, Roland; Grimme, Stefan; Kehr, Gerald; Erker, Gerhard Remarkable coordination behavior of alkyl isocyanides toward unsaturated vicinal frustrated P/B Lewis pairs Chemical Science, 2013, 4, 2657 |
| 1514660 | CIF | C39.5 H30 B Cl F10 N P | C 1 2/c 1 | 39.1199; 16.3061; 23.4811 90; 97.421; 90 | 14853 | Ekkert, Olga; Miera, Greco González; Wiegand, Thomas; Eckert, Hellmut; Schirmer, Birgitta; Petersen, Jeffrey L.; Daniliuc, Constantin G.; Fröhlich, Roland; Grimme, Stefan; Kehr, Gerald; Erker, Gerhard Remarkable coordination behavior of alkyl isocyanides toward unsaturated vicinal frustrated P/B Lewis pairs Chemical Science, 2013, 4, 2657 |
| 1514661 | CIF | C34 H30 Br3 N O4 S | P 21 21 21 | 11.8916; 15.4391; 17.7101 90; 90; 90 | 3251.5 | Chen, Xingkuan; Fang, Xinqiang; Chi, Yonggui Robin cis-Enals in N-heterocyclic carbene-catalyzed reactions: distinct stereoselectivity and reactivity Chemical Science, 2013, 4, 2613 |
| 1514662 | CIF | C32 H37 Cl6 Ir N2 O3 | P 21 21 21 | 8.5561; 28.71; 29.726 90; 90; 90 | 7302.1 | Owens, Clayton P.; Varela-Álvarez, Adrián; Boyarskikh, Vyacheslav; Musaev, Djamaladdin G.; Davies, Huw M. L.; Blakey, Simon B. Iridium(iii)-bis(oxazolinyl)phenyl catalysts for enantioselective C‒H functionalization Chemical Science, 2013, 4, 2590 |
| 1514663 | CIF | C15 H10 F2 O | P 1 21/c 1 | 6.6609; 9.7886; 18.8033 90; 106.893; 90 | 1173.09 | Agabekov, Vladislav; Seiche, Wolfgang; Breit, Bernhard Rhodium-catalyzed hydroformylation of alkynes employing a self-assembling ligand system Chemical Science, 2013, 4, 2418 |
| 1514664 | CIF | C15 H12 O | P 1 21/c 1 | 5.8262; 21.4617; 9.2279 90; 95.017; 90 | 1149.44 | Agabekov, Vladislav; Seiche, Wolfgang; Breit, Bernhard Rhodium-catalyzed hydroformylation of alkynes employing a self-assembling ligand system Chemical Science, 2013, 4, 2418 |
| 1514665 | CIF | C55 H54 F6 N O10 P | P 1 21/n 1 | 14.0847; 15.7003; 25.3994 90; 91.481; 90 | 5614.8 | Suresh, Moorthy; Mandal, Amal Kumar; Suresh, E.; Das, Amitava First demonstration of two-step FRET in a synthetic supramolecular assembly Chemical Science, 2013, 4, 2380 |
| 1514666 | CIF | C28 H18 | C 1 2/c 1 | 23.095; 4.8656; 18.761 90; 122.671; 90 | 1774.6 | Maekawa, Takehisa; Segawa, Yasutomo; Itami, Kenichiro C‒H activation route to dibenzo[a,e]pentalenes: annulation of arylacetylenes promoted by PdCl2‒AgOTf‒o-chloranil Chemical Science, 2013, 4, 2369 |
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