Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1514881 | CIF | C10 H14 O2 | C 1 c 1 | 14.8047; 24.843; 5.0851 90; 101.707; 90 | 1831.4 | Unold, Jörg; Wang, Dongren; Frey, Wolfgang; Buchmeiser, Michael R. Stereo- and regioselective cyclopolymerization of chiral 1,7-octadiynes Polymer Chemistry, 2013, 4, 4219 |
| 1514882 | CIF | C27 H38 Cl2 N2 O1.5 Zn | C 1 2/c 1 | 29.535; 11.948; 15.335 90; 96.899; 90 | 5372.3 | Naumann, Stefan; Schmidt, Friedrich Georg; Frey, Wolfgang; Buchmeiser, Michael R. Protected N-heterocyclic carbenes as latent pre-catalysts for the polymerization of ε-caprolactone Polymer Chemistry, 2013, 4, 4172 |
| 1514883 | CIF | C71 H116 N4 O6 Y2 | P c a b | 21.045; 24.936; 30.425 90; 90; 90 | 15966 | Fang, Jian; Tschan, Mathieu J.-L.; Roisnel, Thierry; Trivelli, Xavier; Gauvin, Régis M.; Thomas, Christophe M.; Maron, Laurent Yttrium catalysts for syndioselective β-butyrolactone polymerization: on the origin of ligand-induced stereoselectivity Polymer Chemistry, 2013, 4, 360 |
| 1514884 | CIF | C23 H26 N4 O2 | P 1 c 1 | 17.848; 16.102; 22.302 90; 110.45; 90 | 6005 | Alsarraf, Jérome; Robert, Frédéric; Cramail, Henri; Landais, Yannick Latent catalysts based on guanidine templates for polyurethane synthesis Polymer Chemistry, 2013, 4, 904 |
| 1514885 | CIF | C25 H30 N4 O2 | P -1 | 10.154; 10.801; 11.233 69.9; 85.34; 70.13 | 1087.2 | Alsarraf, Jérome; Robert, Frédéric; Cramail, Henri; Landais, Yannick Latent catalysts based on guanidine templates for polyurethane synthesis Polymer Chemistry, 2013, 4, 904 |
| 1514886 | CIF | C24 H29 N5 O2 | P b c a | 12.5135; 8.2914; 41.841 90; 90; 90 | 4341.2 | Alsarraf, Jérome; Robert, Frédéric; Cramail, Henri; Landais, Yannick Latent catalysts based on guanidine templates for polyurethane synthesis Polymer Chemistry, 2013, 4, 904 |
| 1514887 | CIF | C27 H41 N3 O3 | P 1 21 1 | 11.2993; 7.8614; 14.373 90; 94.716; 90 | 1272.4 | Li, Weina; Tian, Tian; Zhu, Wei; Cui, Jiecheng; Ju, Yong; Li, Guangtao Metal-free click approach for facile production of main chain poly(bile acid)s Polymer Chemistry, 2013, 4, 3057 |
| 1514888 | CIF | C36 H26 | P -1 | 9.908; 10.7787; 12.7321 97.6691; 94.7545; 115.897 | 1196.95 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514889 | CIF | C36.5 H25 Cl3 | P 1 21/c 1 | 7.5317; 21.0519; 17.7743 90; 94.802; 90 | 2808.3 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514890 | CIF | C38 H30 | C 1 2/c 1 | 7.3789; 22.1571; 16.3043 90; 102.057; 90 | 2606.87 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514891 | CIF | C52 H56 Cl2 | F d d d :2 | 13.8723; 17.3314; 37.589 90; 90; 90 | 9037.4 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514892 | CIF | C23 H19 N7 | P 43 21 2 | 6.1133; 6.1133; 52.627 90; 90; 90 | 1966.8 | Lang, Christiane; Pahnke, Kai; Kiefer, Claude; Goldmann, Anja S.; Roesky, Peter W.; Barner-Kowollik, Christopher Consecutive modular ligation as an access route to palladium containing polymers Polymer Chemistry, 2013, 4, 5456 |
| 1514893 | CIF | C29 H37 Cl4 N7 O3 Pd2 S3 | P -1 | 8.6458; 13.837; 17.394 109.67; 102.9; 95.46 | 1876.8 | Lang, Christiane; Pahnke, Kai; Kiefer, Claude; Goldmann, Anja S.; Roesky, Peter W.; Barner-Kowollik, Christopher Consecutive modular ligation as an access route to palladium containing polymers Polymer Chemistry, 2013, 4, 5456 |
| 1514894 | CIF | C76 H68 N2 O2 | P n a 21 | 18.951; 14.595; 20.257 90; 90; 90 | 5603 | Brulé, Emilie; Guérineau, Vincent; Vermaut, Philippe; Prima, Frédéric; Balogh, Janos; Maron, Laurent; Slawin, Alexandra M. Z.; Nolan, Steven P.; Thomas, Christophe M. Polymerization of cyclic esters using N-heterocyclic carbene carboxylate catalysts Polymer Chemistry, 2013, 4, 2414 |
| 1514895 | CIF | C38 H38 Br2 N2 O2 S2 | P 1 21/c 1 | 18.397; 8.5233; 11.0281 90; 90.413; 90 | 1729.2 | Zhang, Haichang; Welterlich, Irina; Neudörfl, Jörg-Martin; Tieke, Bernd; Yang, Chao; Chen, Xuegang; Yang, Wenjun Synthesis and characterization of 1,3,4,6-tetraarylpyrrolo[3,2-b]-pyrrole-2,5-dione (isoDPP)-based donor–acceptor polymers with low band gap Polymer Chemistry, 2013, 4, 4682 |
| 1514896 | CIF | C32 H51 Al O2 | P -1 | 10.9975; 12.3835; 13.3184 65.237; 75.393; 69.574 | 1531.4 | Descour, Camille; Sciarone, Timo J. J.; Cavallo, Dario; Macko, Tibor; Kelchtermans, Mauritz; Korobkov, Ilia; Duchateau, Robbert Exploration of the effect of 2,6-(t-Bu)2-4-Me-C6H2OH (BHT) in chain shuttling polymerization Polymer Chemistry, 2013, 4, 4718 |
| 1514897 | CIF | C34 H56 O2 Zn2 | P b c a | 17.7224; 9.6794; 19.248 90; 90; 90 | 3301.8 | Descour, Camille; Sciarone, Timo J. J.; Cavallo, Dario; Macko, Tibor; Kelchtermans, Mauritz; Korobkov, Ilia; Duchateau, Robbert Exploration of the effect of 2,6-(t-Bu)2-4-Me-C6H2OH (BHT) in chain shuttling polymerization Polymer Chemistry, 2013, 4, 4718 |
| 1514898 | CIF | C30 H35 Br2 N3 O4 S2 | P 1 21/c 1 | 15.9739; 13.3946; 15.1964 90; 108.737; 90 | 3079.16 | Neo, Wei Teng; Loo, Lee May; Song, Jing; Wang, Xiaobai; Cho, Ching Mui; On Chan, Hardy Sze; Zong, Yun; Xu, Jianwei Solution-processable blue-to-transmissive electrochromic benzotriazole-containing conjugated polymers Polymer Chemistry, 2013, 4, 4663 |
| 1514899 | CIF | C31 H44 Cl4 N2 O2 | C 1 2/c 1 | 16.2658; 9.9841; 21.212 90; 108.293; 90 | 3270.7 | Naumann, Stefan; Schmidt, Friedrich Georg; Schowner, Roman; Frey, Wolfgang; Buchmeiser, Michael R. Polymerization of methyl methacrylate by latent pre-catalysts based on CO2-protected N-heterocyclic carbenes Polymer Chemistry, 2013, 4, 2731 |
| 1514900 | CIF | C32 H24 O4 | P -1 | 8.957; 11.1473; 12.7782 80.558; 89.54; 86.557 | 1256.3 | Hu, Rongrong; Lam, Jacky W. Y.; Yu, Yong; Sung, Herman H. Y.; Williams, Ian D.; Yuen, Matthew M. F.; Tang, Ben Zhong Facile synthesis of soluble nonlinear polymers with glycogen-like structures and functional properties from “simple” acrylic monomers Polymer Chemistry, 2013, 4, 95 |
| 1514901 | CIF | C32 H24 O4 | P -1 | 9.5026; 12.2523; 12.4543 98.109; 110.976; 105.891 | 1255.2 | Hu, Rongrong; Lam, Jacky W. Y.; Yu, Yong; Sung, Herman H. Y.; Williams, Ian D.; Yuen, Matthew M. F.; Tang, Ben Zhong Facile synthesis of soluble nonlinear polymers with glycogen-like structures and functional properties from “simple” acrylic monomers Polymer Chemistry, 2013, 4, 95 |
| 1514902 | CIF | C31 H22 O4 | C 1 2/c 1 | 17.33; 9.333; 13.964 90; 99.064; 90 | 2230.3 | Hu, Rongrong; Lam, Jacky W. Y.; Yu, Yong; Sung, Herman H. Y.; Williams, Ian D.; Yuen, Matthew M. F.; Tang, Ben Zhong Facile synthesis of soluble nonlinear polymers with glycogen-like structures and functional properties from “simple” acrylic monomers Polymer Chemistry, 2013, 4, 95 |
| 1514903 | CIF | C22 H39 Na O9 S | P 1 21 1 | 12.847; 7.442; 13.875 90; 106.04; 90 | 1274.9 | Zhang, Tao; Wu, Ya; Gao, Lihong; Song, Zhongtai; Zhao, Li; Zhang, Yunxiao; Tao, Jingchao A novel Na+ coordination mediated supramolecular organogel based on isosteviol: water-assisted self-assembly, in situ forming and selective gelation abilities Soft Matter, 2013, 9, 638 |
| 1514904 | CIF | C22 H35 Na O7 S | P 21 21 21 | 7.35356; 22.3698; 28.078 90; 90; 90 | 4618.77 | Zhang, Tao; Wu, Ya; Gao, Lihong; Song, Zhongtai; Zhao, Li; Zhang, Yunxiao; Tao, Jingchao A novel Na+ coordination mediated supramolecular organogel based on isosteviol: water-assisted self-assembly, in situ forming and selective gelation abilities Soft Matter, 2013, 9, 638 |
| 1514905 | CIF | C12 H16 N4 O8 S Zn | P b c a | 9.1328; 9.0544; 39.49 90; 90; 90 | 3265.5 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514906 | CIF | C12 H16 Cd N4 O8 S | P 1 21 1 | 6.8863; 10.0489; 12.7212 90; 90.543; 90 | 880.26 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514907 | CIF | C12 H18 N6 O8 S Zn | P 1 21/c 1 | 21.2322; 8.5552; 9.475 90; 94.688; 90 | 1715.34 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514908 | CIF | C12 H18 Cd N6 O8 S | P n m a | 9.5591; 21.864; 8.5122 90; 90; 90 | 1779.1 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514909 | CIF | C12 H20 N6 O9 S Zn | P 21 21 21 | 7.9153; 10.9871; 21.5221 90; 90; 90 | 1871.7 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514910 | CIF | C42 H31 F N3 O5 P | P -1 | 10.3434; 10.8351; 17.8432 88.992; 74.957; 66.544 | 1763.3 | Han, Ying; Sheng, Yin-Jian; Yan, Chao-Guo Convenient Synthesis of Triphenylphosphanylidene Spiro[cyclopentane-1,3'-indolines] and Spiro[cyclopent[2]ene-1,3'-indolines] via Three-Component Reactions. Organic letters, 2014, 16, 2654-2657 |
| 1514911 | CIF | C39 H34 N3 O5 P | P 1 21/c 1 | 11.5092; 20.748; 18.3368 90; 113.281; 90 | 4022.2 | Han, Ying; Sheng, Yin-Jian; Yan, Chao-Guo Convenient Synthesis of Triphenylphosphanylidene Spiro[cyclopentane-1,3'-indolines] and Spiro[cyclopent[2]ene-1,3'-indolines] via Three-Component Reactions. Organic letters, 2014, 16, 2654-2657 |
| 1514912 | CIF | C46 H38 F N2 O7 P | P -1 | 11.8143; 12.899; 16.002 89.295; 75.627; 66.226 | 2151.2 | Han, Ying; Sheng, Yin-Jian; Yan, Chao-Guo Convenient Synthesis of Triphenylphosphanylidene Spiro[cyclopentane-1,3'-indolines] and Spiro[cyclopent[2]ene-1,3'-indolines] via Three-Component Reactions. Organic letters, 2014, 16, 2654-2657 |
| 1514913 | CIF | C27 H19 Cl O3 Sn | P -1 | 9.582; 10.189; 12.743 80.315; 81.682; 72.174 | 1161.7 | Villamil-Ramos, Raul; Barba, Víctor; Yatsimirsky, Anatoly K. Selective fluorometric detection of pyrophosphate by 3-hydroxyflavone-diphenyltin(IV) complex in aqueous micellar medium. The Analyst, 2012, 137, 5229-5236 |
| 1514914 | CIF | C23 H23 N3 O4 | P -1 | 5.933; 11.085; 15.588 93.5; 92.85; 93.01 | 1020.4 | Ho, I-Ting; Lai, Ting-Ling; Wu, Ren-Tsung; Tsai, Ming-Tsung; Wu, Chun-Ming; Lee, Gene-Hsiang; Chung, Wen-Sheng Design and synthesis of triazolyl coumarins as Hg2+ selective fluorescent chemosensors. The Analyst, 2012, 137, 5770-5776 |
| 1514915 | CIF | C25 H25 N3 O5 | P -1 | 5.7298; 11.442; 17.7012 96.531; 96.165; 93.056 | 1143.77 | Ho, I-Ting; Lai, Ting-Ling; Wu, Ren-Tsung; Tsai, Ming-Tsung; Wu, Chun-Ming; Lee, Gene-Hsiang; Chung, Wen-Sheng Design and synthesis of triazolyl coumarins as Hg2+ selective fluorescent chemosensors. The Analyst, 2012, 137, 5770-5776 |
| 1514916 | CIF | C52 H47 F12 N5 P2 | P 1 21/c 1 | 24.481; 8.9613; 23.769 90; 108.336; 90 | 4949.7 | Kumar, Rahul; Kumar, Sandeep; Singh, Prabhpreet; Hundal, Geeta; Hundal, Maninder Singh; Kumar, Subodh A fluorescent chemosensor for detection of perchlorate ions in water. The Analyst, 2012, 137, 4913-4916 |
| 1514917 | CIF | C101 H82 Eu2 F18 N8 O12 S6 | P -1 | 14.5284; 24.4825; 30.2443 97.944; 99.275; 99.985 | 10302.3 | Knall, Astrid C.; Tscherner, Martin; Noormofidi, Nadja; Pein, Andreas; Saf, Robert; Mereiter, Kurt; Ribitsch, Volker; Stelzer, Franz; Slugovc, Christian Nonradiative deactivation of europium(III) luminescence as a detection scheme for moisture. The Analyst, 2012, 137, 563-566 |
| 1514918 | CIF | C24 H22 Cu N4 O5 | P -1 | 8.7402; 10.657; 13.3251 73.598; 81.236; 66.007 | 1086.77 | Singh, Vikram; Mondal, Prakash Chandra; Lakshmanan, Jeyachandran Yekkoni; Zharnikov, Michael; Gupta, Tarkeshwar "Turn on" electron-transfer-based selective detection of ascorbic acid via copper complexes immobilized on glass. The Analyst, 2012, 137, 3216-3219 |
| 1514919 | CIF | C18 H13 N3 S | P 1 21 1 | 8.3875; 12.9511; 13.3838 90; 98.248; 90 | 1438.81 | Sen, Supriti; Sarkar, Sandipan; Chattopadhyay, Basab; Moirangthem, Anuradha; Basu, Anupam; Dhara, Koushik; Chattopadhyay, Pabitra A ratiometric fluorescent chemosensor for iron: discrimination of Fe2+ and Fe3+ and living cell application. The Analyst, 2012, 137, 3335-3342 |
| 1514920 | CIF | C31 H33 Br Fe N4 O | C 1 2/c 1 | 20.3791; 19.3945; 16.8449 90; 121.23; 90 | 5693.1 | Cao, Qian-Yong; Pradhan, Tuhin; Lee, Min Hee; No, Kwanghyun; Kim, Jong Seung Ferrocene-based anion receptor bearing amide and triazolium donor groups. The Analyst, 2012, 137, 4454-4457 |
| 1514921 | CIF | C31 H33 F6 Fe N4 O P | C 1 2/c 1 | 20.9857; 20.1226; 17.211 90; 117.802; 90 | 6429 | Cao, Qian-Yong; Pradhan, Tuhin; Lee, Min Hee; No, Kwanghyun; Kim, Jong Seung Ferrocene-based anion receptor bearing amide and triazolium donor groups. The Analyst, 2012, 137, 4454-4457 |
| 1514922 | CIF | C13 H13 N O2 | C 1 2/c 1 | 15.982; 4.957; 27.97 90; 104.77; 90 | 2143 | Lin, Hsiang-Yi; Cheng, Pi-Yun; Wan, Chin-Feng; Wu, An-Tai A turn-on and reversible fluorescence sensor for zinc ion. The Analyst, 2012, 137, 4415-4417 |
| 1514923 | CIF | C16 H12 B F2 N3 | P 1 21/c 1 | 15.746; 8.9776; 10.2886 90; 99.12; 90 | 1436 | Kand, Dnyaneshwar; Mishra, Pratyush Kumar; Saha, Tanmoy; Lahiri, Mayurika; Talukdar, Pinaki BODIPY based colorimetric fluorescent probe for selective thiophenol detection: theoretical and experimental studies. The Analyst, 2012, 137, 3921-3924 |
| 1514924 | CIF | C16 H13 N O2 | P 1 21/c 1 | 9.7368; 9.5514; 13.8091 90; 107.501; 90 | 1224.8 | Sen, Supriti; Mukherjee, Titas; Chattopadhyay, Basab; Moirangthem, Anuradha; Basu, Anupam; Marek, Jaromir; Chattopadhyay, Pabitra A water soluble Al3+ selective colorimetric and fluorescent turn-on chemosensor and its application in living cell imaging. The Analyst, 2012, 137, 3975-3981 |
| 1514926 | CIF | C24 H15 N O2 | P 1 21/n 1 | 6.661; 30.083; 17.635 90; 99.52; 90 | 3485.08 | Guha, Subarna; Lohar, Sisir; Banerjee, Arnab; Sahana, Animesh; Mukhopadhyay, Subhra Kanti; Matalobos, Jesús Sanmartín; Das, Debasis Anthracene appended coumarin derivative as a Cr(iii) selective turn-on fluorescent probe for living cell imaging: a green approach towards speciation studies Analytical Methods, 2012, 4, 3163 |
| 1514927 | CIF | C16 H11 N O5 | P 1 21/c 1 | 15.7822; 7.2392; 12.5086 90; 106.033; 90 | 1373.5 | Ivanova, Bojidarka B. Matrixes in UV-MALDI mass spectrometry – crystals of organic salts versus co-crystals of neutral polyfunctional carboxylic acids Analytical Methods, 2012, 4, 2247 |
| 1514930 | CIF | C8 H7 N2 O3 | C 1 2/c 1 | 21.047; 8.368; 9.364 90; 101.972; 90 | 1613.3 | Ivanova, Bojidarka B. Matrixes in UV-MALDI mass spectrometry ‒ crystals of organic salts versus co-crystals of neutral polyfunctional carboxylic acids Analytical Methods, 2012, 4, 2247 |
| 1514932 | CIF | C15 H11 N S | A b a 2 | 10.7541; 20.966; 10.5543 90; 90; 90 | 2379.7 | Das, Sudipta; Sahana, Animesh; Banerjee, Arnab; Lohar, Sisir; Guha, Subarna; Matalobos, Jesús Sanmartín; Das, Debasis Thiophene anchored naphthalene derivative: Cr3+ selective turn-on fluorescent probe for living cell imaging Analytical Methods, 2012, 4, 2254 |
| 1514933 | CIF | C30 H35 B O9 | P 1 21/c 1 | 14.1656; 14.6048; 14.5328 90; 104.242; 90 | 2914.2 | Lawrence, Katherine; Flower, Stephen E.; Kociok-Kohn, Gabriele; Frost, Christopher G.; James, Tony D. A simple and effective colorimetric technique for the detection of boronic acids and their derivatives Analytical Methods, 2012, 4, 2215 |
| 1514934 | CIF | C28 H24 | P 32 | 29.9106; 29.9106; 5.9714 90; 90; 120 | 4626.55 | Tseng, Nai-Wen; Liu, Jianzhao; Ng, Jason C. Y.; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Tang, Ben Zhong Deciphering mechanism of aggregation-induced emission (AIE): Is E–Z isomerisation involved in an AIE process? Chemical Science, 2012, 3, 493 |
| 1514935 | CIF | C13 H14 Fe N5 O | P -1 | 8.24; 9.982; 16.64 82.977; 83.088; 73.325 | 1296 | Patra, Ashis K.; Dube, Koustubh S.; Sanders, Brian C.; Papaefthymiou, Georgia C.; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C. A thermally stable {FeNO}8 complex: properties and biological reactivity of reduced MNO systems Chemical Science, 2012, 3, 364 |
| 1514936 | CIF | C13 H14 Co N5 O | P 1 21/n 1 | 10.445; 11.723; 11.03 90; 100.177; 90 | 1329.3 | Patra, Ashis K.; Dube, Koustubh S.; Sanders, Brian C.; Papaefthymiou, Georgia C.; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C. A thermally stable {FeNO}8 complex: properties and biological reactivity of reduced MNO systems Chemical Science, 2012, 3, 364 |
| 1514937 | CIF | C68 H63 Fe3 N9 | P -1 | 11.805; 12.98; 19.363 73.794; 86.132; 75.907 | 2763.3 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514938 | CIF | C68 H63 Fe3 N9 | P -1 | 11.839; 13.026; 19.436 73.818; 86.197; 75.893 | 2791.8 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514939 | CIF | C68 H63 Fe3 N9 | P -1 | 11.8394; 13.037; 19.508 73.852; 86.214; 75.811 | 2804 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514940 | CIF | C68 H63 Fe3 N9 | P -1 | 11.888; 13.106; 19.649 73.904; 86.251; 75.708 | 2850.3 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514941 | CIF | C68 H63 Fe3 N9 | P -1 | 11.881; 13.093; 19.706 73.971; 86.265; 75.654 | 2854.4 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514942 | CIF | C60 H74 Fe3 N6 O4.75 | C 1 2/c 1 | 21.1077; 15.5695; 33.842 90; 98.773; 90 | 10991.6 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514943 | CIF | C65 H69 Fe3 N6 P3 | P 1 21/c 1 | 12.403; 20.06; 22.036 90; 90; 90 | 5483 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514944 | CIF | C26 H25 F3 N2 O4 | P 21 21 21 | 8.6711; 9.4306; 29.5986 90; 90; 90 | 2420.39 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514945 | CIF | C31 H30 F3 N O6 S | P 1 21/c 1 | 11.9727; 24.2406; 10.481 90; 107.399; 90 | 2902.67 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514946 | CIF | C27 H27 F3 N2 O4 | P 1 21 1 | 10.8509; 9.3445; 12.7734 90; 107.297; 90 | 1236.6 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514947 | CIF | C32 H29 N O4 S | P 21 21 21 | 9.3165; 14.3322; 19.705 90; 90; 90 | 2631.13 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514948 | CIF | C44 H40 N4 Si | C 1 2/c 1 | 30.7917; 10.2374; 11.7082 90; 90.481; 90 | 3690.61 | Mei, Ju; Wang, Jian; Sun, Jing Zhi; Zhao, Hui; Yuan, Wangzhang; Deng, Chunmei; Chen, Shuming; Sung, Herman H. Y.; Lu, Ping; Qin, Anjun; Kwok, Hoi Sing; Ma, Yuguang; Williams, Ian D.; Tang, Ben Zhong Siloles symmetrically substituted on their 2,5-positions with electron-accepting and donating moieties: facile synthesis, aggregation-enhanced emission, solvatochromism, and device application Chemical Science, 2012, 3, 549 |
| 1514949 | CIF | C32 H26 O2 Si | P b c a | 21.7477; 13.4689; 35.5044 90; 90; 90 | 10399.9 | Mei, Ju; Wang, Jian; Sun, Jing Zhi; Zhao, Hui; Yuan, Wangzhang; Deng, Chunmei; Chen, Shuming; Sung, Herman H. Y.; Lu, Ping; Qin, Anjun; Kwok, Hoi Sing; Ma, Yuguang; Williams, Ian D.; Tang, Ben Zhong Siloles symmetrically substituted on their 2,5-positions with electron-accepting and donating moieties: facile synthesis, aggregation-enhanced emission, solvatochromism, and device application Chemical Science, 2012, 3, 549 |
| 1514950 | CIF | C54 H44 N2 Si | P 1 21/c 1 | 20.3587; 11.0369; 18.2729 90; 93.111; 90 | 4099.8 | Mei, Ju; Wang, Jian; Sun, Jing Zhi; Zhao, Hui; Yuan, Wangzhang; Deng, Chunmei; Chen, Shuming; Sung, Herman H. Y.; Lu, Ping; Qin, Anjun; Kwok, Hoi Sing; Ma, Yuguang; Williams, Ian D.; Tang, Ben Zhong Siloles symmetrically substituted on their 2,5-positions with electron-accepting and donating moieties: facile synthesis, aggregation-enhanced emission, solvatochromism, and device application Chemical Science, 2012, 3, 549 |
| 1514951 | CIF | C28 H42 F6 N O6 P | C 1 c 1 | 13.4798; 24.491; 11.104 90; 122.469; 90 | 3092.8 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514952 | CIF | C29 H44 F6 N O6 P | P 1 21/c 1 | 13.7552; 13.8563; 16.5085 90; 96.093; 90 | 3128.7 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514953 | CIF | C30 H46 F6 N O6 P | P 1 21/c 1 | 8.538; 33.09; 11.751 90; 97.9; 90 | 3288 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514954 | CIF | C30 H46 F6 N O7 P | P 1 21/c 1 | 8.702; 32.962; 11.4583 90; 93.616; 90 | 3280.1 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514955 | CIF | C29 H46 F6 N O6 P | P 1 21/c 1 | 15.9763; 13.6353; 15.3457 90; 104.633; 90 | 3234.5 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514956 | CIF | C30 H48 F6 N O7 P | P 1 21 1 | 8.3591; 33.576; 12.1989 90; 99.083; 90 | 3380.9 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514957 | CIF | C33 H16 O S4 | P -1 | 11.03; 12.159; 12.875 112.013; 104.449; 96.026 | 1511.8 | Isla, Helena; Grimm, Bruno; Pérez, Emilio M.; Rosario Torres, M.; Ángeles Herranz, M.; Viruela, Rafael; Aragó, Juan; Ortí, Enrique; M. Guldi, Dirk; Martín, Nazario Bowl-shape electron donors with absorptions in the visible range of the solar spectrum and their supramolecular assemblies with C60 Chemical Science, 2012, 3, 498 |
| 1514958 | CIF | C48 H46 Br2 N4 O2 | I 41/a c d :2 | 23.2637; 23.2637; 62.003 90; 90; 90 | 33556 | Nakamura, Shoichi; Hiroto, Satoru; Shinokubo, Hiroshi Synthesis and oxidation of cyclic tetraindole Chemical Science, 2012, 3, 524 |
| 1514959 | CIF | C54 H52 N4 O2 | I -4 c 2 | 17.198; 17.198; 15.807 90; 90; 90 | 4675 | Nakamura, Shoichi; Hiroto, Satoru; Shinokubo, Hiroshi Synthesis and oxidation of cyclic tetraindole Chemical Science, 2012, 3, 524 |
| 1514960 | CIF | C26 H30 B2 F8 Fe N10 O2 | I 41/a :2 | 13.7494; 13.7494; 35.336 90; 90; 90 | 6680.1 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514961 | CIF | C26 H26 B2 F8 Fe N10 | P 42/n :2 | 9.7481; 9.7481; 17.6848 90; 90; 90 | 1680.51 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514962 | CIF | C26 H26 B2 F8 Fe N10 | P 42/n :2 | 9.8046; 9.8046; 17.8869 90; 90; 90 | 1719.47 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514963 | CIF | C14 H17 N5 O | P 21 21 21 | 10.064; 11.6546; 12.3944 90; 90; 90 | 1453.76 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514964 | CIF | C13 H12 B F2 N3 | P -1 | 7.4169; 8.3781; 11.0339 70.296; 73.131; 71.441 | 598.943 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514965 | CIF | C13 H9 B F2 N4 | P 1 21/c 1 | 12.6822; 6.9729; 13.8314 90; 95.138; 90 | 1218.2 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514966 | CIF | C14 H12 B F2 N3 O | P 1 21/c 1 | 13.589; 11.4482; 8.7135 90; 105.519; 90 | 1306.1 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514967 | CIF | C15 H14 B F2 N3 O2 | P 1 21/c 1 | 14.589; 11.456; 8.6272 90; 90.271; 90 | 1441.9 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514968 | CIF | C17 H11 B F2 N4 | P -1 | 7.7978; 8.4159; 25.529 91.862; 95.446; 117.248 | 1477.3 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2‒hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514969 | CIF | C56 H48 Ag2 F12 N12 O4 P2 | P 1 2/c 1 | 14.883; 11.843; 19.893 90; 118.38; 90 | 3085 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514970 | CIF | C56 H48 Ag2 B Cl F4 N12 O4 | P 6 2 2 | 22.2009; 22.2009; 12.58554 90; 90; 120 | 5372.09 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514971 | CIF | C90 H84 Ag3 B3 F12 N18 O6 | P 63 | 17.3366; 17.3366; 18.9739 90; 90; 120 | 4938.73 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514972 | CIF | C90 H84 Ag3 B3 F12 N18 O6 | P 63 | 17.3399; 17.3399; 18.6738 90; 90; 120 | 4862.47 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514973 | CIF | C90 H84 Ag3 N18 O6 | P 63 | 17.2761; 17.2761; 18.7097 90; 90; 120 | 4836.03 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514974 | CIF | C90 H84 Au3 B3 F12 N18 O6 | P 63 | 17.4164; 17.4164; 18.8187 90; 90; 120 | 4943.53 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514975 | CIF | C71 H93 Ag3 Cl4 F12 N18 O8 P2 | P 1 | 12.6553; 13.0092; 15.1663 104.239; 112.9; 99.765 | 2128.75 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514976 | CIF | C16 H20 N2 O6 | P 21 21 21 | 7.95486; 10.00542; 20.80472 90; 90; 90 | 1655.88 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514977 | CIF | C18 H24 N2 O7 | P 21 21 21 | 5.5811; 12.5943; 26.723 90; 90; 90 | 1878.4 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514978 | CIF | C17 H22 N2 O6 | P 1 21 1 | 10.1928; 6.6518; 12.7044 90; 93.098; 90 | 860.11 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514979 | CIF | C18 H24 N2 O7 | P 1 21/c 1 | 12.8847; 5.6274; 25.767 90; 92.776; 90 | 1866.1 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514980 | CIF | C31 H28 Fe O6 Pt S4 | P 1 21/n 1 | 14.6379; 11.5625; 18.7162 90; 96.152; 90 | 3149.5 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514981 | CIF | C47 H60 Co O9.75 Pt S4 | I 1 2/a 1 | 22.814; 16.6711; 23.2989 90; 92.135; 90 | 8855.2 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514982 | CIF | C28 H22 Co O5 Pt S4 | P 1 c 1 | 11.3784; 11.822; 22.0722 90; 90.429; 90 | 2969 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514983 | CIF | C32.35 H29.7 Ni O6.09 Pt S4 | I -4 c 2 | 19.0697; 19.0697; 22.6005 90; 90; 90 | 8218.7 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514984 | CIF | C35 H41 B O7 | P -1 | 8.0671; 12.5459; 15.4229 83.045; 83.617; 81.899 | 1526.94 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514985 | CIF | C28 H35 N O7 Si | P 1 21 1 | 11.4194; 10.9563; 12.2162 90; 104.877; 90 | 1477.19 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514986 | CIF | C28 H35 N O7 Si | P 21 21 21 | 10.6948; 14.0253; 18.4358 90; 90; 90 | 2765.33 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514987 | CIF | C28 H36 O6 Si2 | P -1 | 10.3358; 10.7754; 13.7612 103.096; 100.398; 91.195 | 1465.19 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514988 | CIF | C29 H37 N O8 Si | P 21 21 21 | 10.1179; 13.7992; 21.5342 90; 90; 90 | 3006.58 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514989 | CIF | C38 H47 B O8 Sn | P -1 | 10.8449; 13.7385; 14.5994 78.148; 75.225; 70.556 | 1965.93 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514990 | CIF | C35 H39 B O8 | P 1 21/c 1 | 10.2127; 10.942; 28.6657 90; 98.392; 90 | 3169.02 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
| 1514991 | CIF | C37 H57 Ni P3 Si | P b c a | 16.1008; 16.9634; 25.931 90; 90; 90 | 7082.4 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514992 | CIF | C77.75 H75.75 B F24 N2 Ni P3 Si | C 1 2/c 1 | 47.534; 13.9003; 30.423 90; 128.63; 90 | 15703 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514993 | CIF | C70 H69 B F24 N Ni P3 Si | P 1 21/c 1 | 12.8286; 14.9103; 38.095 90; 96.779; 90 | 7235.8 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514994 | CIF | C69 H66 B Cl F24 Ni O P3 Si | P b c a | 26.3375; 19.5435; 27.2078 90; 90; 90 | 14004.6 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514995 | CIF | C36 H55 Cl Ni P3 Si | P -1 | 10.9905; 11.1304; 16.8144 78.237; 79.052; 61.648 | 1761.8 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514996 | CIF | C86 H54 B F24 N2 Ni P3 Si | P -1 | 13.2952; 15.4595; 20.2687 74.996; 84.981; 83.775 | 3992.6 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514997 | CIF | C87 H54 B F24 Ni O P3 Si | P -1 | 13.2892; 15.457; 20.2883 74.851; 85.107; 83.842 | 3992.3 | Tsay, Charlene; Peters, Jonas C. Thermally stable N2 and H2 adducts of cationic nickel(ii) Chemical Science, 2012, 3, 1313 |
| 1514998 | CIF | C37 H32 Cl2 N2 | C 1 2/c 1 | 28.982; 11.074; 9.7067 90; 101.66; 90 | 3051 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1514999 | CIF | C41 H35 Cl2 N2 | C 1 2/c 1 | 32.92; 11.005; 9.624 90; 106.563; 90 | 3342 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1515000 | CIF | C20 H14 N2 | P 1 21/n 1 | 10.7874; 6.1038; 11.5494 90; 104.177; 90 | 737.3 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1515001 | CIF | C32 H32 N4 O6 | P -1 | 6.2483; 7.152; 16.741 101.417; 91.557; 92.041 | 732.4 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1515002 | CIF | C24 H18 N2 | P 1 21/n 1 | 12.5981; 6.0734; 13.4724 90; 117.737; 90 | 912.37 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1515003 | CIF | C29 H23 Cl2 N2 | C 1 2/c 1 | 22.398; 11.1946; 9.7652 90; 95.645; 90 | 2436.6 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1515004 | CIF | C33 H28 Cl2 N2 | C 1 2/c 1 | 25.388; 11.126; 9.788 90; 94.187; 90 | 2757 | Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes Chemical Science, 2012, 3, 1007 |
| 1515005 | CIF | C44 H42 Cl3 N7 O7 | P 1 21/c 1 | 9.5229; 39.529; 11.6647 90; 98.282; 90 | 4345.2 | Engle, Jeffrey M.; Carroll, Calden N.; Johnson, Darren W.; Haley, Michael M. Synthesis and optoelectronic properties of 2,6-bis(2-anilinoethynyl)pyridine scaffolds Chemical Science, 2012, 3, 1105 |
| 1515006 | CIF | C72 H102 Nb2 O6 P4 | P 1 21/c 1 | 18.9443; 21.565; 17.9908 90; 99.909; 90 | 7240.2 | Velian, Alexandra; Cummins, Christopher C. Synthesis of a diniobium tetraphosphorus complex by a 2(3−1) process Chemical Science, 2012, 3, 1003 |
| 1515007 | CIF | C46 H78 Co3 I4 N4 O5 | P 1 21/c 1 | 11.79263; 21.62584; 22.16086 90; 102.592; 90 | 5515.64 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515008 | CIF | C46 H78 Br4 Co3 N4 O5 | P 1 21/c 1 | 11.69346; 20.8757; 22.0206 90; 102.034; 90 | 5257.3 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515009 | CIF | C75.5 H123 Cl20 Co4 K N8 O4 | P n m a | 23.2374; 30.6555; 14.1318 90; 90; 90 | 10066.8 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515010 | CIF | C76 H124 Cl21 Co4 K N8 O4 | P 1 21/c 1 | 11.78965; 31.1301; 27.4398 90; 96.1289; 90 | 10013.2 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515011 | CIF | C42 H74 Cl7 Co2 N5 O2 | P 1 21/n 1 | 14.4425; 21.581; 16.8129 90; 105.087; 90 | 5059.69 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515012 | CIF | C50 H86 Cl3 Co2 N6 O3 | P -1 | 12.4636; 15.6121; 15.8197 69.978; 71.369; 85.244 | 2739.42 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515013 | CIF | C42 H70 Cl3 Co2 N7 O2 | P 1 21/n 1 | 15.09; 20.2875; 15.702 90; 104.082; 90 | 4662.54 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515014 | CIF | C46 H76 Cl2 Co2 N6 O4 | P -1 | 11.3806; 13.8405; 15.7508 96.278; 96.347; 91.87 | 2448.45 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515015 | CIF | C45.5 H73 Cl11 Co2 N6 O2 | C 1 2/c 1 | 35.3728; 20.4934; 19.9836 90; 124.046; 90 | 12003.2 | Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K. Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism? Chemical Science, 2012, 3, 1245 |
| 1515016 | CIF | C24 H28 Cl8 I4 N8 O8 | P 42/n m c :2 | 18.1726; 18.1726; 7.0372 90; 90; 90 | 2323.99 | Raatikainen, Kari; Rissanen, Kari Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels Chemical Science, 2012, 3, 1235 |
| 1515017 | CIF | C23 H29 Cl3 I4 N8 O8 | C 1 2/c 1 | 26.3584; 7.034; 21.0654 90; 109.216; 90 | 3688.03 | Raatikainen, Kari; Rissanen, Kari Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels Chemical Science, 2012, 3, 1235 |
| 1515018 | CIF | C26 H36 Cl8 I4 N8 O8 | P 43 21 2 | 17.2587; 17.2587; 15.5855 90; 90; 90 | 4642.34 | Raatikainen, Kari; Rissanen, Kari Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels Chemical Science, 2012, 3, 1235 |
| 1515019 | CIF | C26 H40 I4 N12 O16 | I -4 c 2 | 16.8566; 16.8566; 14.5819 90; 90; 90 | 4143.37 | Raatikainen, Kari; Rissanen, Kari Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels Chemical Science, 2012, 3, 1235 |
| 1515020 | CIF | C29 H36 I4 N8 O8 | C 1 2/c 1 | 26.0769; 7.0625; 20.9842 90; 108.622; 90 | 3662.29 | Raatikainen, Kari; Rissanen, Kari Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels Chemical Science, 2012, 3, 1235 |
| 1515021 | CIF | C17 H15 Br F3 N O3 | P 1 21 1 | 9.0685; 9.5467; 10.5065 90; 107.563; 90 | 867.19 | Corbett, Michael T.; Xu, Qihai; Johnson, Jeffrey S. Trisubstituted 2-Trifluoromethyl Pyrrolidines via Catalytic Asymmetric Michael Addition/Reductive Cyclization. Organic letters, 2014, 16, 2362-2365 |
| 1515022 | CIF | C90 H77 N12 O7 U3 | P 1 21/n 1 | 16.7294; 16.6323; 29.5917 90; 90.954; 90 | 8232.7 | Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella Magnetic communication and reactivity of a stable homometallic cation–cation trimer of pentavalent uranyl Chemical Science, 2012, 3, 1075 |
| 1515023 | CIF | C29 H23 Cl3 N4 O2 U | P -1 | 7.2599; 12.1368; 16.1046 99.775; 90.893; 95.133 | 1392.11 | Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella Magnetic communication and reactivity of a stable homometallic cation‒cation trimer of pentavalent uranyl Chemical Science, 2012, 3, 1075 |
| 1515024 | CIF | C57.5 H44.25 N8.75 O5 U2 | C 1 2/c 1 | 27.1234; 27.366; 28.2322 90; 90.531; 90 | 20954.7 | Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella Magnetic communication and reactivity of a stable homometallic cation‒cation trimer of pentavalent uranyl Chemical Science, 2012, 3, 1075 |
| 1515025 | CIF | C52 H66 Cl2 Hg N O Sb | P 1 21/n 1 | 11.172; 34.082; 12.621 90; 99.244; 90 | 4743 | Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P. Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex Chemical Science, 2012, 3, 1128 |
| 1515026 | CIF | C57 H60 F6 Hg N6 O P Sb | C 1 c 1 | 18.171; 28.753; 13.422 90; 130.397; 90 | 5341 | Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P. Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex Chemical Science, 2012, 3, 1128 |
| 1515027 | CIF | C68 H52 F2 Hg2 O Sb2 | P -1 | 12.689; 13.651; 16.06 97.184; 95.058; 102.804 | 2672 | Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P. Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex Chemical Science, 2012, 3, 1128 |
| 1515028 | CIF | C38 H34 F6 Hg O1.5 P Sb | P 1 21/c 1 | 13.2206; 21.054; 13.5998 90; 118.154; 90 | 3337.6 | Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P. Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex Chemical Science, 2012, 3, 1128 |
| 1515029 | CIF | C18 H29 I N4 O Pd S2 | P -1 | 11.0114; 14.456; 15.04 86.364; 88.837; 84.021 | 2376 | Liu, Jing; Deng, Yi; Lin, Caitao; Lei, Aiwen “Push effect” of sulfur coordination: promoting the breaking of C(sp2)‒I bond by pincer thioimido-Pd(ii) complexes Chemical Science, 2012, 3, 1211 |
| 1515030 | CIF | C28 H33 N5 Pd S3 | P -1 | 9.4934; 12.8359; 12.9362 85.96; 70.27; 84.36 | 1475.5 | Liu, Jing; Deng, Yi; Lin, Caitao; Lei, Aiwen “Push effect” of sulfur coordination: promoting the breaking of C(sp2)‒I bond by pincer thioimido-Pd(ii) complexes Chemical Science, 2012, 3, 1211 |
| 1515031 | CIF | C88 H178 Cu5 Ga30 N23 S54 | P -1 | 22.414; 23.022; 23.782 95.8178; 116.725; 114.544 | 9322 | Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying Largest discrete supertetrahedral clusters synthesized in ionic liquids Chemical Science, 2012, 3, 1200 |
| 1515032 | CIF | C97.5 H192 Cl Cu5 Ga30 N24 S53.5 | P -1 | 22.168; 22.846; 24.663 115.174; 111.389; 96.407 | 9985 | Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying Largest discrete supertetrahedral clusters synthesized in ionic liquids Chemical Science, 2012, 3, 1200 |
| 1515033 | CIF | C108 H210 Cl2 Cu5 In30 N25 S54 | C 1 2/c 1 | 23.617; 40.808; 46.252 90; 94.748; 90 | 44423 | Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying Largest discrete supertetrahedral clusters synthesized in ionic liquids Chemical Science, 2012, 3, 1200 |
| 1515034 | CIF | C90 H186 Cu5 Ga30 N23 S56 | P 63/m | 23.018; 23.018; 42.321 90; 90; 120 | 19419 | Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying Largest discrete supertetrahedral clusters synthesized in ionic liquids Chemical Science, 2012, 3, 1200 |
| 1515035 | CIF | C42 H46 Fe N2 O9 | P 1 21/c 1 | 13.831; 16.175; 18.572 90; 111.6; 90 | 3863 | Evans, Nicholas H.; Rahman, Habibur; Leontiev, Alexandre V.; Greenham, Neil D.; Orlowski, Grzegorz A.; Zeng, Qiang; Jacobs, Robert M. J.; Serpell, Christopher J.; Kilah, Nathan L.; Davis, Jason J.; Beer, Paul D. Solution and surface-confined chloride anion templated redox-active ferrocene catenanes Chemical Science, 2012, 3, 1080 |
| 1515036 | CIF | C74 H84 Cl Fe N5 O17 | P -1 | 11.106; 17.783; 19.841 95.61; 100.94; 106.08 | 3649.6 | Evans, Nicholas H.; Rahman, Habibur; Leontiev, Alexandre V.; Greenham, Neil D.; Orlowski, Grzegorz A.; Zeng, Qiang; Jacobs, Robert M. J.; Serpell, Christopher J.; Kilah, Nathan L.; Davis, Jason J.; Beer, Paul D. Solution and surface-confined chloride anion templated redox-active ferrocene catenanes Chemical Science, 2012, 3, 1080 |
| 1515037 | CIF | C152 H172 Cl14 Fe2 N10 O34 | P -1 | 15.7014; 18.6485; 28.3126 98.202; 99.703; 102.308 | 7845.3 | Evans, Nicholas H.; Rahman, Habibur; Leontiev, Alexandre V.; Greenham, Neil D.; Orlowski, Grzegorz A.; Zeng, Qiang; Jacobs, Robert M. J.; Serpell, Christopher J.; Kilah, Nathan L.; Davis, Jason J.; Beer, Paul D. Solution and surface-confined chloride anion templated redox-active ferrocene catenanes Chemical Science, 2012, 3, 1080 |
| 1515038 | CIF | C76 H92 Cl Fe N5 O17 S2 | P 1 21/c 1 | 14.26; 39.5; 14.26 90; 95.55; 90 | 7994.6 | Evans, Nicholas H.; Rahman, Habibur; Leontiev, Alexandre V.; Greenham, Neil D.; Orlowski, Grzegorz A.; Zeng, Qiang; Jacobs, Robert M. J.; Serpell, Christopher J.; Kilah, Nathan L.; Davis, Jason J.; Beer, Paul D. Solution and surface-confined chloride anion templated redox-active ferrocene catenanes Chemical Science, 2012, 3, 1080 |
| 1515039 | CIF | C93 H117 F6 N7 O8 Pt2 S2 | P -1 | 19.5557; 20.1957; 30.683 99.204; 101.673; 95.081 | 11622.6 | Tanaka, Yuya; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian Phosphorescent molecular tweezers based on alkynylplatinum(ii) terpyridine system: turning on of NIR emission via heterologous Pt⋯M interactions (M = PtII, PdII, AuIII and AuI) Chemical Science, 2012, 3, 1185 |
| 1515040 | CIF | C69 H93 Cu2 Dy6 N11 O54 | P 1 21 1 | 11.2309; 23.8183; 20.3932 90; 102.308; 90 | 5329.8 | Novitchi, Ghenadie; Pilet, Guillaume; Ungur, Liviu; Moshchalkov, Victor V.; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Luneau, Dominique; Powell, Annie K. Heterometallic CuII/DyIII 1D chiral polymers: chirogenesis and exchange coupling of toroidal moments in trinuclear Dy3 single molecule magnets Chemical Science, 2012, 3, 1169 |
| 1515041 | CIF | C69 H93 Cu2 Gd6 N11 O54 | P 1 21 1 | 11.3478; 24.0164; 20.6607 90; 102.06; 90 | 5506.5 | Novitchi, Ghenadie; Pilet, Guillaume; Ungur, Liviu; Moshchalkov, Victor V.; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Luneau, Dominique; Powell, Annie K. Heterometallic CuII/DyIII 1D chiral polymers: chirogenesis and exchange coupling of toroidal moments in trinuclear Dy3 single molecule magnets Chemical Science, 2012, 3, 1169 |
| 1515042 | CIF | C69 H93 Cu2 Dy6 N11 O54 | P 1 21 1 | 11.259; 24.017; 20.506 90; 101.793; 90 | 5428 | Novitchi, Ghenadie; Pilet, Guillaume; Ungur, Liviu; Moshchalkov, Victor V.; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Luneau, Dominique; Powell, Annie K. Heterometallic CuII/DyIII 1D chiral polymers: chirogenesis and exchange coupling of toroidal moments in trinuclear Dy3 single molecule magnets Chemical Science, 2012, 3, 1169 |
| 1515043 | CIF | C69 H93 Cu2 N11 O54 Y6 | P 1 21 1 | 11.36; 24; 20.66 90; 101.988; 90 | 5509.9 | Novitchi, Ghenadie; Pilet, Guillaume; Ungur, Liviu; Moshchalkov, Victor V.; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Luneau, Dominique; Powell, Annie K. Heterometallic CuII/DyIII 1D chiral polymers: chirogenesis and exchange coupling of toroidal moments in trinuclear Dy3 single molecule magnets Chemical Science, 2012, 3, 1169 |
| 1515044 | CIF | C29 H26 Cl N3 O5 | P 21 21 21 | 9.5107; 10.1897; 27.7823 90; 90; 90 | 2692.4 | Zhong, Fangrui; Han, Xiaoyu; Wang, Youqing; Lu, Yixin Highly enantioselective [4 + 2] annulations catalyzed by amino acid-based phosphines: Synthesis of functionalized cyclohexenes and 3-spirocyclohexene-2-oxindoles Chemical Science, 2012, 3, 1231 |
| 1515045 | CIF | C21 H21 Br N2 O4 | C 1 2 1 | 21.316; 6.3205; 17.4926 90; 112.859; 90 | 2171.6 | Zhong, Fangrui; Han, Xiaoyu; Wang, Youqing; Lu, Yixin Highly enantioselective [4 + 2] annulations catalyzed by amino acid-based phosphines: Synthesis of functionalized cyclohexenes and 3-spirocyclohexene-2-oxindoles Chemical Science, 2012, 3, 1231 |
| 1515046 | CIF | C50 H28 Cr Dy2 F38 N5 O16 | C 1 2/c 1 | 26.3208; 15.7874; 18.718 90; 115.474; 90 | 7021.8 | Dreiser, Jan; Pedersen, Kasper S.; Piamonteze, Cinthia; Rusponi, Stefano; Salman, Zaher; Ali, Md. Ehesan; Schau-Magnussen, Magnus; Thuesen, Christian Aa.; Piligkos, Stergios; Weihe, Høgni; Mutka, Hannu; Waldmann, Oliver; Oppeneer, Peter; Bendix, Jesper; Nolting, Frithjof; Brune, Harald Direct observation of a ferri-to-ferromagnetic transition in a fluoride-bridged 3d‒4f molecular cluster Chemical Science, 2012, 3, 1024 |
| 1515047 | CIF | C40 H24 Cr Dy F26 N4 O8 | P -1 | 12.515; 19.836; 21.392 85.52; 81.35; 86.229 | 5226 | Dreiser, Jan; Pedersen, Kasper S.; Piamonteze, Cinthia; Rusponi, Stefano; Salman, Zaher; Ali, Md. Ehesan; Schau-Magnussen, Magnus; Thuesen, Christian Aa.; Piligkos, Stergios; Weihe, Høgni; Mutka, Hannu; Waldmann, Oliver; Oppeneer, Peter; Bendix, Jesper; Nolting, Frithjof; Brune, Harald Direct observation of a ferri-to-ferromagnetic transition in a fluoride-bridged 3d‒4f molecular cluster Chemical Science, 2012, 3, 1024 |
| 1515048 | CIF | C348 H354 Cl6 Co24 N6 O72 S24 | I a -3 | 48.8463; 48.8463; 48.8463 90; 90; 90 | 116545 | Xiong, Kecai; Jiang, Feilong; Gai, Yanli; Yuan, Daqiang; Chen, Lian; Wu, Mingyan; Su, Kongzhao; Hong, Maochun Truncated octahedral coordination cage incorporating six tetranuclear-metal building blocks and twelve linear edges Chemical Science, 2012, 3, 2321 |
| 1515049 | CIF | C74 H106 N4 O3 Y2 | P -1 | 12.5958; 15.8; 20.902 76.137; 76.659; 83.229 | 3921 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515050 | CIF | C81 H114 Lu2 N4 O3 | P -1 | 13.2117; 14.827; 23.057 81.78; 73.628; 66.103 | 3959.9 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515051 | CIF | C81 H123 N4 O4.5 Si Y2 | P 1 21/n 1 | 13.0663; 38.724; 15.781 90; 93.796; 90 | 7967 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515052 | CIF | C83 H115 N5 O3 Y2 | P 1 21/c 1 | 11.898; 23.121; 35.564 90; 90.028; 90 | 9783 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515053 | CIF | C88 H116 Lu2 N4 O3 | P -1 | 13.437; 14.939; 22.326 107.399; 102.549; 100.158 | 4031.9 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515054 | CIF | C84 H108 Lu2 N4 O2 | P -1 | 12.53; 16.733; 22.194 107.824; 103.291; 91.97 | 4284 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515055 | CIF | C80 H100 Lu2 N4 O | P -1 | 15.161; 17.449; 18.27 76.958; 76.864; 70.969 | 4388.8 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515056 | CIF | C86 H108 N4 O2 Y2 | P -1 | 13.731; 15.277; 22.821 97.855; 98.334; 99.894 | 4601.6 | Cheng, Jianhua; Wang, Haiyu; Nishiura, Masayoshi; Hou, Zhaomin Binuclear rare-earth polyhydride complexes bearing both terminal and bridging hydride ligands Chemical Science, 2012, 3, 2230 |
| 1515057 | CIF | C159 H0 Co5 O25 | P 1 21 1 | 19.3772; 34.3744; 20.7308 90; 115.432; 90 | 12470.3 | Wen, Liang; Cheng, Peng; Lin, Wenbin Mixed-motif interpenetration and cross-linking of high-connectivity networks led to robust and porous metal‒organic frameworks with high gas uptake capacities Chemical Science, 2012, 3, 2288 |
| 1515058 | CIF | C159 H O24 Zn4 | P 1 21 1 | 20.6536; 33.4974; 20.7926 90; 118.619; 90 | 12627.7 | Wen, Liang; Cheng, Peng; Lin, Wenbin Mixed-motif interpenetration and cross-linking of high-connectivity networks led to robust and porous metal‒organic frameworks with high gas uptake capacities Chemical Science, 2012, 3, 2288 |
| 1515059 | CIF | C10 H18 N2 O4 S | P 1 21/c 1 | 10.5431; 9.835; 12.1245 90; 92.891; 90 | 1255.6 | Chávez, Patricia; Kirsch, Jonathan; Hövelmann, Claas H.; Streuff, Jan; Martínez-Belmonte, Marta; Escudero-Adán, Eduardo C.; Martin, Eddy; Muñiz, Kilian Metal-free diamination of alkenes employing bromide catalysis Chemical Science, 2012, 3, 2375 |
| 1515060 | CIF | C19 H32 N2 O6 S | P 1 21/c 1 | 10.1825; 21.4793; 20.4614 90; 103.9; 90 | 4344.1 | Chávez, Patricia; Kirsch, Jonathan; Hövelmann, Claas H.; Streuff, Jan; Martínez-Belmonte, Marta; Escudero-Adán, Eduardo C.; Martin, Eddy; Muñiz, Kilian Metal-free diamination of alkenes employing bromide catalysis Chemical Science, 2012, 3, 2375 |
| 1515061 | CIF | C15 H20 N2 O4 S | P 1 21/n 1 | 5.8032; 20.518; 12.8411 90; 97.101; 90 | 1517.3 | Chávez, Patricia; Kirsch, Jonathan; Hövelmann, Claas H.; Streuff, Jan; Martínez-Belmonte, Marta; Escudero-Adán, Eduardo C.; Martin, Eddy; Muñiz, Kilian Metal-free diamination of alkenes employing bromide catalysis Chemical Science, 2012, 3, 2375 |
| 1515062 | CIF | C26 H26 N2 O4 S | P 1 21/c 1 | 6.5173; 21.874; 15.6036 90; 90.991; 90 | 2224.1 | Chávez, Patricia; Kirsch, Jonathan; Hövelmann, Claas H.; Streuff, Jan; Martínez-Belmonte, Marta; Escudero-Adán, Eduardo C.; Martin, Eddy; Muñiz, Kilian Metal-free diamination of alkenes employing bromide catalysis Chemical Science, 2012, 3, 2375 |
| 1515063 | CIF | C13 H22 N2 O4 S | P 1 21/c 1 | 13.355; 10.423; 11.32 90; 107.797; 90 | 1500.3 | Chávez, Patricia; Kirsch, Jonathan; Hövelmann, Claas H.; Streuff, Jan; Martínez-Belmonte, Marta; Escudero-Adán, Eduardo C.; Martin, Eddy; Muñiz, Kilian Metal-free diamination of alkenes employing bromide catalysis Chemical Science, 2012, 3, 2375 |
| 1515064 | CIF | C101.5 H146.5 O96 Pb14 | P 21 21 21 | 15.6077; 24.196; 38.766 90; 90; 90 | 14640 | Wei, Yanhui; Sun, Di; Yuan, Daqiang; Liu, Yongjun; Zhao, Yi; Li, Xiyou; Wang, Suna; Dou, Jianmin; Wang, Xingpo; Hao, Aiyou; Sun, Daofeng Pb(ii) metal‒organic nanotubes based on cyclodextrins: biphasic synthesis, structures and properties Chemical Science, 2012, 3, 2282 |
| 1515065 | CIF | C96 H128 O89 Pb16 | P 1 21 1 | 20.126; 18.866; 22.188 90; 94.783; 90 | 8395 | Wei, Yanhui; Sun, Di; Yuan, Daqiang; Liu, Yongjun; Zhao, Yi; Li, Xiyou; Wang, Suna; Dou, Jianmin; Wang, Xingpo; Hao, Aiyou; Sun, Daofeng Pb(ii) metal‒organic nanotubes based on cyclodextrins: biphasic synthesis, structures and properties Chemical Science, 2012, 3, 2282 |
| 1515066 | CIF | C22 H30 N4 O8 | P 1 21/c 1 | 9.58; 16.55; 7.69 90; 112.13; 90 | 1129.4 | Johnston, Priscilla; Braybrook, Carl; Saito, Kei Topochemical photo-reversible polymerization of a bioinspired monomer and its recovery and repolymerization after photo-depolymerization Chemical Science, 2012, 3, 2301 |
| 1515067 | CIF | C24 H36 N4 O9 | C 1 2/c 1 | 22.4706; 9.36; 16.0501 90; 131.959; 90 | 2510.3 | Johnston, Priscilla; Braybrook, Carl; Saito, Kei Topochemical photo-reversible polymerization of a bioinspired monomer and its recovery and repolymerization after photo-depolymerization Chemical Science, 2012, 3, 2301 |
| 1515068 | CIF | C20 H30 N6 O7 | P 42/n :2 | 22.26; 22.26; 4.77 90; 90; 90 | 2363.6 | Johnston, Priscilla; Braybrook, Carl; Saito, Kei Topochemical photo-reversible polymerization of a bioinspired monomer and its recovery and repolymerization after photo-depolymerization Chemical Science, 2012, 3, 2301 |
| 1515069 | CIF | C84 H94 O12 | P 21 21 21 | 9.824; 20.306; 36.358 90; 90; 90 | 7253 | Ishii, Yuuki; Nakanishi, Yusuke; Omachi, Haruka; Matsuura, Sanae; Matsui, Katsuma; Shinohara, Hisanori; Segawa, Yasutomo; Itami, Kenichiro Size-selective synthesis of [9]–[11] and [13]cycloparaphenylenes Chemical Science, 2012, 3, 2340 |
| 1515070 | CIF | C35.5 H31 Co N3 O9.5 | P 1 21/c 1 | 12.565; 29.618; 9.858 90; 105.695; 90 | 3531.9 | Yang, Wenbin; Davies, Andrew J.; Lin, Xiang; Suyetin, Mikhail; Matsuda, Ryotaro; Blake, Alexander J.; Wilson, Claire; Lewis, William; Parker, Julia E.; Tang, Chiu C.; George, Michael W.; Hubberstey, Peter; Kitagawa, Susumu; Sakamoto, Hirotoshi; Bichoutskaia, Elena; Champness, Neil R.; Yang, Sihai; Schröder, Martin Selective CO2 uptake and inverse CO2/C2H2 selectivity in a dynamic bifunctional metal‒organic framework Chemical Science, 2012, 3, 2993 |
| 1515071 | CIF | C72 H66 Co2 N10 O18 | P -1 | 10.09; 16.362; 24.453 106.75; 92.97; 103.16 | 3734.2 | Yang, Wenbin; Davies, Andrew J.; Lin, Xiang; Suyetin, Mikhail; Matsuda, Ryotaro; Blake, Alexander J.; Wilson, Claire; Lewis, William; Parker, Julia E.; Tang, Chiu C.; George, Michael W.; Hubberstey, Peter; Kitagawa, Susumu; Sakamoto, Hirotoshi; Bichoutskaia, Elena; Champness, Neil R.; Yang, Sihai; Schröder, Martin Selective CO2 uptake and inverse CO2/C2H2 selectivity in a dynamic bifunctional metal‒organic framework Chemical Science, 2012, 3, 2993 |
| 1515072 | CIF | C28 H26 O4 | P 1 21/n 1 | 13.83; 8.0116; 21.166 90; 104.203; 90 | 2273.5 | Meng, Wei; Zhao, Hai-Tao; Nie, Jing; Zheng, Yan; Fu, Aiping; Ma, Jun-An Allenoate-derived 1,5-, 1,7-, and 1,9-zwitterions as highly versatile coupling-partners for phosphine-triggered cycloaddition reactions Chemical Science, 2012, 3, 3053 |
| 1515073 | CIF | C22 H25 N3 O7 | C 1 c 1 | 15.778; 16.681; 8.324 90; 95.55; 90 | 2180.5 | Meng, Wei; Zhao, Hai-Tao; Nie, Jing; Zheng, Yan; Fu, Aiping; Ma, Jun-An Allenoate-derived 1,5-, 1,7-, and 1,9-zwitterions as highly versatile coupling-partners for phosphine-triggered cycloaddition reactions Chemical Science, 2012, 3, 3053 |
| 1515074 | CIF | C48 H32 | P 1 21/n 1 | 12.9325; 8.0103; 19.3676 90; 105.363; 90 | 1934.66 | Xia, Jianlong; Bacon, Jeffrey W.; Jasti, Ramesh Gram-scale synthesis and crystal structures of [8]- and [10]CPP, and the solid-state structure of C60@[10]CPP Chemical Science, 2012, 3, 3018 |
| 1515075 | CIF | C60 H40 | P 1 21/c 1 | 15.9075; 8.1405; 20.7418 90; 108.655; 90 | 2544.84 | Xia, Jianlong; Bacon, Jeffrey W.; Jasti, Ramesh Gram-scale synthesis and crystal structures of [8]- and [10]CPP, and the solid-state structure of C60@[10]CPP Chemical Science, 2012, 3, 3018 |
| 1515076 | CIF | C120 H40 | P -1 | 12.8737; 19.0556; 27.2224 69.54; 79.038; 79.051 | 6087.1 | Xia, Jianlong; Bacon, Jeffrey W.; Jasti, Ramesh Gram-scale synthesis and crystal structures of [8]- and [10]CPP, and the solid-state structure of C60@[10]CPP Chemical Science, 2012, 3, 3018 |
| 1515077 | CIF | C81 H28 Cu2 O18 | P b a n :2 | 28.532; 33.426; 16.0881 90; 90; 90 | 15343 | Liu, Demin; Wu, Haohan; Wang, Shunzhi; Xie, Zhigang; Li, Jing; Lin, Wenbin A high connectivity metal‒organic framework with exceptional hydrogen and methane uptake capacities Chemical Science, 2012, 3, 3032 |
| 1515078 | CIF | C34.71 H20 O8 Zn1.71 | I -4 2 d | 36.3615; 36.3615; 34.7679 90; 90; 90 | 45968.7 | Liu, Demin; Wu, Haohan; Wang, Shunzhi; Xie, Zhigang; Li, Jing; Lin, Wenbin A high connectivity metal‒organic framework with exceptional hydrogen and methane uptake capacities Chemical Science, 2012, 3, 3032 |
| 1515079 | CIF | C42 H74 I2 Mn2 O2 | P -1 | 9.232; 9.9138; 13.3547 105.125; 102.783; 100.418 | 1113.14 | Maekawa, Miyuki; Römelt, Michael; Daniliuc, Constantin G.; Jones, Peter G.; White, Peter S.; Neese, Frank; Walter, Marc D. Reactivity studies on [Cp′MnX(thf)]2: manganese amide and polyhydride synthesis Chemical Science, 2012, 3, 2972 |
| 1515080 | CIF | C78 H146 Mn5 | C 1 2/c 1 | 27.5131; 12.7588; 25.2896 90; 114.339; 90 | 8088.5 | Maekawa, Miyuki; Römelt, Michael; Daniliuc, Constantin G.; Jones, Peter G.; White, Peter S.; Neese, Frank; Walter, Marc D. Reactivity studies on [Cp′MnX(thf)]2: manganese amide and polyhydride synthesis Chemical Science, 2012, 3, 2972 |
| 1515081 | CIF | C78 H146 Mn5 | C 1 2/c 1 | 27.484; 12.7411; 25.273 90; 114.331; 90 | 8064 | Maekawa, Miyuki; Römelt, Michael; Daniliuc, Constantin G.; Jones, Peter G.; White, Peter S.; Neese, Frank; Walter, Marc D. Reactivity studies on [Cp′MnX(thf)]2: manganese amide and polyhydride synthesis Chemical Science, 2012, 3, 2972 |
| 1515082 | CIF | C26.5 H22 Cl3 N O3 | P 1 21 1 | 10.149; 11.5785; 19.7361 90; 93.295; 90 | 2315.36 | Gómez-Bengoa, Enrique; Jiménez, Jacqueline; Lapuerta, Irati; Mielgo, Antonia; Oiarbide, Mikel; Otazo, Itziar; Velilla, Irene; Vera, Silvia; Palomo, Claudio Combined α,α-dialkylprolinol ether/Brønsted acid promotes Mannich reactions of aldehydes with unactivated imines. An entry to anti-configured propargylic amino alcohols Chemical Science, 2012, 3, 2949 |
| 1515083 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.8946; 5.9692; 10.8812 90; 92.454; 90 | 512.3 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 1515084 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.8401; 5.9549; 10.8935 90; 92.556; 90 | 508.08 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
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