Crystallography Open Database
Search results
Result: there are 20209 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching year of publication is 2019
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1550367 | CIF | C280 H132 Eu2 N12 Ni3 | C 1 2/m 1 | 24.307; 18.191; 22.087 90; 100.995; 90 | 9587 | Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science, 2019 |
| 1550368 | CIF | C130.05 H53.66 Eu N4 Ni S0.78 | C 1 2/m 1 | 25.3346; 15.1339; 19.9751 90; 95.659; 90 | 7621.4 | Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science, 2019 |
| 1550369 | CIF | C132 H56 Eu N4 Ni | C 1 2/m 1 | 25.386; 15.123; 19.953 90; 95.2; 90 | 7629 | Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science, 2019 |
| 1550370 | CIF Paper | C4 H9 Co N O6 | P n m a | 8.2674; 11.66; 8.1483 90; 90; 90 | 785.48 | Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ, 2019, 6, 105-115 |
| 1550371 | CIF Paper | C4 H9 Co N O6 | P n m a | 8.2556; 11.6519; 8.1508 90; 90; 90 | 784.05 | Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ, 2019, 6, 105-115 |
| 1550372 | CIF Paper | C4 H9 Co N O6 | P n m a | 8.2702; 11.6766; 8.1631 90; 90; 90 | 788.29 | Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ, 2019, 6, 105-115 |
| 1550373 | CIF Paper | C4 H9 Co N O6 | P n m a | 8.2548; 11.6547; 8.1521 90; 90; 90 | 784.29 | Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ, 2019, 6, 105-115 |
| 1550375 | CIF | C77 H51.5 Cl6 S5 | C 1 2/c 1 | 21.7713; 21.459; 27.4874 90; 92.893; 90 | 12825.5 | Lin, Hsing-An; Kato, Kenta; Segawa, Yasutomo; Scott, Lawrence T.; Itami, Kenichiro Synthesis and Structural Features of Thiophene-fused Analogues of Warped Nanographene and Quintuple Helicene Chemical Science, 2019 |
| 1550376 | CIF | C24 H22 O | P -1 | 8.4646; 10.2366; 11.8274 77.022; 69.293; 74.924 | 915.6 | Zhang, Yuchen; Wu, Wangteng; Fu, Chunling; Huang, Xin; Ma, Shengming Benzene Construction via Pd-catalyzed Cyclization of 2,7-Alkadiynylic Carbonates in the Presence of Alkynes Chemical Science, 2019 |
| 1550377 | CIF | C24 H22 O2 | P 1 21/n 1 | 6.8864; 33.272; 8.5011 90; 104.932; 90 | 1882 | Zhang, Yuchen; Wu, Wangteng; Fu, Chunling; Huang, Xin; Ma, Shengming Benzene Construction via Pd-catalyzed Cyclization of 2,7-Alkadiynylic Carbonates in the Presence of Alkynes Chemical Science, 2019 |
| 1550378 | CIF | C27 H23 N O2 | P b c a | 37.682; 6.9971; 15.2009 90; 90; 90 | 4007.9 | Zhang, Yuchen; Wu, Wangteng; Fu, Chunling; Huang, Xin; Ma, Shengming Benzene Construction via Pd-catalyzed Cyclization of 2,7-Alkadiynylic Carbonates in the Presence of Alkynes Chemical Science, 2019 |
| 1550379 | CIF | C21 H24 O4 | P 21 21 21 | 6.2996; 14.6723; 19.1704 90; 90; 90 | 1771.9 | Gupta, Saswata; Lin, Yongjia; Xia, Yuanzhi; Wink, Donald; Lee, Daesung Alder-Ene Reactions Driven by High Steric Strain and Bond Angle Distortion to Form Benzocyclobutenes Chemical Science, 2019 |
| 1550380 | CIF | C42 H30 O14 Ti3 | R -3 m | 25.8366; 25.8366; 13.6675 90; 90; 120 | 7901.2 | Feng, Xuanyu; Song, Yang; Chen, Justin S.; Li, Zhe; Chen, Emily Y.; Kaufmann, Michael; Wang, Cheng; Lin, Wenbin Cobalt-Bridged Secondary Building Units in a Titanium Metal-Organic Framework Catalyze Cascade Reduction of N-Heteroarenes Chemical Science, 2019 |
| 1550381 | CIF | C78.74 H94.11 Cl4 N9.37 O6 P2 | P 1 21/n 1 | 13.8833; 29.9782; 18.874 90; 93.677; 90 | 7839.1 | Peñuelas-Haro, Guillem; Ballester, Pablo Efficient Hydrogen Bonding Recognition in Water using Aryl-extended Calix[4]pyrrole Receptors Chemical Science, 2019 |
| 1550382 | CIF | C74 H87 Cl4 N7 O6 P2 | I 41 m d | 19.6411; 19.6411; 18.4185 90; 90; 90 | 7105.4 | Peñuelas-Haro, Guillem; Ballester, Pablo Efficient Hydrogen Bonding Recognition in Water using Aryl-extended Calix[4]pyrrole Receptors Chemical Science, 2019 |
| 1550383 | CIF | Al2 Eu4 F2 O8 | P 1 21/c 1 | 7.5885; 10.8399; 11.0776 90; 108.788; 90 | 862.67 | Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure IUCrJ, 2019, 6, 128-135 |
| 1550384 | CIF | Al2 F2 O8 Sm4 | P 1 21/c 1 | 7.6188; 10.8705; 11.1077 90; 108.805; 90 | 870.84 | Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure IUCrJ, 2019, 6, 128-135 |
| 1550400 | CIF | C55 H66 Cl2 N4 Ru | P -1 | 10.9047; 11.6314; 19.7689 95.343; 101.998; 100.664 | 2387.6 | Dumas, Adrien; Colombel-Rouen, Sophie; Curbet, Idriss; Forcher, Gwénael; Tripoteau, Fabien; Caijo, Frédéric; Queval, Pierre; Rouen, Mathieu; Baslé, Olivier; Mauduit, Marc Highly selective macrocyclic ring-closing metathesis of terminal olefins in non-chlorinated solvents at low dilution Catalysis Science & Technology, 2019 |
| 1550401 | CIF | C77 H66 Cl2 N10 O12 | P -1 | 13.861; 15.962; 17.258 69.871; 75.157; 81.221 | 3457 | Chen, Huaiyu; Huang, Chao; Ding, Yazhou; Zhang, Qi-Long; Zhu, Bi-Xue; Ni, Xin-Long Organic core‒shell-shaped micro/nanoparticles from twisted macrocycles in Schiff base reaction Chemical Science, 2019, 10, 490 |
| 1550402 | CIF | C15 H12 O4 | P 1 21/n 1 | 7.804; 11.72; 13.252 90; 94.565; 90 | 1208.2 | Chen, Huaiyu; Huang, Chao; Ding, Yazhou; Zhang, Qi-Long; Zhu, Bi-Xue; Ni, Xin-Long Organic core–shell-shaped micro/nanoparticles from twisted macrocycles in Schiff base reaction Chemical Science, 2019, 10, 490 |
| 1550403 | CIF | C32 H47 Al N2 | P 1 21/c 1 | 10.5476; 13.0639; 22.5422 90; 99.217; 90 | 3066 | Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science, 2019 |
| 1550404 | CIF | C38.5 H57 Al N2 | C 1 2/c 1 | 19.4468; 18.4781; 20.5105 90; 102.346; 90 | 7199.8 | Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science, 2019 |
| 1550405 | CIF | C39 H53 Al N2 O | P 1 21/n 1 | 12.3296; 16.8397; 17.7035 90; 106.384; 90 | 3526.5 | Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science, 2019 |
| 1550406 | CIF | C31 H45 Al N2 | P 1 21/n 1 | 12.3658; 17.1209; 14.023 90; 104.507; 90 | 2874.2 | Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science, 2019 |
| 1550407 | CIF | C38 H50 Al N2 | P 21 21 21 | 11.227; 14.6841; 21.0838 90; 90; 90 | 3475.8 | Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science, 2019 |
| 1550408 | CIF | C62 H90 Al2 N4 | C 1 2/c 1 | 24.6053; 15.38681; 14.82658 90; 96.6729; 90 | 5575.27 | Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science, 2019 |
| 1550409 | CIF | C48 H36 Cu F12 N8 O14.13 S4 | P -1 | 16.1504; 16.2726; 17.8745 99.297; 112.765; 102.854 | 4059.7 | Liu, Yanju; Han, Yongzhen; Zhang, Zongyao; Zhang, Wei; Lai, Wenzhen; Wang, Yong; Cao, Rui Low overpotential water oxidation at neutral pH catalyzed by a copper(II) porphyrin Chemical Science, 2019 |
| 1550410 | CIF | C35 H21 Al2 F55 O6 Si | P -1 | 10.4039; 12.682; 21.4037 88.235; 80.175; 82.373 | 2757.92 | Martens, Arthur; Kreuzer, Marvin; Ripp, Alexander Johannes Christoph; Schneider, Marius; Himmel, Daniel; Scherer, Harald; Krossing, Ingo Investigations on Non-Classical Silylium Ions Leading to a Cyclobutenyl Cation Chemical Science, 2019 |
| 1550411 | CIF | C30 H31 Al F28 N2 O3 Si | P -1 | 9.4236; 10.9684; 20.6676 78.207; 88.952; 83.352 | 2077.06 | Martens, Arthur; Kreuzer, Marvin; Ripp, Alexander Johannes Christoph; Schneider, Marius; Himmel, Daniel; Scherer, Harald; Krossing, Ingo Investigations on Non-Classical Silylium Ions Leading to a Cyclobutenyl Cation Chemical Science, 2019 |
| 1550412 | CIF | C19 H10 Al F27 N2 O3 | P 1 21/c 1 | 12.2182; 11.395; 21.1752 90; 105.383; 90 | 2842.5 | Martens, Arthur; Kreuzer, Marvin; Ripp, Alexander Johannes Christoph; Schneider, Marius; Himmel, Daniel; Scherer, Harald; Krossing, Ingo Investigations on Non-Classical Silylium Ions Leading to a Cyclobutenyl Cation Chemical Science, 2019 |
| 1550413 | CIF | C24 H22 F N O4 | P 1 21 1 | 15.3747; 7.2401; 18.684 90; 102.066; 90 | 2033.85 | Royal, Titouan; Baudoin, Olivier Pd-catalyzed γ-arylation of γ,δ-unsaturated O-carbamates via an unusual haptotropic rearrangement Chemical Science, 2019 |
| 1550414 | CIF | C24 H22 F N O4 | P 1 21 1 | 15.3844; 7.2248; 18.6689 90; 102.133; 90 | 2028.68 | Royal, Titouan; Baudoin, Olivier Pd-catalyzed γ-arylation of γ,δ-unsaturated O-carbamates via an unusual haptotropic rearrangement Chemical Science, 2019 |
| 1550415 | CIF | C39 H32 Br2 N4 O | P c c n | 18.5184; 19.9443; 9.0043 90; 90; 90 | 3325.6 | Sindt, Ammon J.; DeHaven, Baillie A.; McEachern, David F.; Dissanayake, Madushanka M.; Smith, Mark D.; Vannucci, Aaron K.; Shimizu, Linda S. UV-irradiation of self-assembled triphenylamines affords persistent and regenerable radicals Chemical Science, 2019 |
| 1550416 | CIF | C79 H106 N18 O14 P | P n a 21 | 20.4627; 15.7895; 25.0638 90; 90; 90 | 8098 | Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science, 2019 |
| 1550417 | CIF | C142 H157 N32 O20 P2 | P -1 | 15.948; 16.487; 16.568 98.9391; 95.3315; 117.154 | 3762 | Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science, 2019 |
| 1550418 | CIF | C142 H201 N36 O33 P2 | P 1 21/n 1 | 22.7938; 18.9289; 23.1163 90; 119.257; 90 | 8701.5 | Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science, 2019 |
| 1550419 | CIF | C27 H20 Cl2 O3 | P 21 21 21 | 7.6102; 10.7051; 27.326 90; 90; 90 | 2226.2 | Yao, Lu; Ishihara, Kazuaki Enantioselecive [1,3] O-to-C rearrangement: Dearomatization of alkyl 2-allyloxy/benzyloxy-1/3-naphthoates catalyzed by a chiral π–Cu(II) complex Chemical Science, 2019 |
| 1550420 | CIF | C50 H64 Cu F6 N4 O8 S2 | P 21 21 21 | 14.293; 16.823; 21.7 90; 90; 90 | 5217.8 | Yao, Lu; Ishihara, Kazuaki Enantioselecive [1,3] O-to-C rearrangement: Dearomatization of alkyl 2-allyloxy/benzyloxy-1/3-naphthoates catalyzed by a chiral π–Cu(II) complex Chemical Science, 2019 |
| 1550421 | CIF | C50 H46 N6 O6 | P 1 21/c 1 | 16.393; 12.1248; 20.3969 90; 96.964; 90 | 4024.22 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550422 | CIF | C66 H52 Cl12 N8 O6 | P -1 | 10.6274; 12.6722; 13.0666 76.113; 81.646; 68.89 | 1590.27 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550423 | CIF | C60 H46 N8 O7 | P 1 | 9.1177; 10.6349; 13.6347 84.797; 86.884; 73.337 | 1260.8 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550424 | CIF | C62 H50 Cl8 N8 O6 | P -1 | 9.5459; 10.8943; 14.704 77.534; 84.269; 68.203 | 1386.03 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550425 | CIF | C62 H46 Cl8 N8 O5 | P n a 21 | 34.5017; 10.56728; 14.7887 90; 90; 90 | 5391.8 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550426 | CIF | C66 H50 Cl16 N8 O6 | P -1 | 10.5616; 23.6815; 27.6022 94.092; 92.874; 92.603 | 6869.1 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550427 | CIF | C134 H110 Cl24 N16 O17 | P -1 | 10.653; 12.928; 51.06 92.18; 90.93; 111.37 | 6540 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
| 1550428 | CIF | C29 H21 B Cl F10 N | P -1 | 10.2284; 11.0264; 12.5397 88.589; 80.364; 79.511 | 1371 | Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science, 2019 |
| 1550429 | CIF | C29 H21 B Br F10 N | P -1 | 10.2011; 11.0143; 12.5252 88.743; 80.865; 79.649 | 1366.81 | Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science, 2019 |
| 1550430 | CIF | C36 H42 B F10 P | P -1 | 9.9507; 11.7835; 16.007 71.517; 86.117; 70.299 | 1674.26 | Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science, 2019 |
| 1550431 | CIF | C27.5 H43 Cl | P -1 | 10.8108; 12.1099; 19.1989 76.703; 75.176; 87.966 | 2363.95 | Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science, 2019 |
| 1550432 | CIF | C65.56 H77.12 B2 Cl7.12 F8 N2 O8.38 P4 Pd0.98 | C 1 2/c 1 | 24.9341; 15.1575; 22.1525 90; 114.583; 90 | 7613.4 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550433 | CIF | C35 H30 Cl3 F6 N O4.4 P3 Pd | P 1 21/n 1 | 12.3522; 26.1118; 13.6448 90; 113.138; 90 | 4046.96 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550434 | CIF | C33 H38 Cl2 N2 O4 P2 Pd | P 1 21/n 1 | 12.9976; 18.6574; 14.6755 90; 105.169; 90 | 3434.83 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550435 | CIF | C35 H41 Cl8 N Ni O4 P2 | P 1 21/c 1 | 11.7989; 15.5485; 23.5593 90; 101.232; 90 | 4239.29 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550436 | CIF | C33 H38 Cl2 N2 Ni O4 P2 | P 1 21/n 1 | 12.8814; 18.6698; 14.5746 90; 105.006; 90 | 3385.56 | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions, 2019, 215, 141-161 |
| 1550437 | CIF | C26 H18 La N9 O9 | P 1 21/n 1 | 9.1366; 14.1095; 20.9641 90; 90.052; 90 | 2702.54 | Gajarushi, Ashwini S.; Wasim, Mohd; Nabi, Rizwan; Kancharlapalli, Srinivasu; Rao, V. Ramgopal; Rajaraman, Gopalan; Subramaniam, Chandramouli; Shanmugam, Maheswaran Lanthanide complexes as molecular dopants for realizing air-stable n-type graphene logic inverters with symmetric transconductance Materials Horizons, 2019, 6, 743 |
| 1550438 | CIF | C26 H18 Ce N9 O9 | C 1 2/c 1 | 15.0921; 10.8118; 19.5232 90; 118.32; 90 | 2804.4 | Gajarushi, Ashwini S.; Wasim, Mohd; Nabi, Rizwan; Kancharlapalli, Srinivasu; Rao, V. Ramgopal; Rajaraman, Gopalan; Subramaniam, Chandramouli; Shanmugam, Maheswaran Lanthanide complexes as molecular dopants for realizing air-stable n-type graphene logic inverters with symmetric transconductance Materials Horizons, 2019, 6, 743 |
| 1550439 | CIF | C16 H26 | P 1 21/n 1 | 14.3334; 5.56223; 8.53021 90; 92.0219; 90 | 679.65 | van de Streek, Jacco; Alig, Edith; Parsons, Simon; Vella-Zarb, Liana A jumping crystal predicted with molecular dynamics and analysed with TLS refinement against powder diffraction data IUCrJ, 2019, 6, 136-144 |
| 1550440 | CIF | C7 H15 Cl N2 O | P 1 21 1 | 7.2588; 8.9399; 22.7927 90; 95.818; 90 | 1471.47 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550441 | CIF | C7 H15 I N2 O | P b c a | 13.4725; 9.8551; 32.7259 90; 90; 90 | 4345.11 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550442 | CIF | C7 H15 Cl N2 O | P 1 21 1 | 7.2902; 8.9099; 7.8789 90; 107.024; 90 | 489.35 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550443 | CIF | C7 H15 Br N2 O | P 1 21 1 | 7.5269; 9.1017; 7.93 90; 107.161; 90 | 519.08 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550444 | CIF | C7 H15 I N2 O | P 21 21 21 | 7.585; 10.8242; 13.0468 90; 90; 90 | 1071.16 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550445 | CIF | C14 H30 B Cl F4 N4 O2 | P 21 21 21 | 9.4006; 13.2619; 16.6581 90; 90; 90 | 2076.76 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550446 | CIF | C22 H27 Br N2 O4 S | P 21 21 21 | 6.106; 9.0317; 42.33 90; 90; 90 | 2334.4 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550447 | CIF | C22 H27 I N2 O4 S | P 21 21 21 | 6.2219; 9.0228; 43.0569 90; 90; 90 | 2417.17 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550448 | CIF | C22 H27 N3 O7 S | P 21 21 21 | 6.3765; 8.8174; 42.942 90; 90; 90 | 2414.38 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550449 | CIF | C22 H32 N2 O9.5 P S | P 1 | 8.7929; 12.6645; 23.7867 82.3345; 81.4117; 89.9824 | 2595.2 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550450 | CIF | C15 H24 N2 O5 | P 1 21 1 | 11.47377; 6.14747; 11.71348 90; 111.978; 90 | 766.164 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550451 | CIF | C19 H23 Cl N6 O4 | P 1 21/c 1 | 12.6065; 13.0726; 12.6694 90; 106.397; 90 | 2003 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550452 | CIF | C20 H23 Cl N6 O S | P -1 | 12.1482; 13.1848; 13.8251 90.263; 90.218; 108.005 | 2105.9 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550453 | CIF | C19 H23 B Cl F4 N5 O | P 1 21/c 1 | 12.46473; 12.98315; 13.42014 90; 106.765; 90 | 2079.49 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550454 | CIF | C16 H21 N O4 S | P 1 21 1 | 5.72587; 20.83882; 6.92054 90; 98.3547; 90 | 816.998 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550455 | CIF | C24 H38 N2 O8 | P 1 | 5.8213; 7.27088; 15.90214 94.7215; 96.6693; 109.525 | 624.781 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550456 | CIF | C24 H38 N2 O9 | P 1 21 1 | 6.07189; 32.9414; 7.1383 90; 114.168; 90 | 1302.63 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550457 | CIF | C10 H16 N2 O4 | P 1 21 1 | 6.0401; 29.3553; 7.3828 90; 112.806; 90 | 1206.7 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
| 1550458 | CIF HKL Paper | C25 H24 Cl4 N2 P2 Pd | P 1 21/n 1 | 11.7085; 16.9319; 15.2399 90; 105.324; 90 | 2913.85 | Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe Dichlorido[1,1-(diphenylphosphino)hydrazide]palladium(II) dichloromethane monosolvate IUCrData, 2019, 4, x181803 |
| 1550459 | CIF HKL Paper | C12 H14 Cl N O3 | P 1 21/c 1 | 5.7323; 9.2537; 21.6899 90; 91.168; 90 | 1150.3 | Rodriguez-Vega, Gibran; Aguirre, Gerardo; Chávez, Daniel Ethyl 4-chloro-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylate IUCrData, 2019, 4, x190016 |
| 1550460 | CIF HKL Paper | C20 H21 N5 O | P 1 2/n 1 | 12.241; 5.9386; 25.2112 90; 90.317; 90 | 1832.69 | Slassi, Siham; Stetsiuk, Oleh; Amine, Amina; Aarjane, Mohammed; El-Ghayoury, Abdelkrim; Zouihri, Hafid; Yamni, Khalid 2-[(<i>E</i>)-{[3-(1<i>H</i>-Imidazol-1-yl)propyl]imino}methyl]-4-[(<i>E</i>)-(4-methylphenyl)diazenyl]phenol IUCrData, 2019, 4, x190036 |
| 1550461 | CIF HKL Paper | C17 H14 O2 | P 1 21/n 1 | 9.0801; 15.4598; 10.092 90; 109.453; 90 | 1335.81 | Pineda, Leslie W.; Amey, Adam; Cabezas, Jorge A. 5,5-Diphenyl-<i>cis</i>-penta-2,4-dienoic acid IUCrData, 2019, 4, x181799 |
| 1550462 | CIF HKL | C52 H50 Cl2 N4 O7 | P 1 21/n 1 | 13.702; 11.349; 28.538 90; 92.999; 90 | 4431.7 | Lee, Jae Myoung; Kim, Sung Baek; Sim, Wonbo; Lee, Jai Young 25,27-(3,6,9-Trioxaundecane-1,11-dioxy)-26,28-[3-(4-tricyanoethylene)phenyl]-3-aza-pentane-1,5-dioxy)calix[4]arene dichloromethane monosolvate IUCrData, 2019, 4, x190026 |
| 1550463 | CIF | Cu Mg O5 V | C m c m | 5.7716; 8.7145; 6.3052 90; 90; 90 | 317.13 | Gake, T.; Matsushita, S.; Arai, M.; Obata, K. Electronic structures and optical properties of CuMgVO4 and AgMgVO4: a first-principles study Journal of the Ceramic Society of Japan, 2019, 127, 50-55 |
| 1550464 | CIF | Ag Mg O5 V | P n m a | 9.5314; 6.7696; 5.3618 90; 90; 90 | 345.964 | Gake, T.; Matsushita, S.; Arai, M.; Obata, K. Electronic structures and optical properties of CuMgVO4 and AgMgVO4: a first-principles study Journal of the Ceramic Society of Japan, 2019, 127, 50-55 |
| 1550465 | CIF | C52 H15 Cl2 F20 Ga N4 O2 | P 1 21/c 1 | 13.125; 17.799; 21.46 90; 106.821; 90 | 4798.8 | Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science, 2019 |
| 1550466 | CIF | C52 H32 Cl0 F20 Ga N4 O5 | P 1 21/c 1 | 14.3965; 25.5948; 13.8025 90; 93.422; 90 | 5076.8 | Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science, 2019 |
| 1550467 | CIF | C8 H20 Cl3 Ga N4 | P n a 21 | 14.5269; 7.3499; 12.7491 90; 90; 90 | 1361.2 | Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science, 2019 |
| 1550468 | CIF | C44 H8 F20 Ga N4 O2 | P 1 21/n 1 | 14.0662; 5.607; 26.055 90; 95.056; 90 | 2046.9 | Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science, 2019 |
| 1550469 | CIF | C2 H6 F3 N O6 S2 | P n a 21 | 8.9227; 18.531; 5.5268 90; 90; 90 | 913.8 | D'Amato, Erica M.; Börgel, Jonas; Ritter, Tobias Aromatic C–H amination in hexafluoroisopropanol Chemical Science, 2019 |
| 1550470 | CIF | C34 H58 Al2 Br2 | P -1 | 10.367; 12.452; 15.704 69.094; 88.918; 67.783 | 1737.3 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550471 | CIF | C34 H58 Al2 Br2 | C 1 c 1 | 19.582; 8.479; 21.301 90; 93.33; 90 | 3530.8 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550472 | CIF | C27 H44 Al2 Br2 | P 1 21/c 1 | 8.824; 29.234; 12.125 90; 108.8; 90 | 2960.9 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550473 | CIF | C46 H68 Al2 N2 | P b c a | 17.2467; 13.0572; 18.6141 90; 90; 90 | 4191.8 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550474 | CIF | C17 H29 Al Br2 | P 1 21/c 1 | 9.4; 14.876; 13.886 90; 105.24; 90 | 1873 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550475 | CIF | C17 H29 Al2 Br3 | P -1 | 10.6448; 10.6844; 11.1041 63.541; 81.455; 73.465 | 1083.5 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550476 | CIF | C51 H87 Al3 O3 | P 1 21/c 1 | 14.173; 19.091; 19.858 90; 109.37; 90 | 5069 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550477 | CIF | C21 H38 Al2 Cl2 | P 1 21 1 | 9.8915; 21.5331; 11.5146 90; 90.457; 90 | 2452.47 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550478 | CIF | C34 H58 Al3 Br3 | P 1 21/c 1 | 10.1424; 38.371; 10.1825 90; 105.719; 90 | 3814.6 | Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science, 2019 |
| 1550479 | CIF | C19 H22 O5 | C 1 2 1 | 22.5468; 10.4722; 7.3277 90; 107.751; 90 | 1647.8 | Craig, Robert A.; Roizen, Jennifer L.; Smith, Russell C.; Jones, Amanda C.; Virgil, Scott C.; Stoltz, Brian M. Correction: Enantioselective, convergent synthesis of the ineleganolide core by a tandem annulation cascade Chemical Science, 2019 |
| 1550480 | CIF | C17 H17 Cl N2 O3 | P 1 21 1 | 7.599; 10.249; 10.488 90; 109.1; 90 | 771.861 | Wu, Zijun; Wang, Jian A tandem dearomatization/rearomatization strategy: enantioselective N-heterocyclic carbene-catalyzed α-arylation Chemical Science, 2019 |
| 1550481 | CIF HKL Paper | C23 H26 Br Cl N6 | P 1 21/n 1 | 16.252; 5.3787; 27.109 90; 90.551; 90 | 2369.6 | Bourichi, Selma; Kandri Rodi, Youssef; Hökelek, Tuncer; Chakroune, Said; Ouzidan, Younes; Capet, Frédéric 6-Bromo-2-(4-chlorophenyl)-3-[(1-octyl-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-3<i>H</i>-imidazo[4,5-<i>b</i>]pyridine IUCrData, 2019, 4, x190053 |
| 1550482 | CIF HKL Paper | C95 H90 Cl2 F3 Fe N12 O7 S | P -1 | 12.2257; 19.3422; 19.5199 88.061; 72.058; 77.104 | 4277.6 | Li, Jianfeng; Oliver, Allen G.; Scheidt, W. Robert Bis(1-phenylimidazole)[5,10,15,20-tetrakis(2-pivalamidophenyl)porphinato]iron(III) trifluoromethanesulfonate chlorobenzene disolvate IUCrData, 2019, 4, x190015 |
| 1550483 | CIF HKL Paper | C8 H14 B O7 Rb | P 1 21/n 1 | 8.3075; 10.4488; 15.563 90; 92.202; 90 | 1349.92 | Gokila, Govindharajan; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Rubidium bis(2-methyllactato)borate monohydrate IUCrData, 2019, 4, x190039 |
| 1550484 | CIF HKL Paper | C31 H26 N4 O2 S | P -1 | 10.5467; 11.6469; 12.942 108.321; 102.108; 110.887 | 1313.9 | Muthuselvi, C.; Muthu, M.; Athimoolam, S.; Ravikumar, B.; Pandiarajan, S.; Srinivasan, N.; Krishnakumar, R. V. Ethyl 6'-cyano-7'-(<i>p</i>-tolyl)-1',6',7',7a'-tetrahydro-3'<i>H</i>-spiro[indeno[1,2-<i>b</i>]quinoxaline-11,5'-pyrrolo[1,2-<i>c</i>]thiazole]-6'-carboxylate IUCrData, 2019, 4, x190010 |
| 1550485 | CIF | C67 H3 Cl O | P 1 21 1 | 10.1607; 9.8856; 16.4378 90; 102.188; 90 | 1613.9 | Niu, Chuang; Zhou, Dian-Bing; Yang, Yong; Yin, Zheng-Chun; Wang, Guan-Wu Retro Baeyer‒Villiger Reaction: Electrochemical Reduction of [60]Fullerene-Fused Lactones to [60]Fullerene-Fused Ketones Chemical Science, 2019 |
| 1550486 | CIF | C53 H37 Cl4 Ir N4 O6 | P -1 | 9.758; 13.838; 18.798 103.599; 104.123; 101.639 | 2300.4 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550487 | CIF | C52 H37 B Cl3 Ir N2 O6 | P 1 21/c 1 | 14.7106; 23.3274; 12.5713 90; 90.352; 90 | 4313.9 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550488 | CIF | C52 H35 B2 Cl2 Ir N2 O6 | P -1 | 12.9285; 13.0934; 15.0271 107.392; 96.416; 111.677 | 2183.9 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550489 | CIF | C61 H43 B2 Ir N4 O6 | C 1 2/c 1 | 34.306; 16.952; 28.45 90; 126.132; 90 | 13363 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550490 | CIF | C52 H40 Cl3 Ir N2 O6 | P 1 21/n 1 | 10.3303; 31.873; 13.6751 90; 95.52; 90 | 4481.8 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550491 | CIF | C51 H36 Ir N3 O6 | P -1 | 12.8021; 13.4779; 13.5356 71.759; 73.179; 63.251 | 1950.2 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550492 | CIF | C65 H55 B2 Ir N6 O6 | P 1 21/n 1 | 16.7138; 25.8579; 16.5041 90; 103.462; 90 | 6936.8 | li, qiuxia; Shi, Chao; Huang, Manli; Wei, Xing; Yan, Hong; Yang, Chuluo; Yuan, Aihua B- and N-embedded color-tunable phosphorescent iridium complexes and B−N lewis adducts with intriguing structural and optical changes Chemical Science, 2019 |
| 1550493 | CIF | C20 H20 Cl N O2 S | P 1 21/c 1 | 11.5425; 20.2515; 8.2218 90; 92.176; 90 | 1920.48 | Lei, Aiwen; Li, Dan-Dan; Li, Shuaibing; Peng, Chong; Lu, Lijun; Wang , Shengchun; Wang, Pan; Chen, Yi-Hung; Cong, Hengjiang Electrochemical Oxidative C-H/S-H Cross-Coupling between Enamines and Thiophenols with H2 Evolution Chemical Science, 2019 |
| 1550494 | CIF HKL Paper | As4 Ba H6 O14 | P m a n | 8.4638; 11.1799; 5.8353 90; 90; 90 | 552.16 | Weil, Matthias The crystal structure of BaH6As4O14 redetermined, revealing the localization of the hydrogen atoms IUCrData, 2019, 4, x190075 |
| 1550495 | CIF | C35 H27 O P Sn | P 1 21/c 1 | 9.9327; 18.4467; 15.8535 90; 104.801; 90 | 2808.38 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550496 | CIF | C19 H16 Au Cl N O P | P b c a | 12.7694; 7.3282; 38.4557 90; 90; 90 | 3598.56 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550497 | CIF | C92 H77 Au6 Cl5 O5 P5 S | P 1 21/n 1 | 15.3119; 21.8107; 28.8693 90; 99.077; 90 | 9520.55 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550498 | CIF | C18 H20 Cl2 Cu2 N2 O6 P2 | P -1 | 7.3741; 7.5275; 11.8201 78.77; 87.887; 67.556 | 594.3 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550499 | CIF | C187 H158 Cl6 Cu8 O8 P16 | P -1 | 14.7461; 15.0636; 22.964 87.081; 75.816; 63.403 | 4412 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550500 | CIF | C40 H60 Cl2 Cu2 O4 P4 | P -1 | 9.1382; 11.4943; 12.1632 79.859; 71.565; 66.823 | 1112.26 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550501 | CIF | C28 H36 Cl2 Cu2 O4 P4 | P -1 | 8.0889; 9.7187; 10.6284 78.259; 87.754; 80.431 | 806.66 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550502 | CIF | C62 H80 Na2 O15 P2 | C 1 2/c 1 | 27.5839; 9.1559; 28.119 90; 121.726; 90 | 6040.4 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550503 | CIF | C17 H13 Cl Cu O P | P 1 21/c 1 | 17.1019; 3.8793; 21.547 90; 97.229; 90 | 1418.1 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550504 | CIF | C35 H27 Au O P2 | P -1 | 10.7949; 11.5285; 11.9802 87.576; 84.28; 71.512 | 1406.85 | Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes Chemical Science, 2019 |
| 1550505 | CIF | C19 H24 N4 O12 | P 21 21 21 | 6.9557; 7.4897; 41.571 90; 90; 90 | 2165.7 | Shi, Jing; Zeng, Ying Jie; Zhang, Bo; Shao, Fen Li; Chen, Yan-Chi; Xu, Xiang; Sun, Yang; Xu, Qiang; Tan, Ren Xiang; Ge, Hui Ming Comparative Genome Mining and Heterologous Expression of an Orphan NRPS Gene Cluster Directs the Production of Ashimides Chemical Science, 2019 |
| 1550506 | CIF | C26 H36 Cl2 Si Zr | P 1 21/n 1 | 11.6286; 14.8501; 14.9589 90; 99.332; 90 | 2549 | Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl complexes for slurry-phase polymerisation of ethylene Polymer Chemistry, 2019, 10, 1386 |
| 1550507 | CIF | C22 H28 Br2 Si Zr | F d d 2 | 52.0095; 19.2685; 8.6866 90; 90; 90 | 8705.2 | Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl complexes for slurry-phase polymerisation of ethylene Polymer Chemistry, 2019, 10, 1386 |
| 1550508 | CIF | C26 H36 Cl2 Si Zr | P -1 | 8.7586; 11.3702; 14.6917 104.583; 94.052; 103.622 | 1362.94 | Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl complexes for slurry-phase polymerisation of ethylene Polymer Chemistry, 2019, 10, 1386 |
| 1550509 | CIF | C24 H34 Si Zr | F d d 2 | 52.131; 19.346; 8.7251 90; 90; 90 | 8799.5 | Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl complexes for slurry-phase polymerisation of ethylene Polymer Chemistry, 2019, 10, 1386 |
| 1550510 | CIF | C36 H42 Si Zr | P -1 | 12.4776; 14.8663; 17.9117 100.463; 101.218; 105.208 | 3048.5 | Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot Group 4 permethylindenyl complexes for slurry-phase polymerisation of ethylene Polymer Chemistry, 2019, 10, 1386 |
| 1550512 | CIF | C41 H28 O2 | P n a 21 | 9.7427; 13.5639; 21.658 90; 90; 90 | 2862.1 | Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiao-Chun; Jiang, Gaoxi Brønsted acid-catalyzed aromatic annulation of alkoxyallenes with naphthols: a reaction sequence to larger π-conjugated naphthopyrans with aggregation-induced emission characters Chemical Science, 2019 |
| 1550513 | CIF | C26 H17 Br O | P 1 21/c 1 | 12.8537; 13.3132; 11.8696 90; 114.474; 90 | 1848.7 | Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiao-Chun; Jiang, Gaoxi Brønsted acid-catalyzed aromatic annulation of alkoxyallenes with naphthols: a reaction sequence to larger π-conjugated naphthopyrans with aggregation-induced emission characters Chemical Science, 2019 |
| 1550514 | CIF | C10 H10 As5 Cr2 | P 1 21/n 1 | 8.1149; 14.8158; 12.0097 90; 104.644; 90 | 1397.01 | Brake, Helena; Presypkina, Eugenia V.; Heindl, Claudia; Virovets, Alexander Viktorovich; Kremer, Werner; Scheer, Manfred From Nano-Balls to Nano-Bowls Chemical Science, 2019 |
| 1550515 | CIF | C130.61 H192.4 As5 Cl19.27 Cr2 Cu13.35 Fe11 N3.83 P55 | C 1 c 1 | 30.4118; 29.4289; 28.8188 90; 112.875; 90 | 23764 | Brake, Helena; Presypkina, Eugenia V.; Heindl, Claudia; Virovets, Alexander Viktorovich; Kremer, Werner; Scheer, Manfred From Nano-Balls to Nano-Bowls Chemical Science, 2019 |
| 1550516 | CIF | C125.2 H184.5 As5 Br14.55 Cl6.8 Cr2 Cu14.55 Fe11 N0.9 P55 | C 1 c 1 | 27.08802; 33.62013; 25.36593 90; 103.351; 90 | 22476.5 | Brake, Helena; Presypkina, Eugenia V.; Heindl, Claudia; Virovets, Alexander Viktorovich; Kremer, Werner; Scheer, Manfred From Nano-Balls to Nano-Bowls Chemical Science, 2019 |
| 1550518 | CIF HKL | C27 H17 Cl O | P n a 21 | 14.0201; 17.4488; 7.8775 90; 90; 90 | 1927.1 | Roy Choudhury, Anuradha; Paul, Satya B.; Choudhury, Sudip 14-(4-Chlorophenyl)-14<i>H</i>-dibenzo[<i>a</i>,<i>j</i>]xanthene IUCrData, 2019, 4, x181846 |
| 1550519 | CIF | C26 H34 B N O4 S | P 1 21/c 1 | 6.4192; 32.5924; 11.989 90; 99.366; 90 | 2474.9 | Cabrera-Lobera, Natalia; Quirós, M. Teresa; Buñuel, Elena; Cardenas, Diego J. Atom-Economical Regioselective Ni-Catalyzed Hydroborylative Cyclization of Enynes: Development and Mechanism Catalysis Science & Technology, 2019 |
| 1550520 | CIF Paper | C12 H16 N4 O6 | P 1 21/c 1 | 14.0525; 7.8134; 12.8242 90; 91.848; 90 | 1407.34 | Gryl, Marlena; Rydz, Agnieszka; Wojnarska, Joanna; Krawczuk, Anna; Kozieł, Marcin; Seidler, Tomasz; Ostrowska, Katarzyna; Marzec, Monika; Stadnicka, Katarzyna Marta Origin of chromic effects and crystal-to-crystal phase transition in the polymorphs of tyraminium violurate IUCrJ, 2019, 6 |
| 1550521 | CIF Paper | C12 H14 N4 O5 | P 1 21/c 1 | 6.8711; 15.119; 11.884 90; 91.858; 90 | 1233.9 | Gryl, Marlena; Rydz, Agnieszka; Wojnarska, Joanna; Krawczuk, Anna; Kozieł, Marcin; Seidler, Tomasz; Ostrowska, Katarzyna; Marzec, Monika; Stadnicka, Katarzyna Marta Origin of chromic effects and crystal-to-crystal phase transition in the polymorphs of tyraminium violurate IUCrJ, 2019, 6 |
| 1550522 | CIF Paper | C12 H14 N4 O5 | P 1 21/c 1 | 13.2706; 7.651; 13.1269 90; 102.097; 90 | 1303.22 | Gryl, Marlena; Rydz, Agnieszka; Wojnarska, Joanna; Krawczuk, Anna; Kozieł, Marcin; Seidler, Tomasz; Ostrowska, Katarzyna; Marzec, Monika; Stadnicka, Katarzyna Marta Origin of chromic effects and crystal-to-crystal phase transition in the polymorphs of tyraminium violurate IUCrJ, 2019, 6 |
| 1550523 | CIF | C78 H102 Cl Mn9 N6 O28 S6 | P 21 21 21 | 13.3925; 25.1226; 27.0041 90; 90; 90 | 9085.6 | Mitcov, Dmitri; Pedersen, Anders Hjordt; Ceccato, Marcel; Gelardi, Rikke Munch; Hassenkam, Tue; Konstantatos, Andreas; Reinholdt, Anders; Sørensen, Mikkel A.; Thulstrup, Peter Waaben Waaben; Vinum, Morten Gotthold; Wilhelm, Fabrice; Rogalev, Andrei; Wernsdorfer, Wolfgang; Brechin, Euan K.; Piligkos, Stergios Molecular multifunctionality preservation upon surface deposition for a chiral Single-Molecule Magnet Chemical Science, 2019 |
| 1550524 | CIF | C78 H102 Cl Mn9 N6 O28 S6 | P 21 21 21 | 13.4007; 25.1409; 26.8999 90; 90; 90 | 9062.7 | Mitcov, Dmitri; Pedersen, Anders Hjordt; Ceccato, Marcel; Gelardi, Rikke Munch; Hassenkam, Tue; Konstantatos, Andreas; Reinholdt, Anders; Sørensen, Mikkel A.; Thulstrup, Peter Waaben Waaben; Vinum, Morten Gotthold; Wilhelm, Fabrice; Rogalev, Andrei; Wernsdorfer, Wolfgang; Brechin, Euan K.; Piligkos, Stergios Molecular multifunctionality preservation upon surface deposition for a chiral Single-Molecule Magnet Chemical Science, 2019 |
| 1550525 | CIF | C17 H21 N O3 S | P 21 21 21 | 5.8911; 12.299; 22.4992 90; 90; 90 | 1630.17 | Breit, Bernhard; Schmidt, Johannes Transition Metal Catalyzed Stereodivergent Synthesis of syn- and anti-δ-Vinyl-Lactams: Formal Total Synthesis of (−)-Cermizine C and (−)-Senepodine G Chemical Science, 2019 |
| 1550526 | CIF | C20 H21 N O3 S | P 1 21/n 1 | 8.136; 17.429; 13.045 90; 105.2; 90 | 1785 | Breit, Bernhard; Schmidt, Johannes Transition Metal Catalyzed Stereodivergent Synthesis of syn- and anti-δ-Vinyl-Lactams: Formal Total Synthesis of (−)-Cermizine C and (−)-Senepodine G Chemical Science, 2019 |
| 1550527 | CIF | C21 H19 N O4 S | P 1 21/n 1 | 9.07481; 15.022; 12.762 90; 99.1959; 90 | 1717.38 | Li, Long; Zhu, Xin-Qi; Zhang, Ying-Qi; Bu, Hao-Zhen; Yuan, Peng; Chen, Jinyu; Su, Jingyi; Deng, Xianming; Ye, Long-Wu Metal-Free Alkene Carbooxygenation Following Tandem Intramolecular Alkoxylation/Claisen Rearrangement: Stereocontrolled Access to Bridged [4.2.1] Lactones Chemical Science, 2019 |
| 1550528 | CIF | C28 H25 N O4 S | P 1 21/c 1 | 12.3488; 9.82302; 19.2566 90; 108.549; 90 | 2214.53 | Li, Long; Zhu, Xin-Qi; Zhang, Ying-Qi; Bu, Hao-Zhen; Yuan, Peng; Chen, Jinyu; Su, Jingyi; Deng, Xianming; Ye, Long-Wu Metal-Free Alkene Carbooxygenation Following Tandem Intramolecular Alkoxylation/Claisen Rearrangement: Stereocontrolled Access to Bridged [4.2.1] Lactones Chemical Science, 2019 |
| 1550529 | CIF | C28 H24 N2 O7 S | P 1 21 1 | 9.68936; 16.6569; 15.2343 90; 94.933; 90 | 2449.63 | Li, Long; Zhu, Xin-Qi; Zhang, Ying-Qi; Bu, Hao-Zhen; Yuan, Peng; Chen, Jinyu; Su, Jingyi; Deng, Xianming; Ye, Long-Wu Metal-Free Alkene Carbooxygenation Following Tandem Intramolecular Alkoxylation/Claisen Rearrangement: Stereocontrolled Access to Bridged [4.2.1] Lactones Chemical Science, 2019 |
| 1550530 | CIF | C22 H21 N O4 S | P 1 21/n 1 | 13.78; 9.3801; 14.41 90; 92.893; 90 | 1860.2 | Li, Long; Zhu, Xin-Qi; Zhang, Ying-Qi; Bu, Hao-Zhen; Yuan, Peng; Chen, Jinyu; Su, Jingyi; Deng, Xianming; Ye, Long-Wu Metal-Free Alkene Carbooxygenation Following Tandem Intramolecular Alkoxylation/Claisen Rearrangement: Stereocontrolled Access to Bridged [4.2.1] Lactones Chemical Science, 2019 |
| 1550531 | CIF | C14 H12 F N O2 | P 1 21/c 1 | 5.45155; 18.5193; 11.2116 90; 102.137; 90 | 1106.61 | Li, Long; Zhu, Xin-Qi; Zhang, Ying-Qi; Bu, Hao-Zhen; Yuan, Peng; Chen, Jinyu; Su, Jingyi; Deng, Xianming; Ye, Long-Wu Metal-Free Alkene Carbooxygenation Following Tandem Intramolecular Alkoxylation/Claisen Rearrangement: Stereocontrolled Access to Bridged [4.2.1] Lactones Chemical Science, 2019 |
| 1550532 | CIF | C22 H24 B N O3 | P 1 21 1 | 9.9629; 10.4616; 18.5419 90; 90.923; 90 | 1932.33 | Shen, Chong; Zeidan, Nicolas; Wu, Quan; Breuers, Christian; Liu, Ren-Rong; Jia, Yi-Xia; Lautens, Mark Pd-Catalyzed Dearomative Arylborylation of Indoles Chemical Science, 2019 |
| 1550533 | CIF | C36 H72 Mn4 O16 | I 2 2 2 | 12.1248; 14.1447; 14.1468 90; 90; 90 | 2426.2 | Nagae, Haruki; Hirai, Takahiro; Kato, Daiki; Soma, Shusei; Akebi, Shin-ya; Mashima, Kazushi Dinuclear Manganese Alkoxide Complexes as Catalysts for C—N Bond Cleavage of Simple Tertiary N,N-Dialkylamides to Give Esters Chemical Science, 2019 |
| 1550534 | CIF | C52 H54 Mn2 N4 O6 | P 1 21/c 1 | 10.4733; 20.948; 10.6581 90; 94.542; 90 | 2331 | Nagae, Haruki; Hirai, Takahiro; Kato, Daiki; Soma, Shusei; Akebi, Shin-ya; Mashima, Kazushi Dinuclear Manganese Alkoxide Complexes as Catalysts for C—N Bond Cleavage of Simple Tertiary N,N-Dialkylamides to Give Esters Chemical Science, 2019 |
| 1550535 | CIF HKL | C14 H14 N2 O4 S | P 1 21/c 1 | 7.2595; 27.492; 7.963 90; 113.072; 90 | 1462.1 | Faizi, Md. Serajul Haque; Lone, Mohammad Nadeem; Dege, Necmi; Iskenderov, Turganbay; Malinkin, Sergey (<i>Z</i>)-3-Butyl-5-(4-nitrobenzylidene)thiazolidine-2,4-dione IUCrData, 2019, 4, x190094 |
| 1550536 | CIF HKL Paper | C11 H10 Cl2 N2 Zn | P 1 21/c 1 | 12.1865; 7.6666; 14.1087 90; 111.467; 90 | 1226.72 | Siegfried, Adam; McAbee, Brett; Zotov, Vladimir; McMillen, Colin; Hanks, Timothy Dichlorido(2,2'-methylenedipyridine)zinc(II) IUCrData, 2019, 4, x190131 |
| 1550537 | CIF | C56 H43 F6 Ir2 N12 P | C 1 2/c 1 | 39.183; 9.5561; 17.8539 90; 102.731; 90 | 6520.8 | Chen, Mu-He; Zheng, Yue; Cai, Xiong-Jie; zhang, hang; Wang, Fang-Xin; Tan, Caiping; Chen, Wen-Hua; Ji, Liangnian; Mao, Zong-Wan Inhibition of Autophagic Flux by Cyclometalated Iridium(III) Complexes through Anion Transportation Chemical Science, 2019 |
| 1550538 | CIF | C30 H23 F6 Ir N5 P | P b c a | 10.9356; 15.8786; 33.0214 90; 90; 90 | 5733.9 | Chen, Mu-He; Zheng, Yue; Cai, Xiong-Jie; zhang, hang; Wang, Fang-Xin; Tan, Caiping; Chen, Wen-Hua; Ji, Liangnian; Mao, Zong-Wan Inhibition of Autophagic Flux by Cyclometalated Iridium(III) Complexes through Anion Transportation Chemical Science, 2019 |
| 1550539 | CIF | C72 H6 Cl6 | P -1 | 9.8783; 9.9409; 12.3344 70.99; 75.17; 63.05 | 1012.3 | Lei, Yilong; Wang, Shaoyan; Lai, Zhuangchai; Yao, Xin; Zhao, Yanli; Zhang, Hua; Chen, Hongyu Two-dimensional C<sub>60</sub> nano-meshes via crystal transformation. Nanoscale, 2019, 11, 8692-8698 |
| 1550540 | CIF HKL | C14 H8 N4 Pt S2 | P 1 21/n 1 | 10.087; 7.349; 19.442 90; 101.276; 90 | 1413.4 | Nesterov, Vladimir N.; Hu, Jiandu; Reinheimer, Eric W.; Smucker, Bradley W. (2,2'-Bipyridine)(1,2-dicyanoethene-1,2-dithiolato)platinum(II) IUCrData, 2019, 4, x190158 |
| 1550541 | CIF HKL Paper | C17 H11 Cl N4 O2 | P 1 21/c 1 | 17.8925; 7.4168; 11.5006 90; 102.061; 90 | 1492.5 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Yousif, Emad; Hayal Alotaibi, Mohammad; Hegazy, Amany S.; Kariuki, Benson M. 5-[5-(4-Chlorophenyl)isoxazol-3-yl]-<i>N</i>-phenyl-1,3,4-oxadiazol-2-amine IUCrData, 2019, 4, x190136 |
| 1550542 | CIF HKL Paper | C10 H12 N2 Pt S2 | P n m a | 16.8696; 7.5226; 9.054 90; 90; 90 | 1148.98 | Ha, Kwang [(1,2,5,6-η)-Cycloocta-1,5-diene]bis(thiocyanato-κ<i>S</i>)platinum(II) IUCrData, 2019, 4, x190162 |
| 1550543 | CIF HKL Paper | B4 H6 K2 O10 | P -1 | 7.185; 7.8479; 8.9932 68.572; 88.393; 74.975 | 454.66 | Dhatchaiyini, M. K.; NizamMohideen, M.; Rajasekar, G.; Bhaskaran, A. Dipotassium tetrahydroxidopentaoxidotetraborate monohydrate IUCrData, 2019, 4, x190128 |
| 1550544 | CIF | C64 H78 Mg2 N4 | P -1 | 8.65; 12.2882; 13.5191 108.311; 90.582; 100.254 | 1339.07 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550545 | CIF | C60 H70 Mg2 N4 | P b c a | 15.3389; 14.0741; 23.7894 90; 90; 90 | 5135.7 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550546 | CIF | C93 H114 B2 Cd2 N6 Si2 | P 21 21 2 | 14.733; 27.815; 11.021 90; 90; 90 | 4516.4 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550547 | CIF | C60 H68 Mg2 N4 | P -1 | 13.659; 14.429; 15.718 67.851; 79.39; 66.344 | 2626.1 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550548 | CIF | C59 H76 Mg2 N4 | C 1 c 1 | 19.9645; 11.2773; 22.9784 90; 93.089; 90 | 5166 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550549 | CIF | C72 H100 B2 N6 Si2 Zn2 | P -1 | 10.9999; 12.4537; 13.2073 92.95; 90.257; 108.041 | 1717.63 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550550 | CIF | C94 H116 B2 Cd2 I2 N6 Si2 | C 1 2/c 1 | 23.4536; 11.0309; 33.833 90; 92.003; 90 | 8747.7 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550551 | CIF | C76 H80 Mg2 N2 Si2 | P 1 21/c 1 | 11.1004; 16.2687; 18.3324 90; 103.171; 90 | 3223.54 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550552 | CIF | C56 H62 Mg2 N4 | P 1 21/c 1 | 18.7478; 12.7752; 20.4162 90; 100.287; 90 | 4811.2 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550553 | CIF | C74 H98 Ge Mg N3 Si | P -1 | 11.053; 12.9063; 23.4106 99.68; 97.495; 95.233 | 3242 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550554 | CIF | C103 H120 N2 Si2 Zn2 | C 1 c 1 | 14.8102; 18.9756; 31.5018 90; 98.531; 90 | 8755.1 | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis Chemical Science, 2019 |
| 1550555 | CIF | C22 H17 N2 O0.5 | C 1 2/c 1 | 19.1394; 8.9002; 19.2392 90; 107.39; 90 | 3127.5 | Obata, Atsushi; Sasagawa, Akane; Yamazaki, Ken; Ano, Yusuke; Chatani, Naoto Nickel-Catalyzed Oxidative C-H/N-H Annulation of N-Heteroaromatic Compounds with Alkynes Chemical Science, 2019 |
| 1550556 | CIF | C25 H26 I N O6 S | P 1 21/n 1 | 8.0732; 30.9671; 10.1196 90; 97.056; 90 | 2510.78 | Caramenti, Paola; Declas, Nina; Tessier, Romain; Wodrich, Matthew D.; Waser, Jerome Stereoselective Synthesis of Alkyl-, Aryl-, Vinyl- and Alkynyl-Substituted Z- Enamides and Enol Ethers Chemical Science, 2019 |
| 1550557 | CIF | C39 H63 Lu N3 P3 | P -1 | 10.6585; 11.7628; 17.3425 90.309; 91.012; 112.41 | 2009.6 | Lu, Connie; Ramirez, Bianca L.; Sharma, Prachi; Eisenhart, Reed; Gagliardi, Laura Bimetallic nickel-lutetium complexes: Tuning the properties and catalytic hydrogenation activity of the Ni site by varying the Lu coordination environment Chemical Science, 2019 |
| 1550558 | CIF | C46 H71 Lu N3 Ni P3 | P 1 21/c 1 | 12.9011; 14.025; 25.5191 90; 94.979; 90 | 4599.9 | Lu, Connie; Ramirez, Bianca L.; Sharma, Prachi; Eisenhart, Reed; Gagliardi, Laura Bimetallic nickel-lutetium complexes: Tuning the properties and catalytic hydrogenation activity of the Ni site by varying the Lu coordination environment Chemical Science, 2019 |
| 1550559 | CIF | C48 H79 Lu N6 P3 | P 1 21/c 1 | 11.5369; 38.7027; 11.85 90; 112.211; 90 | 4898.5 | Lu, Connie; Ramirez, Bianca L.; Sharma, Prachi; Eisenhart, Reed; Gagliardi, Laura Bimetallic nickel-lutetium complexes: Tuning the properties and catalytic hydrogenation activity of the Ni site by varying the Lu coordination environment Chemical Science, 2019 |
| 1550560 | CIF | C43 H71 Lu N3 Ni O P3 | P -1 | 11.4262; 12.1111; 17.7291 76.841; 81.233; 68.244 | 2212.5 | Lu, Connie; Ramirez, Bianca L.; Sharma, Prachi; Eisenhart, Reed; Gagliardi, Laura Bimetallic nickel-lutetium complexes: Tuning the properties and catalytic hydrogenation activity of the Ni site by varying the Lu coordination environment Chemical Science, 2019 |
| 1550561 | CIF | C45 H72 Lu N6 Ni P3 | P -1 | 10.7814; 10.8562; 20.1873 78.273; 79.603; 78.339 | 2241.69 | Lu, Connie; Ramirez, Bianca L.; Sharma, Prachi; Eisenhart, Reed; Gagliardi, Laura Bimetallic nickel-lutetium complexes: Tuning the properties and catalytic hydrogenation activity of the Ni site by varying the Lu coordination environment Chemical Science, 2019 |
| 1550562 | CIF | C36 H72 Cu2.01 Li1.99 N4 | P 1 21/c 1 | 11.679; 22.808; 15.234 90; 108.9; 90 | 3839.2 | Wheatley, Andrew; Peel, Andrew; Tezuka, Noriyuki; D'Rozario, James; Uchiyama, Masanobu A new route to the efficient metalation of unfunctionalized aromatics Chemical Science, 2019 |
| 1550563 | CIF | C33 H59 Cu3.12 Li0.88 N3 | P b c a | 11.3883; 18.8747; 31.9081 90; 90; 90 | 6858.7 | Wheatley, Andrew; Peel, Andrew; Tezuka, Noriyuki; D'Rozario, James; Uchiyama, Masanobu A new route to the efficient metalation of unfunctionalized aromatics Chemical Science, 2019 |
| 1550564 | CIF | C33 H59 Cu4 N3 | P c a 21 | 11.2175; 15.925; 18.9824 90; 90; 90 | 3391 | Wheatley, Andrew; Peel, Andrew; Tezuka, Noriyuki; D'Rozario, James; Uchiyama, Masanobu A new route to the efficient metalation of unfunctionalized aromatics Chemical Science, 2019 |
| 1550565 | CIF | C30 H46 Cu2 Li2 N2 | P b c a | 8.6647; 16.1964; 21.7364 90; 90; 90 | 3050.42 | Wheatley, Andrew; Peel, Andrew; Tezuka, Noriyuki; D'Rozario, James; Uchiyama, Masanobu A new route to the efficient metalation of unfunctionalized aromatics Chemical Science, 2019 |
| 1550566 | CIF | C33 H59 Cu2 Li2 N3 | P 1 21/n 1 | 15.4346; 12.0863; 19.5308 90; 110.296; 90 | 3417.21 | Wheatley, Andrew; Peel, Andrew; Tezuka, Noriyuki; D'Rozario, James; Uchiyama, Masanobu A new route to the efficient metalation of unfunctionalized aromatics Chemical Science, 2019 |
| 1550567 | CIF HKL Paper | C19 H20 O6 | P n a 21 | 7.7143; 28.907; 7.501 90; 90; 90 | 1672.7 | Lee, Ji Hye; Koh, Dongsoo (<i>E</i>)-1-(2-Hydroxy-6-methoxyphenyl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one IUCrData, 2019, 4, x190179 |
| 1550568 | CIF HKL | C29 H25 F N2 O4 | P 21 21 21 | 9.959; 10.49; 23.62 90; 90; 90 | 2467.6 | Li, Yu-Long; Zhou, Jin; Zhong, Kai-Long; Shi, Xing-Hao; Zhang, Zhi-Yuan; Jiang, Hong; Sun, Hong-Shun Diethyl 3,3'-[(4-fluorophenyl)methylidene]bis(1<i>H</i>-indole-2-carboxylate) IUCrData, 2019, 4, x190134 |
| 1550569 | CIF | C17 H20 O7 | P 1 21/c 1 | 18.2208; 9.3925; 9.6745 90; 92.591; 90 | 1653.99 | Scheidt, Karl A.; Betori, Rick; McDonald, Benjamin Reductive Annulations of Arylidene Malonates With Unsaturated Electrophiles Using Photoredox/Lewis Acid Cooperative Catalysis Chemical Science, 2019 |
| 1550570 | CIF | C21 H24 N4 O3 | C 1 2/c 1 | 22.4783; 11.4618; 15.6035 90; 92.056; 90 | 4017.53 | Saunthwal, Rakesh; Cornall, Matthew; Abrams, Roman; Ward, John; Clayden, Jonathan Connective Synthesis of 5,5-Disubstituted Hydantoins by Tandem α-Amination and α-Arylation of Silyl Ketene Acetals Chemical Science, 2019 |
| 1550571 | CIF | C16 H21 N3 O4 | P 1 21/c 1 | 21.1353; 9.1587; 16.9027 90; 92.271; 90 | 3269.32 | Saunthwal, Rakesh; Cornall, Matthew; Abrams, Roman; Ward, John; Clayden, Jonathan Connective Synthesis of 5,5-Disubstituted Hydantoins by Tandem α-Amination and α-Arylation of Silyl Ketene Acetals Chemical Science, 2019 |
| 1550572 | CIF | C80 H112 N4 O21 Rh2 | P -1 | 10.9672; 12.007; 15.6024 78.603; 84.035; 72.96 | 1923.3 | Berndt, Jan Philipp; Radchenko, Yevhenii; Becker, Jonathan; Logemann, Christian; Bhandari, Dhaka Ram; Hrdina, Radim; SCHREINER, Peter Richard Site-Selective Nitrenoid Insertions Utilizing Postfunctionalized Bifunctional Rhodium(II) Catalysts Chemical Science, 2019 |
| 1550573 | CIF | C88 H128 N8 O18 Rh2 S6 | P -1 | 13.4068; 14.036; 14.1837 68.831; 72.514; 69.919 | 2289.69 | Berndt, Jan Philipp; Radchenko, Yevhenii; Becker, Jonathan; Logemann, Christian; Bhandari, Dhaka Ram; Hrdina, Radim; SCHREINER, Peter Richard Site-Selective Nitrenoid Insertions Utilizing Postfunctionalized Bifunctional Rhodium(II) Catalysts Chemical Science, 2019 |
| 1550574 | CIF | C88 H100 F24 N8 O16 Rh2 S4 | P -1 | 14.0242; 14.3859; 17.8002 89.158; 89.755; 62.152 | 3174.9 | Berndt, Jan Philipp; Radchenko, Yevhenii; Becker, Jonathan; Logemann, Christian; Bhandari, Dhaka Ram; Hrdina, Radim; SCHREINER, Peter Richard Site-Selective Nitrenoid Insertions Utilizing Postfunctionalized Bifunctional Rhodium(II) Catalysts Chemical Science, 2019 |
| 1550575 | CIF | C22 H29 O2 P | P 1 21 1 | 6.4762; 7.8291; 18.9197 90; 92.615; 90 | 958.28 | Szkop, Kevin M.; Geeson, Michael Baily; Stephan, Douglas W.; Cummins, Christopher Synthesis of acyl(chloro)phosphines enabled by phosphinidene transfer Chemical Science, 2019 |
| 1550576 | CIF | C21 H28 Cl3 O P Ru | P 1 21/c 1 | 15.7335; 7.0904; 20.8392 90; 105.282; 90 | 2242.6 | Szkop, Kevin M.; Geeson, Michael Baily; Stephan, Douglas W.; Cummins, Christopher Synthesis of acyl(chloro)phosphines enabled by phosphinidene transfer Chemical Science, 2019 |
| 1550577 | CIF | C21 H34 Na O6 P | P 1 21/c 1 | 18.5288; 14.5736; 19.2314 90; 113.995; 90 | 4744.3 | Szkop, Kevin M.; Geeson, Michael Baily; Stephan, Douglas W.; Cummins, Christopher Synthesis of acyl(chloro)phosphines enabled by phosphinidene transfer Chemical Science, 2019 |
| 1550578 | CIF | C52 H50 | P 1 21/n 1 | 16.156; 11.811; 20.079 90; 93.63; 90 | 3823.8 | Majewski, Marcin Aleksander; Chmielewski, Piotr Jan; Chien, Alan; Hong, Yongseok; Lis, Tadeusz; Witwicki, Maciej; Kim, Dongho; Zimmerman, Paul; Stępień, Marcin 5,10-Dimesityldiindeno[1,2-a:2',1'-i]phenanthrene: A Stable Biradicaloid Derived from Chichibabin’s Hydrocarbon Chemical Science, 2019 |
| 1550579 | CIF | C26 H24 Br N3 O3 S | P 63 | 17.66; 17.66; 13.5994 90; 90; 120 | 3673.1 | JARRIGE , Lucie; Glavač, Danijel; Levitre, Guillaume; Retailleau, Pascal; Bernadat, Guillaume; Neuville, luc; Masson, Geraldine Chiral Phosphoric Acid-Catalyzed Enantioselective Construction of Structurally Diverse Benzothiazolopyrimidines Chemical Science, 2019 |
| 1550580 | CIF | C18 H17 Br N2 O S | P 1 21 1 | 9.6687; 8.1636; 11.2423 90; 104.07; 90 | 860.75 | JARRIGE , Lucie; Glavač, Danijel; Levitre, Guillaume; Retailleau, Pascal; Bernadat, Guillaume; Neuville, luc; Masson, Geraldine Chiral Phosphoric Acid-Catalyzed Enantioselective Construction of Structurally Diverse Benzothiazolopyrimidines Chemical Science, 2019 |
| 1550581 | CIF | C18 H26 Ag N7 O13 | P 32 | 30.382; 30.382; 14.976 90; 90; 120 | 11972 | houlton, andrew; Mistry, Liam; El-Zubir, Osama; Horrocks, Ben R.; Dura, Gema; Clegg, William; Waddell, Paul G.; Hofer, Werner; pope, thomas; Wright, Nicholas Addressing the Properties of “Metallo-DNA” with a Ag(I)-Mediated Supramolecular Duplex Chemical Science, 2019 |
| 1550582 | CIF | C23 H30 N2 O | P 21 21 21 | 9.8225; 10.4555; 19.967 90; 90; 90 | 2050.59 | Vasu, Dhananjayan; Fuentes de Arriba, Angel L.; Leitch, Jamie; de Gombert, Antoine; Dixon, Darren Primary α-Tertiary Amine Synthesis via α-C–H Functionalization Chemical Science, 2019 |
| 1550583 | CIF HKL Paper | C8 H13 B K O6.5 | C 1 2/c 1 | 12.3919; 10.7917; 19.9794 90; 103.138; 90 | 2601.9 | Gokila, Govindharajan; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Potassium bis(2-methyllactato)borate hemihydrate IUCrData, 2019, 4, x190202 |
| 1550584 | CIF HKL Paper | C21 H24 N2 O4 | P 1 21/c 1 | 10.6258; 10.2217; 18.0993 90; 90.798; 90 | 1965.64 | Lee, Ji Hye; Koh, Dongsoo Diethyl 4-(1<i>H</i>-indol-3-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate IUCrData, 2019, 4, x190193 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!