Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1515639 | CIF | C132 H126 In8 N84 O39.67 | R -3 :H | 28.1055; 28.1055; 19.1669 90; 90; 120 | 13111.9 | Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science, 2011, 2, 1695 |
| 1515640 | CIF | C135 H175 Co8 N73 O56 S6 | P 1 21/n 1 | 20.3067; 18.7195; 24.9104 90; 93.182; 90 | 9454.6 | Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science, 2011, 2, 1695 |
| 1515641 | CIF | C11 H20 Cl2 Fe0.5 N3 O2 Re0.5 | P -1 | 8.623; 10.307; 10.493 104.88; 92.7; 101.67 | 877.838 | Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science, 2011, 2, 1688 |
| 1515642 | CIF | C38 H72 Cl4 Fe N6 O4 Re | P -1 | 8.9348; 10.504; 14.0627 68.984; 77.296; 85.408 | 1201.85 | Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science, 2011, 2, 1688 |
| 1515643 | CIF | C13 H26 Cl2 Fe0.5 N3 O2 Re0.5 | P 1 21/n 1 | 10.778; 12.316; 14.407 90; 107.01; 90 | 1828.75 | Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science, 2011, 2, 1688 |
| 1515644 | CIF | C11 H22 Cl2 Fe0.5 N3 O2 Re0.5 | P -1 | 9.465; 9.976; 10.631 108.44; 109.42; 106.27 | 810.526 | Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science, 2011, 2, 1688 |
| 1515645 | CIF | C26 H52 Cl4 Fe N6 O4 Re | P 4/n :2 | 13.3667; 13.3667; 10.7152 90; 90; 90 | 1914.5 | Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science, 2011, 2, 1688 |
| 1515646 | CIF | C33.25 H37.25 Cl1.5 N2 O4 Si | P 21 21 2 | 8.3338; 25.68; 15.2004 90; 90; 90 | 3253.1 | Kummer, David A.; Li, Derun; Dion, Amelie; Myers, Andrew G. A practical, convergent route to the key precursor to the tetracycline antibiotics. Chemical science (Royal Society of Chemistry : 2010), 2011, 2, 1710-1718 |
| 1515647 | CIF | C20 H18 N2 O4 | P -1 | 8.4645; 9.265; 13.88 101.3; 98.534; 106.22 | 1000.8 | Kummer, David A.; Li, Derun; Dion, Amelie; Myers, Andrew G. A practical, convergent route to the key precursor to the tetracycline antibiotics. Chemical science (Royal Society of Chemistry : 2010), 2011, 2, 1710-1718 |
| 1515648 | CIF | C20 H20 N2 O4 | P 21 21 21 | 6.4713; 12.2439; 21.5133 90; 90; 90 | 1704.58 | Kummer, David A.; Li, Derun; Dion, Amelie; Myers, Andrew G. A practical, convergent route to the key precursor to the tetracycline antibiotics. Chemical science (Royal Society of Chemistry : 2010), 2011, 2, 1710-1718 |
| 1515649 | CIF | C50 H58 N O18 Ru3 S6 | P -1 | 10.577; 10.715; 13.367 106.03; 90.59; 105.44 | 1397.7 | Lai-Fung Chan, Sharon; Wai-Yin Sun, Raymond; Choi, Mei-Yuk; Zeng, Yibo; Shek, Lam; Sin-Yin Chui, Stephen; Che, Chi-Ming An anti-cancer trinuclear ruthenium(iii) complex with 2-thiosalicylate ligands attenuates Wnt-β-catenin signaling Chemical Science, 2011, 2, 1788 |
| 1515650 | CIF | C27 H22 Cl N O5 S2 | P 1 21 1 | 11.2346; 7.9046; 14.0597 90; 94.892; 90 | 1244.02 | Atienza, Roxanne L.; Roth, Howard S.; Scheidt, Karl A. N-heterocyclic carbene-catalyzed rearrangements of vinyl sulfones. Chemical science (Royal Society of Chemistry : 2010), 2011, 2, 1772-1776 |
| 1515651 | CIF | C24 H18 B F10 N | P -4 21 c | 22.3613; 22.3613; 8.7343 90; 90; 90 | 4367.4 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515652 | CIF | C27 H22 B F10 N | P -1 | 9.1677; 11.1135; 13.3821 68.696; 78.909; 81.699 | 1242.4 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515653 | CIF | C23 H20 B F10 N | C 1 2/c 1 | 18.5936; 9.2952; 26.1791 90; 104.988; 90 | 4370.6 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515654 | CIF | C38 H34 B F10 N | P 1 21/n 1 | 13.6638; 16.1258; 16.855 90; 111.633; 90 | 3452.24 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515655 | CIF | C28 H28 B F10 N | C 1 2/c 1 | 18.8907; 17.3259; 16.9954 90; 105.094; 90 | 5370.7 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515656 | CIF | C33 H24 B F10 N | P 1 21/n 1 | 8.9726; 13.4786; 24.6543 90; 93.952; 90 | 2974.6 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515657 | CIF | C25 H20 B F10 N | A b a 2 | 17.8309; 21.5961; 12.2832 90; 90; 90 | 4730 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515658 | CIF | C23 H22 B F10 N | P 1 21/n 1 | 12.1379; 14.0463; 13.5423 90; 105.934; 90 | 2220.15 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515659 | CIF | C22 H20 B F10 N | P 21 21 21 | 10.9724; 11.3362; 16.996 90; 90; 90 | 2114.05 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515660 | CIF | C30 H26 B F10 N O | P -1 | 9.428; 11.0909; 14.6744 108.637; 96.263; 105.831 | 1366.01 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515661 | CIF | C43 H38 B F10 N O | P 1 21/c 1 | 20.3695; 9.2993; 21.591 90; 114.314; 90 | 3727.1 | Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science, 2011, 2, 1842 |
| 1515662 | CIF | C16 H15 Br O | P 1 21 1 | 12.363; 6.388; 17.867 90; 98.728; 90 | 1394.7 | Li, Hui; Zhang, Fu-Min; Tu, Yong-Qiang; Zhang, Qing-Wei; Chen, Zhi-Min; Chen, Zhi-Hua; Li, Jian Enantioselective bromination/semipinacol rearrangement for the synthesis of β-bromoketones containing an all-α-carbon quaternary center Chemical Science, 2011, 2, 1839 |
| 1515663 | CIF | C56 H126 N6 O2 Si12 U2 | P -1 | 11.0022; 11.7354; 18.0634 90.254; 94.779; 117.609 | 2057.05 | Arnold, Polly L.; Turner, Zoë R.; Bellabarba, Ronan M.; Tooze, Robert P. Carbon monoxide coupling and functionalisation at a simple uranium coordination complex Chemical Science, 2011, 2, 77 |
| 1515664 | CIF | C57 H162 N9 O3 Si18 U3 | P 1 21/c 1 | 30.0251; 15.6531; 22.4759 90; 103.691; 90 | 10263.2 | Arnold, Polly L.; Turner, Zoë R.; Bellabarba, Ronan M.; Tooze, Robert P. Carbon monoxide coupling and functionalisation at a simple uranium coordination complex Chemical Science, 2011, 2, 77 |
| 1515665 | CIF | C57 H60 B F20 N2 O2 P Zr | C 1 2/c 1 | 36.218; 12.304; 31.224 90; 122.397; 90 | 11749 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair‒nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515666 | CIF | C30 H30 B F12 N2 O P | P 21 21 21 | 11.6507; 13.7877; 19.5448 90; 90; 90 | 3139.6 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515667 | CIF | C60 H66 B2 F24 N4 O2 P2 | P -1 | 11.691; 12.8326; 13.5442 63.637; 88.082; 72.341 | 1722.62 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515668 | CIF | C36 H36 B F12 N2 O P | P b c a | 19.5019; 16.3963; 21.7273 90; 90; 90 | 6947.5 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515669 | CIF | C37 H47 B Cl F3 O P2 | P 1 21/c 1 | 9.5346; 21.1476; 17.6877 90; 102.604; 90 | 3480.5 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair‒nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515670 | CIF | C55 H42 B F20 N2 O P | P -1 | 12.3838; 12.5415; 18.4913 94.703; 103.546; 101.734 | 2708.21 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515671 | CIF | C42 H43 B F15 N2 O P Zr | P 1 21/n 1 | 15.6655; 12.5681; 21.5094 90; 93.812; 90 | 4225.5 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair‒nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515672 | CIF | C120 H60 Cd13 O66 S24 | F m -3 c | 39.2048; 39.2048; 39.2048 90; 90; 90 | 60258 | Yuan, Daqiang; Zhao, Dan; Timmons, Daren J.; Zhou, Hong-Cai A stepwise transition from microporosity to mesoporosity in metal‒organic frameworks by thermal treatment Chemical Science, 2011, 2, 103 |
| 1515673 | CIF | C40.25 H36.5 Cl0.5 N10 | P 1 21/n 1 | 13.668; 12.3175; 24.2737 90; 100.887; 90 | 4013.1 | Breiten, Benjamin; Wu, Yi-Lin; Jarowski, Peter D.; Gisselbrecht, Jean-Paul; Boudon, Corinne; Griesser, Markus; Onitsch, Christine; Gescheidt, Georg; Schweizer, W. Bernd; Langer, Nicolle; Lennartz, Christian; Diederich, François Donor-substituted octacyano[4]dendralenes: a new class of cyano-rich non-planar organic acceptors Chemical Science, 2011, 2, 88 |
| 1515674 | CIF | C52 H60 N10 | P 1 21/c 1 | 14.1265; 21.8947; 15.3826 90; 93.6655; 90 | 4748.04 | Breiten, Benjamin; Wu, Yi-Lin; Jarowski, Peter D.; Gisselbrecht, Jean-Paul; Boudon, Corinne; Griesser, Markus; Onitsch, Christine; Gescheidt, Georg; Schweizer, W. Bernd; Langer, Nicolle; Lennartz, Christian; Diederich, François Donor-substituted octacyano[4]dendralenes: a new class of cyano-rich non-planar organic acceptors Chemical Science, 2011, 2, 88 |
| 1515675 | CIF | C19 H22 N2 O5 S | P 1 21/n 1 | 6.9683; 21.374; 12.566 90; 91.091; 90 | 1871.2 | Stoll, Armin H.; Blakey, Simon B. Rhodium catalyzed allene amidation: a facile entry into 2-amidoallylcations for unusual [3 + 3] annulation reactions Chemical Science, 2011, 2, 112 |
| 1515676 | CIF | C11 H19 N O5 S | P 1 21/n 1 | 12.6837; 8.7119; 13.9765 90; 110.965; 90 | 1442.15 | Stoll, Armin H.; Blakey, Simon B. Rhodium catalyzed allene amidation: a facile entry into 2-amidoallylcations for unusual [3 + 3] annulation reactions Chemical Science, 2011, 2, 112 |
| 1515677 | CIF | C25.5 H29.5 Cl1.5 N O2 S | C 1 2/c 1 | 35.8601; 6.0216; 23.1924 90; 111.979; 90 | 4644.1 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515678 | CIF | C28 H29 N O2 S | P 1 21 1 | 8.962; 10.4716; 12.3795 90; 100.903; 90 | 1140.8 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515679 | CIF | C27 H27 N O2 S | P 1 21/c 1 | 13.6368; 7.9693; 21.253 90; 97.724; 90 | 2288.7 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515680 | CIF | C33 H31 N O2 S | C 1 2/c 1 | 52.0309; 6.2004; 16.2321 90; 98.15; 90 | 5183.8 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515681 | CIF | C28 H29 N O2 S | P c c n | 34.3459; 11.0908; 12.4392 90; 90; 90 | 4738.4 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515682 | CIF | C32 H32 O4 S2 | P -1 | 10.0661; 11.2303; 12.7093 108.467; 92.142; 102.893 | 1319.3 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515683 | CIF | C33 H34 O4 S2 | P -1 | 10.7285; 10.9833; 13.0463 111.389; 92.772; 103.536 | 1376.4 | Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science, 2011, 2, 141 |
| 1515684 | CIF | C112 H222 Co8 Gd8 N4 O73 P8 | C 1 2/c 1 | 35.624; 20.7297; 25.0866 90; 101.416; 90 | 18159.3 | Zheng, Yan-Zhen; Evangelisti, Marco; Winpenny, Richard E. P. Co‒Gd phosphonate complexes as magnetic refrigerants Chemical Science, 2011, 2, 99 |
| 1515685 | CIF | C104 H198 Co8 Gd4 O50 P6 | P 1 21/n 1 | 22.622; 11.63; 30.189 90; 97.612; 90 | 7872.5 | Zheng, Yan-Zhen; Evangelisti, Marco; Winpenny, Richard E. P. Co‒Gd phosphonate complexes as magnetic refrigerants Chemical Science, 2011, 2, 99 |
| 1515686 | CIF | C116 H174 Co4 Gd6 N2 O46 P6 | P 1 21/n 1 | 13.55; 29.003; 18.2506 90; 97.588; 90 | 7109.5 | Zheng, Yan-Zhen; Evangelisti, Marco; Winpenny, Richard E. P. Co‒Gd phosphonate complexes as magnetic refrigerants Chemical Science, 2011, 2, 99 |
| 1515687 | CIF | C64 H88 Cl2 N8 O5 Zr2 | P 21 21 21 | 14.7192; 20.6103; 21.1775 90; 90; 90 | 6424.6 | Nguyen, Andy I.; Zarkesh, Ryan A.; Lacy, David C.; Thorson, Megan K.; Heyduk, Alan F. Catalytic nitrene transfer by a zirconium(iv) redox-active ligand complex Chemical Science, 2011, 2, 166 |
| 1515688 | CIF | C84 H50 B2 F48 Pt3 | C 1 2/c 1 | 19.6876; 18.0489; 24.2236 90; 104.85; 90 | 8320.1 | Murahashi, Tetsuro; Usui, Kentaro; Inoue, Ryou; Ogoshi, Sensuke; Kurosawa, Hideo Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl Chemical Science, 2011, 2, 117 |
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