Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 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 |
| 1515085 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.7899; 5.9402; 10.9075 90; 92.67; 90 | 504.18 | 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 |
| 1515086 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.7378; 5.9245; 10.9232 90; 92.821; 90 | 500.14 | 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 |
| 1515087 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.6885; 5.9097; 10.9351 90; 92.984; 90 | 496.18 | 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 |
| 1515088 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.8926; 5.9767; 10.8739 90; 92.47; 90 | 512.46 | 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 |
| 1515089 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.433; 5.8092; 10.9101 90; 93.736; 90 | 470.09 | 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 |
| 1515090 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.2027; 5.6926; 10.9057 90; 94.504; 90 | 445.78 | 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 |
| 1515091 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.0544; 5.6024; 10.8873 90; 95.062; 90 | 428.61 | 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 |
| 1515092 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.992; 5.559; 10.875 90; 95.344; 90 | 420.86 | 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 |
| 1515093 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.9259; 5.5072; 10.8549 90; 95.667; 90 | 412.01 | 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 |
| 1515094 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.871; 5.467; 10.8393 90; 95.878; 90 | 405.02 | 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 |
| 1515095 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.828; 5.4298; 10.8209 90; 96.076; 90 | 398.93 | 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 |
| 1515096 | CIF | C69 H54 Ag F9 N8 O9 S3 | P 1 21/c 1 | 17.533; 20.0767; 21.7131 90; 96.387; 90 | 7595.7 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515097 | CIF | C136 H104 Ag4 F12 N16 O12 S4 | P 1 2/n 1 | 17.1508; 16.7972; 24.955 90; 106.286; 90 | 6900.7 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515098 | CIF | C132 H104 Ag4 F24 N16 P4 | P -1 | 14.122; 17.707; 32.571 93.111; 97.694; 109.952 | 7543 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515099 | CIF | C68 H52 F6 N8 O6 Pt S2 | P 1 21/c 1 | 28.295; 8.808; 29.743 90; 97.637; 90 | 7346.9 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515100 | CIF | C72 H64 F6 N8 O8 Ru S4 | P 1 21/n 1 | 12.306; 18.427; 16.292 90; 100.907; 90 | 3627.7 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515101 | CIF | C69 H54 Cl2 Co F6 N8 O6 S2 | P 1 21/n 1 | 16.995; 13.564; 27.388 90; 93.097; 90 | 6304 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515102 | CIF | C70 H58 Cl2 Cr F6 N10 P | P 1 21 1 | 12.1931; 13.7529; 18.886 90; 91.471; 90 | 3166 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515103 | CIF | C68 H54 Ag3 Cl4 F3 N8 O3 S | C 1 2/c 1 | 33.096; 16.4589; 26.678 90; 120.04; 90 | 12580.1 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515104 | CIF | C68 H52 F6 N8 O6 Pd S2 | P 1 21/c 1 | 28.29; 8.8229; 29.69 90; 97.815; 90 | 7341.8 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515105 | CIF | C68 H52 F6 N8 Ni O6 S2 | P 1 21/n 1 | 17.1544; 28.6906; 29.7309 90; 104.592; 90 | 14160.7 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515106 | CIF | C66 H52 F6 I2 N8 P Rh | P 1 21 1 | 12.646; 13.785; 18.779 90; 90.702; 90 | 3273 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515107 | CIF | C69 H52 Au F9 N8 O9 S3 | P 1 21/n 1 | 18.2751; 13.6076; 27.721 90; 92.926; 90 | 6884.7 | Lu, Zheng; Cramer, S. Alan; Jenkins, David M. Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes Chemical Science, 2012, 3, 3081 |
| 1515108 | CIF | C45 H35 Cl4 Co2 F18 N10 O2 P3 | P 1 21/c 1 | 13.6543; 24.252; 18.6535 90; 94.437; 90 | 6158.5 | Rigsby, Matthew L.; Mandal, Sukanta; Nam, Wonwoo; Spencer, Lara C.; Llobet, Antoni; Stahl, Shannon S. Cobalt analogs of Ru-based water oxidation catalysts: overcoming thermodynamic instability and kinetic lability to achieve electrocatalytic O2 evolution Chemical Science, 2012, 3, 3058 |
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