Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1572717 | CIF | C8 H16 Ag Cs N2 O8 | P -1 | 9.7035; 13.0999; 13.5608 68.125; 73.051; 76.873 | 1516.49 | Larsen, Emil Mickey Hilligsøe; Brock-Nannestad, Theis; Skibsted, Jørgen; Reinholdt, Anders; Bendix, Jesper A Homoleptic AgIII Complex Stabilized by Succinimidate Ligands Chemical Science, 2024 |
| 1572718 | CIF | C32 H48 Ag2 N8 O24 Rb2 | I 4/m | 11.3963; 11.3963; 8.5069 90; 90; 90 | 1104.84 | Larsen, Emil Mickey Hilligsøe; Brock-Nannestad, Theis; Skibsted, Jørgen; Reinholdt, Anders; Bendix, Jesper A Homoleptic AgIII Complex Stabilized by Succinimidate Ligands Chemical Science, 2024 |
| 1572719 | CIF | C2 H3 Ag0.12 K0.12 N0.5 O1.5 | I 4/m | 11.554; 11.554; 8.42 90; 90; 90 | 1124 | Larsen, Emil Mickey Hilligsøe; Brock-Nannestad, Theis; Skibsted, Jørgen; Reinholdt, Anders; Bendix, Jesper A Homoleptic AgIII Complex Stabilized by Succinimidate Ligands Chemical Science, 2024 |
| 1572730 | CIF | C34 H57 La2 Li N8 O38 P10 | P -1 | 12.2018; 16.4476; 16.9585 68.442; 69.632; 79.14 | 2960.26 | Ma, Yu-Juan; Xu, Fei; Ren, Xin-Ye; Chen, Fan-Yao; Pan, Jie; Li, Jinhua; Han, Song-De; Wang, Guo-Ming Photoinduced electron-transfer strategy for switchable fluorescence and phosphorescence in lanthanide-based coordination polymers Chemical Science, 2024 |
| 1572731 | CIF | C34 H57 La2 Li N8 O38 P10 | P -1 | 12.1985; 16.4328; 16.9643 68.463; 69.625; 79.152 | 2958.13 | Ma, Yu-Juan; Xu, Fei; Ren, Xin-Ye; Chen, Fan-Yao; Pan, Jie; Li, Jinhua; Han, Song-De; Wang, Guo-Ming Photoinduced electron-transfer strategy for switchable fluorescence and phosphorescence in lanthanide-based coordination polymers Chemical Science, 2024 |
| 1572732 | CIF | C31 H32 B2 N2 | P b c n | 15.9465; 14.8115; 22.4995 90; 90; 90 | 5314.2 | Shibutani, Yuki; Kusumoto, Shuhei; Nozaki, Kyoko Fully Conjugated Tetraborylethylene: Selenium Mediated C–C Double Bond Formation from Diborylcarbenoid Chemical Science, 2024 |
| 1572733 | CIF | C62 H64 B4 N4 Se | P 21 21 2 | 23.3386; 22.7872; 12.1836 90; 90; 90 | 6479.5 | Shibutani, Yuki; Kusumoto, Shuhei; Nozaki, Kyoko Fully Conjugated Tetraborylethylene: Selenium Mediated C–C Double Bond Formation from Diborylcarbenoid Chemical Science, 2024 |
| 1572734 | CIF | C65 H71 B4 N4 S | P 1 21/n 1 | 15.6639; 16.1414; 23.311 90; 93.896; 90 | 5880.3 | Shibutani, Yuki; Kusumoto, Shuhei; Nozaki, Kyoko Fully Conjugated Tetraborylethylene: Selenium Mediated C–C Double Bond Formation from Diborylcarbenoid Chemical Science, 2024 |
| 1572735 | CIF | C62 H64 B4 N4 Se4.85 | P b c a | 14.4403; 25.7841; 32.0022 90; 90; 90 | 11915.4 | Shibutani, Yuki; Kusumoto, Shuhei; Nozaki, Kyoko Fully Conjugated Tetraborylethylene: Selenium Mediated C–C Double Bond Formation from Diborylcarbenoid Chemical Science, 2024 |
| 1572736 | CIF | C31 H35 Au Cl N4 | P 31 | 18.1411; 18.1411; 10.1359 90; 90; 120 | 2888.8 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572737 | CIF | C31 H35 Au Cl N5 O0 | P -1 | 9.2394; 13.0032; 13.1246 82.772; 84.032; 85.266 | 1551.95 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572738 | CIF | C57 H60 Au2 B2 Cl2 F10 N8 | P 1 21/c 1 | 19.51; 10.172; 28.549 90; 97.256; 90 | 5620 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572739 | CIF | C37 H36 Au B Cl2 F4 N4 | P -1 | 9.5527; 13.7464; 14.2095 77.893; 80.575; 80.828 | 1784.6 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572740 | CIF | C31 H35 Au B Cl3 F4 N4 | P -1 | 10.008; 10.3247; 16.4908 86.08; 89.998; 69.301 | 1589.73 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572741 | CIF | C62 H70 Au2 B2 Cl6 F8 N10 O | P 1 21/n 1 | 9.3865; 17.981; 20.354 90; 98.923; 90 | 3393.7 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572742 | CIF | C28 H30 Au B F4 N4 | P -1 | 9.2528; 16.3004; 18.1706 90.162; 95.521; 95.26 | 2716.2 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572743 | CIF | C62 H73 B6 F24 N13 | P -1 | 14.84; 15.5; 16.5 95.25; 99.16; 108.37 | 3515 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572744 | CIF | C62 H72 Au2 B2 Cl12 F8 N8 | P -1 | 10.54; 13.2869; 13.5269 87.44; 88.406; 74.202 | 1820.7 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572745 | CIF | C29 H30 Au B F4 N4 O2 | P 1 21/n 1 | 13.4261; 12.5589; 16.0123 90; 90.397; 90 | 2699.9 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572746 | CIF | C31 H35 Au B Cl2 F5 N4 | P n a 21 | 19.7358; 17.0365; 18.688 90; 90; 90 | 6283.4 | Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species Chemical Science, 2024 |
| 1572747 | CIF | C30 H26 Br F3 N O3 P S | P -1 | 10.2345; 12.0047; 13.9944 112.256; 111.385; 90.484 | 1460.15 | Guo, Jia-Dong; Alemu Korsaye, Feven; Schutz, Dorian; Ciofini, Ilaria; Miesch, Laurence Photocatalyst-free, visible-light-induced regio- and stereoselective synthesis of phosphorylated enamines from N-allenamides via [1,3]-sulfonyl shift at room temperature Chemical Science, 2024 |
| 1572748 | CIF | C18 H18 F3 N O2 S | P 1 21/c 1 | 17.628; 7.0992; 13.6449 90; 92.821; 90 | 1705.5 | Guo, Jia-Dong; Alemu Korsaye, Feven; Schutz, Dorian; Ciofini, Ilaria; Miesch, Laurence Photocatalyst-free, visible-light-induced regio- and stereoselective synthesis of phosphorylated enamines from N-allenamides via [1,3]-sulfonyl shift at room temperature Chemical Science, 2024 |
| 1572749 | CIF | C29 H28 N O3 P S | P -1 | 11.2161; 11.2502; 11.6904 89.379; 62.804; 74.413 | 1253 | Guo, Jia-Dong; Alemu Korsaye, Feven; Schutz, Dorian; Ciofini, Ilaria; Miesch, Laurence Photocatalyst-free, visible-light-induced regio- and stereoselective synthesis of phosphorylated enamines from N-allenamides via [1,3]-sulfonyl shift at room temperature Chemical Science, 2024 |
| 1572750 | CIF | C22 H26 Cl2 N6 O8 Zn | P -1 | 10.9166; 11.0302; 11.9822 71.314; 70.32; 84.685 | 1286.73 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572751 | CIF | C24 H32 F6 N8 O6 S2 Zn | P 1 | 8.4126; 8.7175; 11.8242 68.674; 81.829; 82.012 | 795.98 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572752 | CIF | C24 H26 F6 N6 O6 S2 Zn | P -1 | 9.7462; 11.2383; 14.4759 84.92; 84.334; 76.057 | 1527.87 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572753 | CIF | C22 H32 Cl N9 O6 Zn | P 1 21/c 1 | 7.9977; 24.6887; 13.6159 90; 93.213; 90 | 2684.3 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572754 | CIF | C28 H41 Cl2 N6 O9 P Zn | P 1 21/c 1 | 11.9275; 14.57; 20.8368 90; 104.442; 90 | 3506.7 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572755 | CIF | C64 H67 Cl3 N14 O13 Zn2 | C 1 2/c 1 | 32.352; 11.149; 23.519 90; 128.178; 90 | 6669 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572756 | CIF | C22 H26 Cl N7 O6 Zn | P n n a | 14.0967; 11.9311; 14.7941 90; 90; 90 | 2488.2 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572757 | CIF | C28 H47 Cl2 N8 O9 P Zn | P 1 21/c 1 | 8.5047; 21.305; 20.512 90; 92.188; 90 | 3713.9 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572758 | CIF | C32 H30 F6 N6 O6 S2 Zn | P -1 | 9.554; 12.332; 16.893 109.731; 90.608; 91.289 | 1872.7 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572759 | CIF | C30 H30 Cl N7 O6 Zn | P 1 21/n 1 | 19.739; 8.1896; 23.969 90; 111.897; 90 | 3595.2 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572760 | CIF | C24 H35 Cl2 N9 O8 Zn | P b c a | 18.1198; 16.7592; 20.9767 90; 90; 90 | 6370.1 | Anju, B. S.; Nair, Neeraja R.; Rajput, Janavi; Bertke, Jeffery A.; Mondal, Bhaskar; Kundu, Subrata Role of Ancillary Ligands in S-nitrosothiol and NO Generation from Nitrite-Thiol Interactions at Mononuclear Zinc(II) Sites Chemical Science, 2024 |
| 1572761 | CIF | C49.5 H37 Cl N8 | P 1 21/c 1 | 13.982; 12.019; 23.87 90; 97.56; 90 | 3976.5 | Fracassa, Alessandro; Calogero, Francesco; Pavan, Giulio; Nikolaou, Pavlos; Fermi, Andrea; Ceroni, Paola; Paolucci, Francesco; Cozzi, Pier Giorgio; Scattolin, Thomas; Demitri, Nicola; Negri, Fabrizia; Gualandi, Andrea; Aliprandi, Alessandro; Valenti, Giovanni Tunable electrochemiluminescence of TADF luminophores: manipulating efficiency and unveiling water-soluble emitters Chemical Science, 2024 |
| 1572762 | CIF | C27 H32.82 N6 O9 Sc | P 1 n 1 | 7.9195; 11.7007; 14.6519 90; 98.998; 90 | 1341 | Kelderman, Cormac A.; Glaser, Owen M.; Whetter, Jennifer N.; Aluicio-Sarduy, Eduardo; Mixdorf, Jason C.; Sanders, Kyana M.; Boros, Eszter; Guzei, Ilia; Barnhart, Todd E.; Engle, Jonathan W. Charting the Coordinative Landscape of the 18F-Sc/44Sc/177Lu triad with the Tri-aza-cyclononane (tacn) Scaffold. Chemical Science, 2024 |
| 1572763 | CIF | C16 H24 B2 Cl2 | P 1 21 1 | 8.5963; 14.7551; 13.323 90; 94.308; 90 | 1685.11 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572764 | CIF | C44 H70 B Cl N2 | P 1 21/c 1 | 11.6102; 20.6129; 16.4977 90; 95.399; 90 | 3930.7 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572765 | CIF | C23 H35 B Br N | P -1 | 8.7428; 9.4037; 13.3258 80.686; 87.975; 80.672 | 1066.79 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572766 | CIF | C22 H36 B Cl N | P 1 21 1 | 9.2417; 10.0889; 11.8541 90; 110.192; 90 | 1037.33 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572767 | CIF | C18 H23 B | P 1 21/c 1 | 8.7528; 10.9747; 15.4186 90; 91.674; 90 | 1480.47 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572768 | CIF | C36 H55 B Br Cl2 N | P 1 21/c 1 | 14.0779; 12.7663; 20.0966 90; 91.539; 90 | 3610.5 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572769 | CIF | C35 H53 B Br N | P 1 21/c 1 | 10.81; 12.282; 23.47 90; 93.75; 90 | 3109 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572770 | CIF | C36 H48 B Cl7 N2 | P -1 | 11.7206; 12.0045; 15.0853 108.946; 93.723; 95.092 | 1989.7 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572771 | CIF | C23 H35 B Cl N | P b c a | 12.0999; 13.3302; 25.993 90; 90; 90 | 4192.5 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572772 | CIF | C23 H35 B Br N | P b c a | 12.1571; 13.5618; 25.839 90; 90; 90 | 4260.1 | Zhang, Chonghe; Gilliard, Robert J.; Cummins, Christopher Arene extrusion as an approach to reductive elimination at boron: Implication of carbene-ligated haloborylene as a transient reactive intermediate Chemical Science, 2024 |
| 1572773 | CIF | C78 H72 N8 O16 Zn3 | P 1 21/c 1 | 23.3813; 8.8522; 18.8122 90; 111.915; 90 | 3612.3 | Logelin, Madison E.; Schreiber, Eric; Mercado, Brandon Q.; Burke, Michael J.; Davis, Caitlin M.; Bartholomew, Amymarie K. Exfoliation of a metal-organic framework enabled by post-synthetic cleavage of a dipyridyl dianthracene ligand. Chemical science, 2024, 15, 15198-15204 |
| 1572774 | CIF | C66 H44 N4 O12 Zn3 | P 1 21/c 1 | 16.9; 9.5; 18.2 90; 94.7; 90 | 2912 | Logelin, Madison E.; Schreiber, Eric; Mercado, Brandon Q.; Burke, Michael J.; Davis, Caitlin M.; Bartholomew, Amymarie K. Exfoliation of a metal-organic framework enabled by post-synthetic cleavage of a dipyridyl dianthracene ligand. Chemical science, 2024, 15, 15198-15204 |
| 1572775 | CIF | C45 H37 B Cl3 F2 N9 O2 | P -1 | 11.0839; 13.719; 15.383 106.314; 104.337; 105.219 | 2031.6 | Pim, Sebastian; Bourgès, Anaïs C; Wu, Dan; Durán-Sampedro, Gonzalo; Garre, Massimiliano; O'Shea, Donal F Observing bioorthogonal macrocyclizations in the nuclear envelope of live cells using on/on fluorescence lifetime microscopy. Chemical science, 2024, 15, 14913-14923 |
| 1572776 | CIF | C16 H13 Br2 N O2 | P 1 21/n 1 | 9.9175; 17.323; 10.7669 90; 115.609; 90 | 1668.1 | Rodriguez Treviño, Agustin M; Loch-Temzelides, Pierre; Pandiri, Sanjay; Kirkland, Justin K.; Davenport, Michael T.; Aguinaga, Ulises; Yousufuddin, Muhammed; Ess, Daniel H.; Kürti, László Forging structural complexity: diastereoselective synthesis of densely substituted β-lactams with dual functional handles for enhanced core modifications. Chemical science, 2024, 15, 14668-14676 |
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