Crystallography Open Database
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Searching journal of publication like 'Chemical science' volume of publication is 15
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1570619 | CIF | C3.39 H4.36 Mn0.12 N0.36 O0.24 | P 1 21/n 1 | 13.155; 12.7828; 15.378 90; 100.227; 90 | 2544.8 | Mahato, Samyadeb; VandeVen, Warren; MacNeil, Gregory A.; Pulfer, Jason M.; Storr, Tim Untangling ancillary ligand donation <i>versus</i> locus of oxidation effects on metal nitride reactivity. Chemical science, 2024, 15, 2211-2220 |
| 1570620 | CIF | C60.33 H36.33 O64.66 Zr12 | P -3 1 m | 26.659; 26.659; 10.103 90; 90; 120 | 6218.3 | Shiraishi, Kyoko; Otsubo, Kazuya; Kato, Kenichi; Sadakiyo, Masaaki A novel threefold interpenetrated zirconium metal-organic framework exhibiting separation ability for strong acids. Chemical science, 2024, 15, 1441-1448 |
| 1570621 | CIF | C29 H18 F3 N | P 42/n :2 | 22.8051; 22.8051; 8.2792 90; 90; 90 | 4305.78 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570622 | CIF | C38 H39 N | P -1 | 10.9754; 12.115; 12.3347 116.431; 95.048; 94.47 | 1450.31 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570623 | CIF | C94 H90 N2 | P 1 21/n 1 | 27.4355; 7.9543; 31.2422 90; 91.937; 90 | 6814.1 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570624 | CIF | C64 H42 N2 | P 1 21/n 1 | 15.719; 8.3643; 33.8437 90; 101.487; 90 | 4360.59 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570625 | CIF | C18 H19 N0.5 | P 1 21/c 1 | 15.0249; 11.6534; 16.3566 90; 97.312; 90 | 2840.61 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570626 | CIF | C52 H42 | P -1 | 12.0253; 14.285; 15.2395 63.792; 67.462; 77.789 | 2166.5 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570627 | CIF | C58 H45 Cl2 N | P -1 | 10.381; 14.348; 15.6103 94.929; 102.901; 107.046 | 2138.07 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570628 | CIF | C44 H26 Cl6 S | P 1 21/c 1 | 12.2354; 14.2615; 20.8253 90; 98.248; 90 | 3596.33 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570629 | CIF | C84 H92 S2 | P 1 21/c 1 | 22.0314; 12.4409; 26.6247 90; 112.159; 90 | 6758.6 | Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science, 2024, 15, 2112-2117 |
| 1570632 | CIF | C39 H41 Cu Ge N2 | P -1 | 10.65; 11.2963; 15.0976 111.368; 93.137; 92.33 | 1685.35 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570633 | CIF | C40 H43 Cu Ge N2 | P 1 21/n 1 | 8.9616; 19.7494; 20.04 90; 100.99; 90 | 3481.76 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570634 | CIF | C40 H46 Cu N3 O | P c a 21 | 16.2264; 10.8168; 20.4792 90; 90; 90 | 3594.46 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570635 | CIF | C92 H102 Cu2 Ge2 N4 S4 | P -1 | 13.1905; 18.6418; 20.1369 66.024; 81.401; 69.363 | 4233.9 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570636 | CIF | C50 H60 Cu Ge N3 S | P 1 21/c 1 | 10.22373; 20.07164; 22.27774 90; 98.8634; 90 | 4516.96 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570637 | CIF | C53 H57 Cu Ge N2 | P 1 21/n 1 | 12.3095; 19.8911; 18.5854 90; 91.1959; 90 | 4549.63 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570638 | CIF | C90 H102 Cu2 Ge2 N4 | P -1 | 11.0264; 19.2655; 20.3965 86.283; 77.281; 73.472 | 4051.84 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570639 | CIF | C53 H57 Cu Ge N2 | P 1 21/n 1 | 14.9501; 19.7103; 16.1176 90; 105.269; 90 | 4581.74 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570640 | CIF | C59 H57 Cu Ge N4 O2 | P 1 21/n 1 | 11.48162; 30.4535; 14.25277 90; 94.8925; 90 | 4965.4 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570641 | CIF | C46 H55 Cu Ge N2 | P 21 21 21 | 12.0126; 17.1438; 19.7933 90; 90; 90 | 4076.26 | Charman, Rex S. C.; Evans, Nick J.; English, Laura E.; Neale, Samuel E.; Vasko, Petra; Mahon, Mary F.; Liptrot, David J. The structures and reactivity of NHC-supported copper(i) triphenylgermyls Chemical Science, 2024, 15, 584-593 |
| 1570642 | CIF | C20 H26 O12 Ti2 | P 1 21/c 1 | 9.0139; 14.186; 8.9545 90; 90.487; 90 | 1145 | Hou, Jinle; Huang, Nahui; Acharya, Dinesh; Liu, Yuxin; Zhu, Jiaying; Teng, Jiaxin; Wang, Zhi; Qu, Konggang; Zhang, Xianxi; Sun, Di All-catecholate-stabilized black titanium-oxo clusters for efficient photothermal conversion. Chemical science, 2024, 15, 2655-2664 |
| 1570643 | CIF | C134 H100 O58 Ti16 | P -1 | 15.114; 16.444; 17.284 63.041; 64.513; 71.596 | 3417.2 | Hou, Jinle; Huang, Nahui; Acharya, Dinesh; Liu, Yuxin; Zhu, Jiaying; Teng, Jiaxin; Wang, Zhi; Qu, Konggang; Zhang, Xianxi; Sun, Di All-catecholate-stabilized black titanium-oxo clusters for efficient photothermal conversion. Chemical science, 2024, 15, 2655-2664 |
| 1570644 | CIF | C154 H136 O56 Ti16 | P -1 | 16.79; 16.977; 17.003 113.206; 113.379; 98.474 | 3814.6 | Hou, Jinle; Huang, Nahui; Acharya, Dinesh; Liu, Yuxin; Zhu, Jiaying; Teng, Jiaxin; Wang, Zhi; Qu, Konggang; Zhang, Xianxi; Sun, Di All-catecholate-stabilized black titanium-oxo clusters for efficient photothermal conversion. Chemical science, 2024, 15, 2655-2664 |
| 1570645 | CIF | C72 H79 O29 Ti8 | P -1 | 13.7327; 14.2235; 23.4194 87.685; 89.986; 66.441 | 4189.1 | Hou, Jinle; Huang, Nahui; Acharya, Dinesh; Liu, Yuxin; Zhu, Jiaying; Teng, Jiaxin; Wang, Zhi; Qu, Konggang; Zhang, Xianxi; Sun, Di All-catecholate-stabilized black titanium-oxo clusters for efficient photothermal conversion. Chemical science, 2024, 15, 2655-2664 |
| 1570646 | CIF | C59 H13 F25 N4 O S2 | P -1 | 9.774; 14.769; 18.881 95.08; 95.96; 92.17 | 2697 | Sun, Meng; Xie, Yongshu; Baryshnikov, Glib; Li, Chengjie; Sha, Feng; Wu, Xinyan; Ågren, Hans; Li, Shijun; Li, Qizhao Mono- and bis-Pd(ii) complexes of N-confused dithiahexaphyrin(1.1.1.1.1.0) with the absorption and aromaticity modulated by Pd(ii) coordination, macrocycle contraction and ancillary ligands. Chemical science, 2024, 15, 2047-2054 |
| 1570647 | CIF | C77 H27 Cl F25 N4 O P Pd S2 | P -1 | 16.9156; 17.3251; 19.0029 70.416; 65.162; 76.985 | 4738.3 | Sun, Meng; Xie, Yongshu; Baryshnikov, Glib; Li, Chengjie; Sha, Feng; Wu, Xinyan; Ågren, Hans; Li, Shijun; Li, Qizhao Mono- and bis-Pd(ii) complexes of N-confused dithiahexaphyrin(1.1.1.1.1.0) with the absorption and aromaticity modulated by Pd(ii) coordination, macrocycle contraction and ancillary ligands. Chemical science, 2024, 15, 2047-2054 |
| 1570648 | CIF | C59 H11 F25 N4 O Pd S2 | P -1 | 12.633; 16.87; 18.51 113.418; 96.893; 108.505 | 3292.5 | Sun, Meng; Xie, Yongshu; Baryshnikov, Glib; Li, Chengjie; Sha, Feng; Wu, Xinyan; Ågren, Hans; Li, Shijun; Li, Qizhao Mono- and bis-Pd(ii) complexes of N-confused dithiahexaphyrin(1.1.1.1.1.0) with the absorption and aromaticity modulated by Pd(ii) coordination, macrocycle contraction and ancillary ligands. Chemical science, 2024, 15, 2047-2054 |
| 1570649 | CIF | C52 H12 F20 N4 O Pd S2 | P -1 | 17.633; 18.145; 19.027 104.695; 103.672; 112.112 | 5067.6 | Sun, Meng; Xie, Yongshu; Baryshnikov, Glib; Li, Chengjie; Sha, Feng; Wu, Xinyan; Ågren, Hans; Li, Shijun; Li, Qizhao Mono- and bis-Pd(ii) complexes of N-confused dithiahexaphyrin(1.1.1.1.1.0) with the absorption and aromaticity modulated by Pd(ii) coordination, macrocycle contraction and ancillary ligands. Chemical science, 2024, 15, 2047-2054 |
| 1570650 | CIF | C87 H36 F25 N6 O P Pd2 S2 | P -1 | 14.977; 16.782; 16.991 106.814; 90.699; 107.905 | 3866 | Sun, Meng; Xie, Yongshu; Baryshnikov, Glib; Li, Chengjie; Sha, Feng; Wu, Xinyan; Ågren, Hans; Li, Shijun; Li, Qizhao Mono- and bis-Pd(ii) complexes of N-confused dithiahexaphyrin(1.1.1.1.1.0) with the absorption and aromaticity modulated by Pd(ii) coordination, macrocycle contraction and ancillary ligands. Chemical science, 2024, 15, 2047-2054 |
| 1570693 | CIF | C22 H23 B F N O2 | P 1 21/n 1 | 9.8733; 11.5417; 17.0581 90; 95.13; 90 | 1936.1 | Chen, Zunsheng; Nie, Biao; Li, Xiaoning; Liu, Teng; Li, Chunsheng; Huang, Jiuzhong Ligand-controlled regiodivergent Ni-catalyzed <i>trans</i>-hydroboration/carboboration of internal alkynes with B<sub>2</sub>pin<sub>2</sub>. Chemical science, 2024, 15, 2236-2242 |
| 1570694 | CIF | C23 H26 B N O2 | P -1 | 7.0732; 12.8154; 12.8838 109.101; 103.862; 102.475 | 1014.75 | Chen, Zunsheng; Nie, Biao; Li, Xiaoning; Liu, Teng; Li, Chunsheng; Huang, Jiuzhong Ligand-controlled regiodivergent Ni-catalyzed <i>trans</i>-hydroboration/carboboration of internal alkynes with B<sub>2</sub>pin<sub>2</sub>. Chemical science, 2024, 15, 2236-2242 |
| 1570695 | CIF | C20 H28 B N O2 | P 1 21/c 1 | 14.9832; 9.6904; 13.4858 90; 100.376; 90 | 1926.03 | Chen, Zunsheng; Nie, Biao; Li, Xiaoning; Liu, Teng; Li, Chunsheng; Huang, Jiuzhong Ligand-controlled regiodivergent Ni-catalyzed <i>trans</i>-hydroboration/carboboration of internal alkynes with B<sub>2</sub>pin<sub>2</sub>. Chemical science, 2024, 15, 2236-2242 |
| 1570696 | CIF | C22 H24 B N O2 | P -1 | 10.1597; 10.2937; 11.2498 79.933; 89.723; 76.12 | 1123.73 | Chen, Zunsheng; Nie, Biao; Li, Xiaoning; Liu, Teng; Li, Chunsheng; Huang, Jiuzhong Ligand-controlled regiodivergent Ni-catalyzed <i>trans</i>-hydroboration/carboboration of internal alkynes with B<sub>2</sub>pin<sub>2</sub>. Chemical science, 2024, 15, 2236-2242 |
| 1570697 | CIF | C22 H24 B N O2 | P -1 | 9.6547; 10.2621; 10.6861 102.169; 105.217; 103.684 | 949.7 | Chen, Zunsheng; Nie, Biao; Li, Xiaoning; Liu, Teng; Li, Chunsheng; Huang, Jiuzhong Ligand-controlled regiodivergent Ni-catalyzed <i>trans</i>-hydroboration/carboboration of internal alkynes with B<sub>2</sub>pin<sub>2</sub>. Chemical science, 2024, 15, 2236-2242 |
| 1570698 | CIF | C32 H27 F2 N3 O | C 1 c 1 | 14.9152; 9.8681; 18.7455 90; 111.468; 90 | 2567.6 | Jiang, Yonggang; Liu, Dongxiang; Zhang, Lening; Qin, Cuirong; Li, Hui; Yang, Haitao; Walsh, Patrick J.; Yang, Xiaodong Efficient construction of functionalized pyrroloindolines through cascade radical cyclization/intermolecular coupling. Chemical science, 2024, 15, 2205-2210 |
| 1570699 | CIF | C33 H31 F2 N3 O2 | P 1 21/n 1 | 10.1447; 26.4984; 10.7233 90; 106.691; 90 | 2761.2 | Jiang, Yonggang; Liu, Dongxiang; Zhang, Lening; Qin, Cuirong; Li, Hui; Yang, Haitao; Walsh, Patrick J.; Yang, Xiaodong Efficient construction of functionalized pyrroloindolines through cascade radical cyclization/intermolecular coupling. Chemical science, 2024, 15, 2205-2210 |
| 1570701 | CIF | C34 H19 B | P 1 2/c 1 | 20.652; 4.902; 21.645 90; 109.11; 90 | 2070.5 | Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science, 2024, 15, 2984-2989 |
| 1570702 | CIF | C34 H19 B | R 3 :H | 34.63; 34.63; 4.803 90; 90; 120 | 4988.2 | Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science, 2024, 15, 2984-2989 |
| 1570703 | CIF | C88 H64 B N3 O4 | P 1 21/c 1 | 26.86; 14.399; 16.935 90; 106.99; 90 | 6264 | Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science, 2024, 15, 2984-2989 |
| 1570724 | CIF | C22 H23 Br N2 O2 S | P 1 21 1 | 9.5459; 19.1854; 11.5679 90; 93.009; 90 | 2115.65 | Bulger, Ana S.; Nasrallah, Daniel J.; Tena Meza, Arismel; Garg, Neil K. Enantioselective nickel-catalyzed Mizoroki-Heck cyclizations of amide electrophiles. Chemical science, 2024, 15, 2593-2600 |
| 1570745 | CIF | C55 H63 Ge N2 P Si | P 1 21/n 1 | 17.1513; 13.5641; 20.7152 90; 98.907; 90 | 4761.1 | Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science, 2024, 15, 2391-2397 |
| 1570746 | CIF | C63 H79 N2 O2 P Si Sn | P 1 21 1 | 12.462; 15.316; 14.954 90; 97.32; 90 | 2831 | Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science, 2024, 15, 2391-2397 |
| 1570747 | CIF | C66 H79 Ge N2 O2 P Si | P 1 21/n 1 | 10.922; 20.846; 26.946 90; 94.951; 90 | 6112 | Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science, 2024, 15, 2391-2397 |
| 1570748 | CIF | C59 H73 Ge N2 O P5 Si | P -1 | 13.13; 13.51; 17.559 91.771; 105.725; 107.874 | 2831.2 | Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science, 2024, 15, 2391-2397 |
| 1570759 | CIF | C120 H104 Cu4 N12 O38 | P 1 21/n 1 | 19.7309; 16.8006; 24.9013 90; 93.538; 90 | 8238.82 | Doñagueda Suso, Beatriz; Wang, Zaoming; Kennedy, Alan R.; Fletcher, Ashleigh J.; Furukawa, Shuhei; Craig, Gavin A. Improving the gas sorption capacity in lantern-type metal-organic polyhedra by a scrambled cage method. Chemical science, 2024, 15, 2857-2866 |
| 1570760 | CIF | C148.66 H167.11 Cu4 N18.66 O46.56 | P 1 21/n 1 | 19.9031; 16.7668; 24.9964 90; 94.081; 90 | 8320.43 | Doñagueda Suso, Beatriz; Wang, Zaoming; Kennedy, Alan R.; Fletcher, Ashleigh J.; Furukawa, Shuhei; Craig, Gavin A. Improving the gas sorption capacity in lantern-type metal-organic polyhedra by a scrambled cage method. Chemical science, 2024, 15, 2857-2866 |
| 1570761 | CIF | C151.32 H173.29 Cu4 N18.66 O46.56 | P 1 21/n 1 | 19.9329; 16.7488; 25.2197 90; 94.831; 90 | 8389.74 | Doñagueda Suso, Beatriz; Wang, Zaoming; Kennedy, Alan R.; Fletcher, Ashleigh J.; Furukawa, Shuhei; Craig, Gavin A. Improving the gas sorption capacity in lantern-type metal-organic polyhedra by a scrambled cage method. Chemical science, 2024, 15, 2857-2866 |
| 1570762 | CIF | C138.88 H142.27 Cu4 N15.16 O44.67 | P 1 21/n 1 | 19.834; 16.8359; 25.5694 90; 96.331; 90 | 8486.15 | Doñagueda Suso, Beatriz; Wang, Zaoming; Kennedy, Alan R.; Fletcher, Ashleigh J.; Furukawa, Shuhei; Craig, Gavin A. Improving the gas sorption capacity in lantern-type metal-organic polyhedra by a scrambled cage method. Chemical science, 2024, 15, 2857-2866 |
| 1570763 | CIF | C22 H15 N O3 S | P 1 21/n 1 | 10.854; 10.173; 16.146 90; 95.651; 90 | 1774.1 | Shi, Zhaojiang; Dong, Shicheng; Liu, Ting; Wang, Wei-Zhen; Li, Nan; Yuan, Yaofeng; Zhu, Jun; Ye, Ke-Yin Electrochemical cascade migratory <i>versus ortho</i>-cyclization of 2-alkynylbenzenesulfonamides. Chemical science, 2024, 15, 2827-2832 |
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