Crystallography Open Database

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1570661 CIFC2 OP 62 2 21.89375; 1.89375; 3.44983
90; 90; 120
10.715Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570662 CIFCI -4 3 d3.57923; 3.57923; 3.57923
90; 90; 90
45.853Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570663 CIFC2 OR 3 c :H5.50285; 5.50285; 4.08619
90; 90; 120
107.158Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570664 CIFCP 64 2 21.89375; 1.89375; 3.44983
90; 90; 120
10.715Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570665 CIFC2 OI 41 3 24.74478; 4.74478; 4.74478
90; 90; 90
106.819Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570666 CIFC3 OP n -3 :22.776; 2.776; 2.776
90; 90; 90
21.392Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570667 CIFC3 OP 42/n n m :22.54838; 2.54838; 3.73553
90; 90; 90
24.259Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570668 CIFC3 OP 42/n n m :22.77588; 2.77588; 2.77623
90; 90; 90
21.392Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570669 CIFC3 OI a -34.43069; 4.43069; 4.43069
90; 90; 90
86.979Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570670 CIFC3 OI a -3 d4.43066; 4.43066; 4.43066
90; 90; 90
86.977Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570671 CIFC3 OI 41 3 24.2197; 4.2197; 4.2197
90; 90; 90
75.135Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570672 CIFC3 OI 41 3 24.19386; 4.19386; 4.19386
90; 90; 90
73.764Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570673 CIFC3 OI a -33.79654; 3.79654; 3.79654
90; 90; 90
54.722Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570674 CIFC3 OI 41 3 23.5931; 3.5931; 3.5931
90; 90; 90
46.388Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570675 CIFC3 OI 21 34.09382; 4.09382; 4.09382
90; 90; 90
68.61Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570676 CIFC4 OI 4 2 22.12045; 2.12045; 2.45424
90; 90; 90
11.035Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570677 CIFC6 OP m -3 n1.7889; 1.7889; 1.7889
90; 90; 90
5.725Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570678 CIFC6 OP 42 3 22.21608; 2.21608; 2.21608
90; 90; 90
10.883Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570679 CIFC12 OI m -3 m2.18345; 2.18345; 2.18345
90; 90; 90
10.409Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570680 CIFC6 N O2F 41 3 24.11415; 4.11415; 4.11415
90; 90; 90
69.637Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570681 CIFC12 N8 O3P 4 3 22.77525; 2.77525; 2.77525
90; 90; 90
21.375Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570682 CIFC4 N2 OP 6 2 23.266; 3.266; 1.1547
90; 90; 120
10.667Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570683 CIFC4 N2 OP 6/m m m6.0955; 6.0955; 2.31337
90; 90; 120
74.438Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570684 CIFC4 N2 OP 6/m m m4.93261; 4.93261; 2.36698
90; 90; 120
49.875Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570685 CIFC4 N2 OP -6 2 m5.88545; 5.88545; 1.65287
90; 90; 120
49.583Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570686 CIFC4 N2 OP 6/m3.266; 3.266; 1.1547
90; 90; 120
10.667Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570687 CIFC4 N2 OI 4 2 22.37485; 2.37485; 2.16458
90; 90; 90
12.208Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570688 CIFC4 N2 OP 4/n n c :22.37513; 2.37513; 2.16441
90; 90; 90
12.21Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570689 CIFC12 N4 O3I 4/m m m4.71504; 4.71504; 2.98081
90; 90; 90
66.268Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570690 CIFC12 N4 O3P n -3 n :12.3094; 2.3094; 2.3094
90; 90; 90
12.317Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570691 CIFC12 N4 O3I 4 3 22.3094; 2.3094; 2.3094
90; 90; 90
12.317Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570692 CIFC4 N OP 4 2 21.1547; 1.1547; 1.1547
90; 90; 90
1.54Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.
Chemical science, 2023, 14, 12984-12994
1570693 CIFC22 H23 B F N O2P 1 21/n 19.8733; 11.5417; 17.0581
90; 95.13; 90
1936.1Chen, 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 CIFC23 H26 B N O2P -17.0732; 12.8154; 12.8838
109.101; 103.862; 102.475
1014.75Chen, 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 CIFC20 H28 B N O2P 1 21/c 114.9832; 9.6904; 13.4858
90; 100.376; 90
1926.03Chen, 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 CIFC22 H24 B N O2P -110.1597; 10.2937; 11.2498
79.933; 89.723; 76.12
1123.73Chen, 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 CIFC22 H24 B N O2P -19.6547; 10.2621; 10.6861
102.169; 105.217; 103.684
949.7Chen, 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 CIFC32 H27 F2 N3 OC 1 c 114.9152; 9.8681; 18.7455
90; 111.468; 90
2567.6Jiang, 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 CIFC33 H31 F2 N3 O2P 1 21/n 110.1447; 26.4984; 10.7233
90; 106.691; 90
2761.2Jiang, 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 CIFC34 H19 BP 1 2/c 120.652; 4.902; 21.645
90; 109.11; 90
2070.5Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank
A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission.
Chemical science, 2024, 15, 2984-2989
1570702 CIFC34 H19 BR 3 :H34.63; 34.63; 4.803
90; 90; 120
4988.2Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank
A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission.
Chemical science, 2024, 15, 2984-2989
1570703 CIFC88 H64 B N3 O4P 1 21/c 126.86; 14.399; 16.935
90; 106.99; 90
6264Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank
A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission.
Chemical science, 2024, 15, 2984-2989
1570724 CIFC22 H23 Br N2 O2 SP 1 21 19.5459; 19.1854; 11.5679
90; 93.009; 90
2115.65Bulger, 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 CIFC55 H63 Ge N2 P SiP 1 21/n 117.1513; 13.5641; 20.7152
90; 98.907; 90
4761.1Sarkar, 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 CIFC63 H79 N2 O2 P Si SnP 1 21 112.462; 15.316; 14.954
90; 97.32; 90
2831Sarkar, 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 CIFC66 H79 Ge N2 O2 P SiP 1 21/n 110.922; 20.846; 26.946
90; 94.951; 90
6112Sarkar, 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 CIFC59 H73 Ge N2 O P5 SiP -113.13; 13.51; 17.559
91.771; 105.725; 107.874
2831.2Sarkar, 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 CIFC120 H104 Cu4 N12 O38P 1 21/n 119.7309; 16.8006; 24.9013
90; 93.538; 90
8238.82Doñagueda 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 CIFC148.66 H167.11 Cu4 N18.66 O46.56P 1 21/n 119.9031; 16.7668; 24.9964
90; 94.081; 90
8320.43Doñagueda 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 CIFC151.32 H173.29 Cu4 N18.66 O46.56P 1 21/n 119.9329; 16.7488; 25.2197
90; 94.831; 90
8389.74Doñagueda 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

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