Crystallography Open Database

Result: there are 1800 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching journal of publication like 'Chemical Science' volume of publication is 15

Left arrow Left arrow First | Left arrow Previous 50 | of 36 | Next 50 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
1570192 CIFC40 H34P 1 21/n 112.554; 14.479; 15.943
90; 105.032; 90		2798.8Appiarius, Yannik; Míguez-Lago, Sandra; Puylaert, Pim; Wolf, Noah; Kumar, Sourabh; Molkenthin, Martin; Miguel, Delia; Neudecker, Tim; Juríček, Michal; Campaña, Araceli G; Staubitz, Anne
Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups.
Chemical science, 2024, 15, 466-476
1570193 CIFC44 H36C 1 2/c 129.1349; 13.8389; 14.8881
90; 92.953; 90		5994.8Appiarius, Yannik; Míguez-Lago, Sandra; Puylaert, Pim; Wolf, Noah; Kumar, Sourabh; Molkenthin, Martin; Miguel, Delia; Neudecker, Tim; Juríček, Michal; Campaña, Araceli G; Staubitz, Anne
Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups.
Chemical science, 2024, 15, 466-476
1570194 CIFC40 H36 B2 N2C 1 2/c 129.2871; 13.7319; 15.0245
90; 94.365; 90		6024.8Appiarius, Yannik; Míguez-Lago, Sandra; Puylaert, Pim; Wolf, Noah; Kumar, Sourabh; Molkenthin, Martin; Miguel, Delia; Neudecker, Tim; Juríček, Michal; Campaña, Araceli G; Staubitz, Anne
Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups.
Chemical science, 2024, 15, 466-476
1570195 CIFC36 H34 B2 N2P 1 21/n 117.5703; 8.2181; 20.6544
90; 107.203; 90		2848.96Appiarius, Yannik; Míguez-Lago, Sandra; Puylaert, Pim; Wolf, Noah; Kumar, Sourabh; Molkenthin, Martin; Miguel, Delia; Neudecker, Tim; Juríček, Michal; Campaña, Araceli G; Staubitz, Anne
Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups.
Chemical science, 2024, 15, 466-476
1570196 CIFC38.5 H33 B2 Cl N4P -113.0913; 14.9897; 19.698
86.55; 86.961; 69.776		3618.4Appiarius, Yannik; Míguez-Lago, Sandra; Puylaert, Pim; Wolf, Noah; Kumar, Sourabh; Molkenthin, Martin; Miguel, Delia; Neudecker, Tim; Juríček, Michal; Campaña, Araceli G; Staubitz, Anne
Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups.
Chemical science, 2024, 15, 466-476
1570197 CIFC36 H32 B2 Br2 N2P 1 21/n 121.8649; 12.8104; 22.9768
90; 108.44; 90		6105.3Appiarius, Yannik; Míguez-Lago, Sandra; Puylaert, Pim; Wolf, Noah; Kumar, Sourabh; Molkenthin, Martin; Miguel, Delia; Neudecker, Tim; Juríček, Michal; Campaña, Araceli G; Staubitz, Anne
Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups.
Chemical science, 2024, 15, 466-476
1570368 CIFC34 H29 N3 O6P b c a36.1; 19.23; 7.97
90; 90; 90		5533Mathew, Renny; Mazumder, Aniruddha; Kumar, Praveen; Matula, Julie; Mohamed, Sharmarke; Brazda, Petr; Hariharan, Mahesh; Thomas, Brijith
Unveiling the topology of partially disordered micro-crystalline nitro-perylenediimide with X-aggregate stacking: an integrated approach.
Chemical science, 2024, 15, 490-499
1570373 CIFC136 H90 Cl2 N4 O16P 113.2705; 21.6957; 22.113
111.223; 102.466; 104.738		5394.3Weh, Manuel; Kroeger, Asja A.; Anhalt, Olga; Karton, Amir; Würthner, Frank
Mutual induced fit transition structure stabilization of corannulene's bowl-to-bowl inversion in a perylene bisimide cyclophane.
Chemical science, 2024, 15, 609-617
1570375 CIFC12 H13 F N2 O2 SP 1 21/c 121.5943; 5.8735; 9.8361
90; 100.575; 90		1226.36Punjajom, Kunlayanee; Sinclair, Paul P.; Saha, Ishika; Seierstad, Mark; Ameriks, Michael K.; García-Reynaga, Pablo; Lebold, Terry P.; Sarpong, Richmond
Convergent synthesis of thiodiazole dioxides from simple ketones and amines through an unusual nitrogen-migration mechanism.
Chemical science, 2023, 15, 328-335
1570391 CIFC19 H16 Br3 PC 1 2/c 117.7546; 15.532; 28.3321
90; 99.228; 90		7711.9Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570392 CIFC20 H19 Br3 N O2 PR -3 :H32.27; 32.27; 11.323
90; 90; 120		10211.5Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570393 CIFC21 H19 Br3 N PR -3 :H33.1499; 33.1499; 11.1629
90; 90; 120		10623.6Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570394 CIFC21 H20 Br3 O2 PR -3 :H32.4936; 32.4936; 11.3322
90; 90; 120		10361.9Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570395 CIFC23 H24 Br3 O PR -3 :H33.4263; 33.4263; 11.2099
90; 90; 120		10847Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570396 CIFC22 H20 Br3 O2 PR -3 :H32.283; 32.283; 11.5522
90; 90; 120		10426.6Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570397 CIFC24 H25 Br3 N O PR -3 :H33.612; 33.612; 11.4292
90; 90; 120		11182.4Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570398 CIFC21 H22 Br3 O P SR -3 :H33.4643; 33.4643; 11.1613
90; 90; 120		10824.5Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570399 CIFC22 H23 Br3 N O PR -3 :H33.1823; 33.1823; 11.4506
90; 90; 120		10918.7Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570400 CIFC23 H25 Br3 N O PR -3 :H33.0726; 33.0726; 11.369
90; 90; 120		10769.4Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570401 CIFC22 H22 Br3 O0.75 PR -3 :H33.144; 33.144; 11.465
90; 90; 120		10907.2Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570402 CIFC22 H22 Br3 O PR -3 :H33.0003; 33.0003; 11.135
90; 90; 120		10501.6Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570403 CIFC20 H19 I3 N O2 PR -3 :H32.9862; 32.9862; 12.0449
90; 90; 120		11350.1Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570404 CIFC42 H41 Br6 O P2R -3 :H32.8602; 32.8602; 11.266
90; 90; 120		10535.2Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570405 CIFC21 H20 Br3 O PR -3 :H32.8339; 32.8339; 11.1368
90; 90; 120		10397.7Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570406 CIFC19 H17 I2 PP c a 2114.8074; 12.4892; 20.5366
90; 90; 90		3797.89Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570407 CIFC19 H16 Cl3 PP n m a12.2883; 12.5399; 12.1077
90; 90; 90		1865.72Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570408 CIFC23 H22 Br3 O PR -3 :H33.2157; 33.2157; 11.3174
90; 90; 120		10813.4Marrett, Joseph M.; Titi, Hatem M.; Teoh, Yong; Friščić, Tomislav
Supramolecular "baking powder": a hexameric halogen-bonded phosphonium salt cage encapsulates and functionalises small-molecule carbonyl compounds.
Chemical science, 2023, 15, 298-306
1570409 CIFC40 H20 Cl4 O7 S8P 21 21 217.9065; 15.4002; 7.3943
90; 90; 90		2039.08Li, Tao; Liu, Jia-Chuan; Liu, En-Ping; Liu, Bai-Tong; Wang, Jing-Yu; Liao, Pei-Yu; Jia, Jian-Hua; Feng, Yuanning; Tong, Ming-Liang
NIR-II photothermal conversion and imaging based on a cocrystal containing twisted components.
Chemical science, 2024, 15, 1692-1699
1570410 CIFC24 H4 Cl4 N0.25 O6P 1 21/n 113.343; 10.807; 14.322
90; 111.45; 90		1922Li, Tao; Liu, Jia-Chuan; Liu, En-Ping; Liu, Bai-Tong; Wang, Jing-Yu; Liao, Pei-Yu; Jia, Jian-Hua; Feng, Yuanning; Tong, Ming-Liang
NIR-II photothermal conversion and imaging based on a cocrystal containing twisted components.
Chemical science, 2024, 15, 1692-1699
1570412 CIFC52 H40 N4 O2P -110.0726; 14.3581; 15.3628
109.639; 95.666; 108.274		1934.6Sudhakar, Pagidi; Gupta, Abhishek Kumar; Cordes, David B.; Zysman-Colman, Eli
Thermally activated delayed fluorescence emitters showing wide-range near-infrared piezochromism and their use in deep-red OLEDs.
Chemical science, 2024, 15, 545-554
1570413 CIFC64 H64 N4 O2P -15.9658; 17.8685; 25.1599
76.932; 86.233; 86.248		2603.41Sudhakar, Pagidi; Gupta, Abhishek Kumar; Cordes, David B.; Zysman-Colman, Eli
Thermally activated delayed fluorescence emitters showing wide-range near-infrared piezochromism and their use in deep-red OLEDs.
Chemical science, 2024, 15, 545-554
1570414 CIFC33 H22 F7 N3 O2C 2 2 217.1815; 17.3109; 46.2197
90; 90; 90		5746Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao
Selective chiral dimerization and folding driven by arene-perfluoroarene force.
Chemical science, 2024, 15, 618-628
1570415 CIFC33 H22 F7 N3 O2P -18.3043; 8.691; 20.6746
80.978; 81.965; 67.556		1356.82Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao
Selective chiral dimerization and folding driven by arene-perfluoroarene force.
Chemical science, 2024, 15, 618-628
1570416 CIFC79 H64 F14 N6 O4P 1 21 117.8394; 8.2183; 22.8962
90; 102.884; 90		3272.29Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao
Selective chiral dimerization and folding driven by arene-perfluoroarene force.
Chemical science, 2024, 15, 618-628
1570417 CIFC73 H57 Cl3 F14 N6 O4P 1 2/c 122.8294; 9.4458; 31.1842
90; 90.301; 90		6724.53Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao
Selective chiral dimerization and folding driven by arene-perfluoroarene force.
Chemical science, 2024, 15, 618-628
1570418 CIFC61 H80 O13P 1 21 18.6927; 29.467; 11.3135
90; 112.393; 90		2679.4He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570419 CIFC30 H34 O4P 21 21 218.7346; 9.9202; 28.6562
90; 90; 90		2483.03He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570420 CIFC30 H38 O4P 21 21 218.8971; 15.2326; 18.8392
90; 90; 90		2553.2He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570421 CIFC30 H40 O5P 21 21 218.7065; 13.1797; 22.9727
90; 90; 90		2636.1He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570422 CIFC30 H40 O4P 21 21 218.6842; 15.4286; 19.2929
90; 90; 90		2584.96He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570423 CIFC30 H34 O4P 21 21 218.733; 9.9169; 28.6719
90; 90; 90		2483.1He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570424 CIFC15 H22 OP 21 21 218.2056; 9.4771; 16.4429
90; 90; 90		1278.69He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570425 CIFC15 H22 OP 21 21 218.2085; 9.4732; 16.4463
90; 90; 90		1278.88He, Tao-Bin; Yan, Bing-Chao; Zhou, Yuan-Fei; Sang, Yue-Qian; Li, Xiao-Nian; Sun, Han-Dong; Wang, Chu; Xue, Xiao-Song; Puno, Pema-Tenzin
Discovery and bioinspired total syntheses of unprecedented sesquiterpenoid dimers unveiled bifurcating [4 + 2] cycloaddition and target differentiation of enantiomers.
Chemical science, 2024, 15, 1260-1270
1570426 CIFC107 H138 N6 O3 PP -115.9708; 16.8532; 19.6348
98.989; 107.266; 97.797		4891Chen, Yusheng; Kuvayskaya, Anastasia; Pink, Maren; Sellinger, Alan; Flood, Amar H.
A library of vinyl phosphonate anions dimerize with cyanostars, form supramolecular polymers and undergo statistical sorting.
Chemical science, 2023, 15, 389-398
1570427 CIFC89 H109 N6 O3 PP -116.3782; 16.4347; 18.8864
111.457; 112.34; 97.462		4157.2Chen, Yusheng; Kuvayskaya, Anastasia; Pink, Maren; Sellinger, Alan; Flood, Amar H.
A library of vinyl phosphonate anions dimerize with cyanostars, form supramolecular polymers and undergo statistical sorting.
Chemical science, 2023, 15, 389-398
1570428 CIFC93 H115 N8 O3 PP -116.3882; 16.4992; 19.1849
111.893; 111.74; 97.594		4245.5Chen, Yusheng; Kuvayskaya, Anastasia; Pink, Maren; Sellinger, Alan; Flood, Amar H.
A library of vinyl phosphonate anions dimerize with cyanostars, form supramolecular polymers and undergo statistical sorting.
Chemical science, 2023, 15, 389-398
1570429 CIFC32 H27 F N2 O2C 1 2/c 131.691; 6.6329; 25.7816
90; 112.057; 90		5022.74Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca
Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light.
Chemical science, 2023, 15, 271-277
1570430 CIFC30 H23 F5 N2 OP 1 21/c 110.5292; 12.5977; 20.0573
90; 103.635; 90		2585.49Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca
Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light.
Chemical science, 2023, 15, 271-277
1570431 CIFC33 H30.13 N2 O2P 16.8195; 19.5313; 20.5319
96.793; 95.64; 99.888		2655.5Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca
Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light.
Chemical science, 2023, 15, 271-277
1570480 CIFC72 H144 Fe3 K4 N8 O24 Sn18P 1 21/c 114.8596; 25.1992; 18.793
90; 108.689; 90		6666Li, Zi-Sheng; Chen, Wei-Xing; Morgan, Harry W. T.; Shu, Cong-Cong; McGrady, John E.; Sun, Zhong-Ming
Snap-shots of cluster growth: structure and properties of a Zintl ion with an Fe<sub>3</sub> core, [Fe<sub>3</sub>Sn<sub>18</sub>]<sup>4</sup>.
Chemical science, 2024, 15, 1018-1026

Left arrow Left arrow First | Left arrow Previous 50 | of 36 | Next 50 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.