Crystallography Open Database

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

COD ID: 1570192
CIF file Formula: - C40 H34 -
Comments: Appiarius, 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 15(2) (2024) 466-476
Space group: P 1 21/n 1
Cell volume: 2798.8
Cell parameters: 12.554; 14.479; 15.943; 90; 105.032; 90;  

COD ID: 1570193
CIF file Formula: - C44 H36 -
Comments: Appiarius, 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 15(2) (2024) 466-476
Space group: C 1 2/c 1
Cell volume: 5994.8
Cell parameters: 29.1349; 13.8389; 14.8881; 90; 92.953; 90;  

COD ID: 1570194
CIF file Formula: - C40 H36 B2 N2 -
Comments: Appiarius, 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 15(2) (2024) 466-476
Space group: C 1 2/c 1
Cell volume: 6024.8
Cell parameters: 29.2871; 13.7319; 15.0245; 90; 94.365; 90;  

COD ID: 1570195
CIF file Formula: - C36 H34 B2 N2 -
Comments: Appiarius, 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 15(2) (2024) 466-476
Space group: P 1 21/n 1
Cell volume: 2848.96
Cell parameters: 17.5703; 8.2181; 20.6544; 90; 107.203; 90;  

COD ID: 1570196
CIF file Formula: - C38.5 H33 B2 Cl N4 -
Comments: Appiarius, 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 15(2) (2024) 466-476
Space group: P -1
Cell volume: 3618.4
Cell parameters: 13.0913; 14.9897; 19.698; 86.55; 86.961; 69.776;  

COD ID: 1570197
CIF file Formula: - C36 H32 B2 Br2 N2 -
Comments: Appiarius, 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 15(2) (2024) 466-476
Space group: P 1 21/n 1
Cell volume: 6105.3
Cell parameters: 21.8649; 12.8104; 22.9768; 90; 108.44; 90;  

COD ID: 1570368
CIF file Formula: - C34 H29 N3 O6 -
Comments: Mathew, 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 15(2) (2024) 490-499
Space group: P b c a
Cell volume: 5533
Cell parameters: 36.1; 19.23; 7.97; 90; 90; 90;  

COD ID: 1570373
CIF file Formula: - C136 H90 Cl2 N4 O16 -
Comments: Weh, 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 15(2) (2024) 609-617
Space group: P 1
Cell volume: 5394.3
Cell parameters: 13.2705; 21.6957; 22.113; 111.223; 102.466; 104.738;  

COD ID: 1570375
CIF file Formula: - C12 H13 F N2 O2 S -
Comments: Punjajom, 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 15(1) (2023) 328-335
Space group: P 1 21/c 1
Cell volume: 1226.36
Cell parameters: 21.5943; 5.8735; 9.8361; 90; 100.575; 90;  

COD ID: 1570391
CIF file Formula: - C19 H16 Br3 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: C 1 2/c 1
Cell volume: 7711.9
Cell parameters: 17.7546; 15.532; 28.3321; 90; 99.228; 90;  

COD ID: 1570392
CIF file Formula: - C20 H19 Br3 N O2 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10211.5
Cell parameters: 32.27; 32.27; 11.323; 90; 90; 120;  

COD ID: 1570393
CIF file Formula: - C21 H19 Br3 N P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10623.6
Cell parameters: 33.1499; 33.1499; 11.1629; 90; 90; 120;  

COD ID: 1570394
CIF file Formula: - C21 H20 Br3 O2 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10361.9
Cell parameters: 32.4936; 32.4936; 11.3322; 90; 90; 120;  

COD ID: 1570395
CIF file Formula: - C23 H24 Br3 O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10847
Cell parameters: 33.4263; 33.4263; 11.2099; 90; 90; 120;  

COD ID: 1570396
CIF file Formula: - C22 H20 Br3 O2 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10426.6
Cell parameters: 32.283; 32.283; 11.5522; 90; 90; 120;  

COD ID: 1570397
CIF file Formula: - C24 H25 Br3 N O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 11182.4
Cell parameters: 33.612; 33.612; 11.4292; 90; 90; 120;  

COD ID: 1570398
CIF file Formula: - C21 H22 Br3 O P S -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10824.5
Cell parameters: 33.4643; 33.4643; 11.1613; 90; 90; 120;  

COD ID: 1570399
CIF file Formula: - C22 H23 Br3 N O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10918.7
Cell parameters: 33.1823; 33.1823; 11.4506; 90; 90; 120;  

COD ID: 1570400
CIF file Formula: - C23 H25 Br3 N O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10769.4
Cell parameters: 33.0726; 33.0726; 11.369; 90; 90; 120;  

COD ID: 1570401
CIF file Formula: - C22 H22 Br3 O0.75 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10907.2
Cell parameters: 33.144; 33.144; 11.465; 90; 90; 120;  

COD ID: 1570402
CIF file Formula: - C22 H22 Br3 O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10501.6
Cell parameters: 33.0003; 33.0003; 11.135; 90; 90; 120;  

COD ID: 1570403
CIF file Formula: - C20 H19 I3 N O2 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 11350.1
Cell parameters: 32.9862; 32.9862; 12.0449; 90; 90; 120;  

COD ID: 1570404
CIF file Formula: - C42 H41 Br6 O P2 -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10535.2
Cell parameters: 32.8602; 32.8602; 11.266; 90; 90; 120;  

COD ID: 1570405
CIF file Formula: - C21 H20 Br3 O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10397.7
Cell parameters: 32.8339; 32.8339; 11.1368; 90; 90; 120;  

COD ID: 1570406
CIF file Formula: - C19 H17 I2 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: P c a 21
Cell volume: 3797.89
Cell parameters: 14.8074; 12.4892; 20.5366; 90; 90; 90;  

COD ID: 1570407
CIF file Formula: - C19 H16 Cl3 P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: P n m a
Cell volume: 1865.72
Cell parameters: 12.2883; 12.5399; 12.1077; 90; 90; 90;  

COD ID: 1570408
CIF file Formula: - C23 H22 Br3 O P -
Comments: Marrett, 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 15(1) (2023) 298-306
Space group: R -3 :H
Cell volume: 10813.4
Cell parameters: 33.2157; 33.2157; 11.3174; 90; 90; 120;  

COD ID: 1570409
CIF file Formula: - C40 H20 Cl4 O7 S8 -
Comments: Li, 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 15(5) (2024) 1692-1699
Space group: P 21 21 2
Cell volume: 2039.08
Cell parameters: 17.9065; 15.4002; 7.3943; 90; 90; 90;  

COD ID: 1570410
CIF file Formula: - C24 H4 Cl4 N0.25 O6 -
Comments: Li, 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 15(5) (2024) 1692-1699
Space group: P 1 21/n 1
Cell volume: 1922
Cell parameters: 13.343; 10.807; 14.322; 90; 111.45; 90;  

COD ID: 1570412
CIF file Formula: - C52 H40 N4 O2 -
Comments: Sudhakar, 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 15(2) (2024) 545-554
Space group: P -1
Cell volume: 1934.6
Cell parameters: 10.0726; 14.3581; 15.3628; 109.639; 95.666; 108.274;  

COD ID: 1570413
CIF file Formula: - C64 H64 N4 O2 -
Comments: Sudhakar, 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 15(2) (2024) 545-554
Space group: P -1
Cell volume: 2603.41
Cell parameters: 5.9658; 17.8685; 25.1599; 76.932; 86.233; 86.248;  

COD ID: 1570414
CIF file Formula: - C33 H22 F7 N3 O2 -
Comments: Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao Selective chiral dimerization and folding driven by arene-perfluoroarene force. Chemical science 15(2) (2024) 618-628
Space group: C 2 2 21
Cell volume: 5746
Cell parameters: 7.1815; 17.3109; 46.2197; 90; 90; 90;  

COD ID: 1570415
CIF file Formula: - C33 H22 F7 N3 O2 -
Comments: Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao Selective chiral dimerization and folding driven by arene-perfluoroarene force. Chemical science 15(2) (2024) 618-628
Space group: P -1
Cell volume: 1356.82
Cell parameters: 8.3043; 8.691; 20.6746; 80.978; 81.965; 67.556;  

COD ID: 1570416
CIF file Formula: - C79 H64 F14 N6 O4 -
Comments: Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao Selective chiral dimerization and folding driven by arene-perfluoroarene force. Chemical science 15(2) (2024) 618-628
Space group: P 1 21 1
Cell volume: 3272.29
Cell parameters: 17.8394; 8.2183; 22.8962; 90; 102.884; 90;  

COD ID: 1570417
CIF file Formula: - C73 H57 Cl3 F14 N6 O4 -
Comments: Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao Selective chiral dimerization and folding driven by arene-perfluoroarene force. Chemical science 15(2) (2024) 618-628
Space group: P 1 2/c 1
Cell volume: 6724.53
Cell parameters: 22.8294; 9.4458; 31.1842; 90; 90.301; 90;  

COD ID: 1570418
CIF file Formula: - C61 H80 O13 -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 1 21 1
Cell volume: 2679.4
Cell parameters: 8.6927; 29.467; 11.3135; 90; 112.393; 90;  

COD ID: 1570419
CIF file Formula: - C30 H34 O4 -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 2483.03
Cell parameters: 8.7346; 9.9202; 28.6562; 90; 90; 90;  

COD ID: 1570420
CIF file Formula: - C30 H38 O4 -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 2553.2
Cell parameters: 8.8971; 15.2326; 18.8392; 90; 90; 90;  

COD ID: 1570421
CIF file Formula: - C30 H40 O5 -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 2636.1
Cell parameters: 8.7065; 13.1797; 22.9727; 90; 90; 90;  

COD ID: 1570422
CIF file Formula: - C30 H40 O4 -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 2584.96
Cell parameters: 8.6842; 15.4286; 19.2929; 90; 90; 90;  

COD ID: 1570423
CIF file Formula: - C30 H34 O4 -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 2483.1
Cell parameters: 8.733; 9.9169; 28.6719; 90; 90; 90;  

COD ID: 1570424
CIF file Formula: - C15 H22 O -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 1278.69
Cell parameters: 8.2056; 9.4771; 16.4429; 90; 90; 90;  

COD ID: 1570425
CIF file Formula: - C15 H22 O -
Comments: He, 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 15(4) (2024) 1260-1270
Space group: P 21 21 21
Cell volume: 1278.88
Cell parameters: 8.2085; 9.4732; 16.4463; 90; 90; 90;  

COD ID: 1570426
CIF file Formula: - C107 H138 N6 O3 P -
Comments: Chen, 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 15(1) (2023) 389-398
Space group: P -1
Cell volume: 4891
Cell parameters: 15.9708; 16.8532; 19.6348; 98.989; 107.266; 97.797;  

COD ID: 1570427
CIF file Formula: - C89 H109 N6 O3 P -
Comments: Chen, 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 15(1) (2023) 389-398
Space group: P -1
Cell volume: 4157.2
Cell parameters: 16.3782; 16.4347; 18.8864; 111.457; 112.34; 97.462;  

COD ID: 1570428
CIF file Formula: - C93 H115 N8 O3 P -
Comments: Chen, 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 15(1) (2023) 389-398
Space group: P -1
Cell volume: 4245.5
Cell parameters: 16.3882; 16.4992; 19.1849; 111.893; 111.74; 97.594;  

COD ID: 1570429
CIF file Formula: - C32 H27 F N2 O2 -
Comments: Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light. Chemical science 15(1) (2023) 271-277
Space group: C 1 2/c 1
Cell volume: 5022.74
Cell parameters: 31.691; 6.6329; 25.7816; 90; 112.057; 90;  

COD ID: 1570430
CIF file Formula: - C30 H23 F5 N2 O -
Comments: Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light. Chemical science 15(1) (2023) 271-277
Space group: P 1 21/c 1
Cell volume: 2585.49
Cell parameters: 10.5292; 12.5977; 20.0573; 90; 103.635; 90;  

COD ID: 1570431
CIF file Formula: - C33 H30.13 N2 O2 -
Comments: Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light. Chemical science 15(1) (2023) 271-277
Space group: P 1
Cell volume: 2655.5
Cell parameters: 6.8195; 19.5313; 20.5319; 96.793; 95.64; 99.888;  

COD ID: 1570480
CIF file Formula: - C72 H144 Fe3 K4 N8 O24 Sn18 -
Comments: Li, 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 15(3) (2024) 1018-1026
Space group: P 1 21/c 1
Cell volume: 6666
Cell parameters: 14.8596; 25.1992; 18.793; 90; 108.689; 90;  

COD ID: 1570481
CIF file Formula: - C32 H33 N O4 -
Comments: Han, Zhengyu; Zhu, Biao; Zang, Yu; Zhang, Chaoshen; Dong, Xiu-Qin; Huang, Hai; Sun, Jianwei Primary activation of <i>para</i>-quinone methides by chiral phosphoric acid for enantioselective construction of tetraarylmethanes. Chemical science 15(2) (2024) 720-725
Space group: P 1 21 1
Cell volume: 1309.82
Cell parameters: 13.02736; 7.6261; 13.31312; 90; 97.9813; 90;  

COD ID: 1570482
CIF file Formula: - C23 H25 Al F6 N2 O6 S2 -
Comments: Dissanayake, Deepamali; Draper, Alysia; Liu, Zhizhou; Jaunnoo, Neelofur; Haven, Joris J.; Forsyth, Craig; McKay, Alasdair I.; Junkers, Tanja; Vidović, Dragoslav Lewis acid catalysed polymerisation of cyclopentenone. Chemical science 15(2) (2024) 639-643
Space group: P -1
Cell volume: 1408.04
Cell parameters: 9.406; 11.1167; 15.5637; 75.81; 72.977; 66.135;  

COD ID: 1570483
CIF file Formula: - C19 H17 Al F6 N2 O6 S2 -
Comments: Dissanayake, Deepamali; Draper, Alysia; Liu, Zhizhou; Jaunnoo, Neelofur; Haven, Joris J.; Forsyth, Craig; McKay, Alasdair I.; Junkers, Tanja; Vidović, Dragoslav Lewis acid catalysed polymerisation of cyclopentenone. Chemical science 15(2) (2024) 639-643
Space group: C 1 2/c 1
Cell volume: 2472.31
Cell parameters: 20.7709; 10.3593; 13.0575; 90; 118.364; 90;  

COD ID: 1570484
CIF file Formula: - C41 H42 Al2 Cl4 N4 -
Comments: Dissanayake, Deepamali; Draper, Alysia; Liu, Zhizhou; Jaunnoo, Neelofur; Haven, Joris J.; Forsyth, Craig; McKay, Alasdair I.; Junkers, Tanja; Vidović, Dragoslav Lewis acid catalysed polymerisation of cyclopentenone. Chemical science 15(2) (2024) 639-643
Space group: P 1 21/n 1
Cell volume: 2042.12
Cell parameters: 6.2994; 22.3513; 14.5043; 90; 90.524; 90;  

COD ID: 1570485
CIF file Formula: - C96 H90 Fe6 In13 N12 O42 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: R -3 :H
Cell volume: 9761.8
Cell parameters: 19.8087; 19.8087; 28.7268; 90; 90; 120;  

COD ID: 1570486
CIF file Formula: - C68 H56 Cl2 Fe4 In13 N8 O38 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: C 1 2/m 1
Cell volume: 5987.4
Cell parameters: 19.6313; 22.929; 13.3713; 90; 95.854; 90;  

COD ID: 1570487
CIF file Formula: - C106 H86 Fe6 In13 O52 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: C 1 2/m 1
Cell volume: 7145.74
Cell parameters: 21.2041; 25.0454; 13.8544; 90; 103.783; 90;  

COD ID: 1570488
CIF file Formula: - C78 H78 Fe6 In13 O48 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: C 1 2/c 1
Cell volume: 13415.8
Cell parameters: 32.0443; 14.9493; 28.0793; 90; 94.153; 90;  

COD ID: 1570489
CIF file Formula: - C95 H66 Cl3 Fe6 In7 O28 P -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: R -3 :H
Cell volume: 14838.2
Cell parameters: 16.1506; 16.1506; 65.6859; 90; 90; 120;  

COD ID: 1570490
CIF file Formula: - C304 H216 Fe24 In28 N8 O116 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: P 42/n :2
Cell volume: 19625.3
Cell parameters: 35.1846; 35.1846; 15.853; 90; 90; 90;  

COD ID: 1570491
CIF file Formula: - C88 H84 Fe6 In7 N6 O28 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: R -3 :H
Cell volume: 16563.2
Cell parameters: 25.3175; 25.3175; 29.8382; 90; 90; 120;  

COD ID: 1570492
CIF file Formula: - C92 H96 Fe6 In13 N6 O46 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: I 1 2/a 1
Cell volume: 13070.1
Cell parameters: 27.37206; 15.00755; 31.8968; 90; 94.0511; 90;  

COD ID: 1570493
CIF file Formula: - C120 H84 Fe12 In12 O60 -
Comments: Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science 15(2) (2024) 726-735
Space group: P 1 21/n 1
Cell volume: 8032.26
Cell parameters: 15.4037; 20.7536; 25.173; 90; 93.511; 90;  

COD ID: 1570494
CIF file Formula: - C48 H128 Cl11 Cu24 Gd6 N12 O138 -
Comments: Chen, Jia-Nan; Pan, Zhong-Hua; Qiu, Qi-Hao; Wang, Cheng; Long, La-Sheng; Zheng, Lan-Sun; Kong, Xiang-Jian Soluble Gd<sub>6</sub>Cu<sub>24</sub> clusters: effective molecular electrocatalysts for water oxidation. Chemical science 15(2) (2024) 511-515
Space group: P -1
Cell volume: 5524.1
Cell parameters: 18.7431; 18.7639; 19.9485; 65.084; 76.898; 60.275;  

COD ID: 1570495
CIF file Formula: - C73 H156 Cl16 Cu24 Gd6 N36 O151 -
Comments: Chen, Jia-Nan; Pan, Zhong-Hua; Qiu, Qi-Hao; Wang, Cheng; Long, La-Sheng; Zheng, Lan-Sun; Kong, Xiang-Jian Soluble Gd<sub>6</sub>Cu<sub>24</sub> clusters: effective molecular electrocatalysts for water oxidation. Chemical science 15(2) (2024) 511-515
Space group: R -3 :H
Cell volume: 20095.3
Cell parameters: 20.0889; 20.0889; 57.4977; 90; 90; 120;  

COD ID: 1570496
CIF file Formula: - C19 H21 N O4 S2 -
Comments: Lipilin, Dmitry L.; Zubkov, Mikhail O.; Kosobokov, Mikhail D.; Dilman, Alexander D. Direct conversion of carboxylic acids to free thiols <i>via</i> radical relay acridine photocatalysis enabled by N-O bond cleavage. Chemical science 15(2) (2024) 644-650
Space group: P 21 21 21
Cell volume: 1854.37
Cell parameters: 6.2918; 7.9579; 37.036; 90; 90; 90;  

COD ID: 1570497
CIF file Formula: - C24 H21 Cl2 N3 O3 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 1 21/n 1
Cell volume: 4647.79
Cell parameters: 21.7245; 8.151; 27.6097; 90; 108.074; 90;  

COD ID: 1570498
CIF file Formula: - C22 H15 F2 N3 O2 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 1 21/n 1
Cell volume: 1839
Cell parameters: 12.139; 6.8997; 22.664; 90; 104.348; 90;  

COD ID: 1570499
CIF file Formula: - C24 H17 N3 O2 Pt S -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 1 21/c 1
Cell volume: 2032
Cell parameters: 12.577; 8.202; 20.223; 90; 103.1; 90;  

COD ID: 1570500
CIF file Formula: - C42 H61 Cl N4 O3 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 1 21/n 1
Cell volume: 3997.66
Cell parameters: 8.5147; 16.3288; 28.9929; 90; 97.377; 90;  

COD ID: 1570501
CIF file Formula: - C24 H18 N3 O2.5 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 1 21/c 1
Cell volume: 3804.6
Cell parameters: 29.7626; 5.095; 25.3909; 90; 98.831; 90;  

COD ID: 1570502
CIF file Formula: - C114 H122 Cl7 N13 O12 Pt4 -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: C 1 2/c 1
Cell volume: 10922
Cell parameters: 20.783; 23.203; 22.652; 90; 90.778; 90;  

COD ID: 1570503
CIF file Formula: - C41 H55 Cl3 N4 O2 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P c a 21
Cell volume: 3989.98
Cell parameters: 28.1013; 8.2546; 17.2008; 90; 90; 90;  

COD ID: 1570504
CIF file Formula: - C42 H61 Cl N4 O2 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P c a 21
Cell volume: 4047.7
Cell parameters: 21.437; 8.3346; 22.655; 90; 90; 90;  

COD ID: 1570505
CIF file Formula: - C39.67 H54.34 Cl2.67 F2 N4 O2 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 1 21 1
Cell volume: 8196.2
Cell parameters: 16.8798; 16.7488; 29.324; 90; 98.644; 90;  

COD ID: 1570506
CIF file Formula: - C42 H57 Cl3 N4 O2 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P b c a
Cell volume: 8232
Cell parameters: 17.716; 17.001; 27.332; 90; 90; 90;  

COD ID: 1570507
CIF file Formula: - C96 H70 Au Cl9 N10 O4 Pt2 -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P -1
Cell volume: 4218.34
Cell parameters: 13.5379; 18.5737; 19.8643; 62.469; 72.905; 86.326;  

COD ID: 1570508
CIF file Formula: - C42.95 H60.9 Cl1.95 F2 N4 O2 Pt -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: C 1 2/c 1
Cell volume: 8469.9
Cell parameters: 47.3103; 8.5434; 21.0894; 90; 96.468; 90;  

COD ID: 1570509
CIF file Formula: - C112 H116 Cl13 N13 O12 Pt4 -
Comments: Haketa, Yohei; Komatsu, Kaifu; Sei, Hiroi; Imoba, Hiroki; Ota, Wataru; Sato, Tohru; Murakami, Yu; Tanaka, Hiroki; Yasuda, Nobuhiro; Tohnai, Norimitsu; Maeda, Hiromitsu Enhanced solid-state phosphorescence of organoplatinum π-systems by ion-pairing assembly. Chemical science 15(3) (2024) 964-973
Space group: P 4/n c c :2
Cell volume: 10433.1
Cell parameters: 22.024; 22.024; 21.509; 90; 90; 90;  

COD ID: 1570510
CIF file Formula: - C60 H46 N4 -
Comments: Wang, Hui; Liu, Hui; Wang, Mingsen; Hou, Jiaheng; Li, Yongjun; Wang, Yuancheng; Zhao, Yingjie Cucurbituril-based supramolecular host-guest complexes: single-crystal structures and dual-state fluorescence enhancement. Chemical science 15(2) (2024) 458-465
Space group: P 1 21/n 1
Cell volume: 2693.1
Cell parameters: 15.447; 5.8857; 29.629; 90; 91.258; 90;  

COD ID: 1570511
CIF file Formula: - C148 H142 I4 N60 O28 -
Comments: Wang, Hui; Liu, Hui; Wang, Mingsen; Hou, Jiaheng; Li, Yongjun; Wang, Yuancheng; Zhao, Yingjie Cucurbituril-based supramolecular host-guest complexes: single-crystal structures and dual-state fluorescence enhancement. Chemical science 15(2) (2024) 458-465
Space group: P -1
Cell volume: 5460.3
Cell parameters: 13.107; 17.0258; 25.9476; 75.072; 85.004; 77.546;  

COD ID: 1570512
CIF file Formula: - C160 H150 I4 N68 O32 -
Comments: Wang, Hui; Liu, Hui; Wang, Mingsen; Hou, Jiaheng; Li, Yongjun; Wang, Yuancheng; Zhao, Yingjie Cucurbituril-based supramolecular host-guest complexes: single-crystal structures and dual-state fluorescence enhancement. Chemical science 15(2) (2024) 458-465
Space group: P -4 2 c
Cell volume: 31425.4
Cell parameters: 18.6227; 18.6227; 90.614; 90; 90; 90;  

COD ID: 1570520
CIF file Formula: - C10 H28 Cl6 In N3 O -
Comments: Li, Dong-Yang; Kang, Huai-Yuan; Liu, Yu-Hang; Zhang, Jie; Yue, Cheng-Yang; Yan, Dongpeng; Lei, Xiao-Wu A 0D hybrid lead-free halide with near-unity photoluminescence quantum yield toward multifunctional optoelectronic applications. Chemical science 15(3) (2024) 953-963
Space group: P 21 21 21
Cell volume: 2101.3
Cell parameters: 9.3561; 12.3477; 18.1889; 90; 90; 90;  

COD ID: 1570521
CIF file Formula: - C13 H25 F6 Fe N3 O7 S2 -
Comments: Devi, Tarali; Dutta, Kuheli; Deutscher, Jennifer; Mebs, Stefan; Kuhlmann, Uwe; Haumann, Michael; Cula, Beatrice; Dau, Holger; Hildebrandt, Peter; Ray, Kallol A high-spin alkylperoxo-iron(iii) complex with <i>cis</i>-anionic ligands: implications for the superoxide reductase mechanism. Chemical science 15(2) (2024) 528-533
Space group: P b c n
Cell volume: 4868.4
Cell parameters: 35.662; 8.8757; 15.3809; 90; 90; 90;  

COD ID: 1570526
CIF file Formula: - C20 H20 O3 -
Comments: Hou, Jingwei; Li, Xiaohong; Yan, Kaiyu; Zhang, Lei; Loh, Teck-Peng; Xie, Peizhong Uracil-Cu(i) catalyst: allylation of cyclopropanols with Morita-Baylis-Hillman alcohols under water-tolerant conditions. Chemical science 15(3) (2024) 1143-1149
Space group: C 1 2/c 1
Cell volume: 3281.1
Cell parameters: 33.9435; 5.7917; 17.1106; 90; 102.733; 90;  

COD ID: 1570527
CIF file Formula: - C30 H31 B F4 Mn N5 O3 -
Comments: Gulyaeva, Ekaterina S.; Osipova, Elena S.; Kovalenko, Sergey A.; Filippov, Oleg A.; Belkova, Natalia V.; Vendier, Laure; Canac, Yves; Shubina, Elena S.; Valyaev, Dmitry A. Two active species from a single metal halide precursor: a case study of highly productive Mn-catalyzed dehydrogenation of amine-boranes <i>via</i> intermolecular bimetallic cooperation. Chemical science 15(4) (2024) 1409-1417
Space group: I 1 2/a 1
Cell volume: 6287.04
Cell parameters: 23.6994; 8.0465; 33.4683; 90; 99.912; 90;  

COD ID: 1570528
CIF file Formula: - C56 H62 B2 Cl2 Mn N5 O3 -
Comments: Gulyaeva, Ekaterina S.; Osipova, Elena S.; Kovalenko, Sergey A.; Filippov, Oleg A.; Belkova, Natalia V.; Vendier, Laure; Canac, Yves; Shubina, Elena S.; Valyaev, Dmitry A. Two active species from a single metal halide precursor: a case study of highly productive Mn-catalyzed dehydrogenation of amine-boranes <i>via</i> intermolecular bimetallic cooperation. Chemical science 15(4) (2024) 1409-1417
Space group: P 1 21/c 1
Cell volume: 5253
Cell parameters: 19.766; 15.67; 17.052; 90; 95.937; 90;  

COD ID: 1570529
CIF file Formula: - C19 H16 S3 Si -
Comments: Sun, Zhen; Xu, Wan; Qiu, Shuai; Ma, Zhiying; Li, Chunli; Zhang, Sheng; Wang, Hua Thia[<i>n</i>]helicenes with long persistent phosphorescence. Chemical science 15(3) (2024) 1077-1087
Space group: P b c a
Cell volume: 3475.29
Cell parameters: 12.8509; 12.404; 21.802; 90; 90; 90;  

COD ID: 1570530
CIF file Formula: - C15 H14 S3 Si -
Comments: Sun, Zhen; Xu, Wan; Qiu, Shuai; Ma, Zhiying; Li, Chunli; Zhang, Sheng; Wang, Hua Thia[<i>n</i>]helicenes with long persistent phosphorescence. Chemical science 15(3) (2024) 1077-1087
Space group: P -1
Cell volume: 755.5
Cell parameters: 7.373; 8.088; 14.38; 94.58; 99.657; 114.95;  

COD ID: 1570531
CIF file Formula: - C27 H20 S3 Si -
Comments: Sun, Zhen; Xu, Wan; Qiu, Shuai; Ma, Zhiying; Li, Chunli; Zhang, Sheng; Wang, Hua Thia[<i>n</i>]helicenes with long persistent phosphorescence. Chemical science 15(3) (2024) 1077-1087
Space group: P 1 21/c 1
Cell volume: 2251.23
Cell parameters: 14.2989; 12.2575; 12.9384; 90; 96.91; 90;  

COD ID: 1570532
CIF file Formula: - C23 H18 S3 Si -
Comments: Sun, Zhen; Xu, Wan; Qiu, Shuai; Ma, Zhiying; Li, Chunli; Zhang, Sheng; Wang, Hua Thia[<i>n</i>]helicenes with long persistent phosphorescence. Chemical science 15(3) (2024) 1077-1087
Space group: P b c a
Cell volume: 3971.1
Cell parameters: 21.1138; 7.7627; 24.2285; 90; 90; 90;  

COD ID: 1570533
CIF file Formula: - C20 H18 N2 O -
Comments: Zhao, Yuanyuan; Li, Xinyue; Homölle, Simon L; Wang, Bin; Ackermann, Lutz Electrochemical assembly of isoxazoles <i>via</i> a four-component domino reaction. Chemical science 15(3) (2024) 1117-1122
Space group: P 1 21/n 1
Cell volume: 1619.58
Cell parameters: 6.00483; 7.13118; 37.8376; 90; 91.6595; 90;  

COD ID: 1570534
CIF file Formula: - C18 H14 Br Mn N2 O3 S -
Comments: Das, Kuhali; Kundu, Abhishek; Sarkar, Koushik; Adhikari, Debashis; Maji, Biplab Catalytic acceptorless dehydrogenative borylation of styrenes enabled by a molecularly defined manganese complex. Chemical science 15(3) (2024) 1098-1105
Space group: P -1
Cell volume: 1158.45
Cell parameters: 7.6734; 11.85; 13.3321; 104.364; 97.514; 93.655;  

COD ID: 1570535
CIF file Formula: - C19 H16 Br Mn N2 O3 S -
Comments: Das, Kuhali; Kundu, Abhishek; Sarkar, Koushik; Adhikari, Debashis; Maji, Biplab Catalytic acceptorless dehydrogenative borylation of styrenes enabled by a molecularly defined manganese complex. Chemical science 15(3) (2024) 1098-1105
Space group: P 1 21/c 1
Cell volume: 1923.47
Cell parameters: 13.2068; 15.5782; 9.4496; 90; 98.364; 90;  

COD ID: 1570536
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 994.76
Cell parameters: 6.0499; 10.3177; 16.6641; 101.437; 92.135; 101.786;  

COD ID: 1570537
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 1000.17
Cell parameters: 6.0419; 10.3191; 16.7479; 101.248; 92.177; 101.546;  

COD ID: 1570538
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 1002.25
Cell parameters: 6.0399; 10.3202; 16.7772; 101.178; 92.181; 101.469;  

COD ID: 1570539
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 1004.1
Cell parameters: 6.0394; 10.3207; 16.801; 101.124; 92.18; 101.408;  

COD ID: 1570540
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 1006.3
Cell parameters: 6.0405; 10.323; 16.826; 101.079; 92.174; 101.364;  

COD ID: 1570541
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 1009.6
Cell parameters: 6.0445; 10.33; 16.853; 101.035; 92.153; 101.338;  

COD ID: 1570542
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 997.93
Cell parameters: 6.0455; 10.3195; 16.7114; 101.333; 92.155; 101.65;  

COD ID: 1570543
CIF file Formula: - C21 H26 N2 O3 -
Comments: Hasebe, Shodai; Hagiwara, Yuki; Ueno, Takashi; Asahi, Toru; Koshima, Hideko Negative to positive axial thermal expansion switching of an organic crystal: contribution to multistep photoactuation. Chemical science 15(3) (2024) 1088-1097
Space group: P -1
Cell volume: 1011.5
Cell parameters: 6.0467; 10.3324; 16.871; 101; 92.143; 101.307;  

COD ID: 1570544
CIF file Formula: - C31 H35 N O2 -
Comments: Okumatsu, Daichi; Kiyokawa, Kensuke; Bao Nguyen, Linh Tran; Abe, Manabu; Minakata, Satoshi Photoexcitation of (diarylmethylene)amino benziodoxolones for alkylamination of styrene derivatives with carboxylic acids. Chemical science 15(3) (2024) 1068-1076
Space group: P 1 21/n 1
Cell volume: 2478.56
Cell parameters: 9.6712; 10.1319; 25.4616; 90; 96.565; 90;  

COD ID: 1570545
CIF file Formula: - C28 H31 N O2 -
Comments: Okumatsu, Daichi; Kiyokawa, Kensuke; Bao Nguyen, Linh Tran; Abe, Manabu; Minakata, Satoshi Photoexcitation of (diarylmethylene)amino benziodoxolones for alkylamination of styrene derivatives with carboxylic acids. Chemical science 15(3) (2024) 1068-1076
Space group: P 1 21/n 1
Cell volume: 2368.72
Cell parameters: 9.0767; 10.2335; 25.6684; 90; 96.542; 90;  

COD ID: 1570546
CIF file Formula: - C32 H33 N3 -
Comments: Okumatsu, Daichi; Kiyokawa, Kensuke; Bao Nguyen, Linh Tran; Abe, Manabu; Minakata, Satoshi Photoexcitation of (diarylmethylene)amino benziodoxolones for alkylamination of styrene derivatives with carboxylic acids. Chemical science 15(3) (2024) 1068-1076
Space group: P -1
Cell volume: 2513.4
Cell parameters: 10.3382; 15.2358; 17.3918; 107.109; 95.894; 102.639;  

COD ID: 1570547
CIF file Formula: - C36 H26 Cl Cu N3 O4 S2 -
Comments: Mandal, Mukunda; Buss, Joshua A.; Chen, Si-Jie; Cramer, Christopher J.; Stahl, Shannon S. Mechanistic insights into radical formation and functionalization in copper/<i>N</i>-fluorobenzenesulfonimide radical-relay reactions. Chemical science 15(4) (2024) 1364-1373
Space group: P -1
Cell volume: 1675.3
Cell parameters: 10.232; 10.735; 16.557; 85.248; 72.999; 74.424;  

COD ID: 1570548
CIF file Formula: - C28 H72 Cl2 N7 O14 Yb -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2047.63
Cell parameters: 17.3928; 17.3928; 6.7688; 90; 90; 90;  

COD ID: 1570549
CIF file Formula: - C3.11 H6.72 Cl0.22 Dy0.11 N0.78 O1.56 -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2071.11
Cell parameters: 17.4527; 17.4527; 6.7995; 90; 90; 90;  

COD ID: 1570550
CIF file Formula: - C28 H67 Cl2 N7 O14 Y -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2065.3
Cell parameters: 17.4345; 17.4345; 6.7946; 90; 90; 90;  

COD ID: 1570551
CIF file Formula: - C14 H30.5 Cl N3.5 O7 Tm0.5 -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2047.17
Cell parameters: 17.3929; 17.3929; 6.7672; 90; 90; 90;  

COD ID: 1570552
CIF file Formula: - C28 H0.5 Cl2 Er N7 O14 -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2059.6
Cell parameters: 17.4237; 17.4237; 6.7843; 90; 90; 90;  

COD ID: 1570553
CIF file Formula: - C14 H35.5 Cl Ho0.5 N3.5 O7 -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2052.41
Cell parameters: 17.4077; 17.4077; 6.773; 90; 90; 90;  

COD ID: 1570554
CIF file Formula: - C14 H34.5 Cl N3.5 O7 Tb0.5 -
Comments: Manvell, Anna Schannong; Pfleger, Rouven; Bonde, Niels Andreas; Briganti, Matteo; Mattei, Carlo Andrea; Nannestad, Theis Brock; Weihe, Høgni; Powell, Annie K.; Ollivier, Jacques; Bendix, Jesper; Perfetti, Mauro LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry. Chemical science 15(1) (2023) 113-123
Space group: P 4 b m
Cell volume: 2056.78
Cell parameters: 17.4148; 17.4148; 6.7819; 90; 90; 90;  

COD ID: 1570556
CIF file Formula: - C30 H34 Fe N2 O2 Zn -
Comments: Perez-Jimenez, Marina; Crimmin, Mark R. Photochemical H<sub>2</sub> activation by an Zn-Fe heterometallic: a mechanistic investigation. Chemical science 15(4) (2024) 1424-1430
Space group: P b c a
Cell volume: 5585.2
Cell parameters: 14.1876; 14.5939; 26.9748; 90; 90; 90;  

COD ID: 1570557
CIF file Formula: - C71 H94 Fe2 N4 O3 Zn2 -
Comments: Perez-Jimenez, Marina; Crimmin, Mark R. Photochemical H<sub>2</sub> activation by an Zn-Fe heterometallic: a mechanistic investigation. Chemical science 15(4) (2024) 1424-1430
Space group: P -1
Cell volume: 3336.8
Cell parameters: 10.6485; 15.0229; 20.9423; 89.192; 89.647; 84.943;  

COD ID: 1570558
CIF file Formula: - C185 H151 N3 -
Comments: Ruan, Lan; Luo, Wanhua; Zhang, Haifan; Liu, Peng; Shi, Yong; An, Peng Cycl[2,2,4]azine-embedded non-alternant nanographenes containing fused antiaromatic azepine ring. Chemical science 15(4) (2024) 1511-1519
Space group: P -1
Cell volume: 6303
Cell parameters: 11.1406; 16.2422; 35.82; 96.234; 92.497; 101.357;  

COD ID: 1570559
CIF file Formula: - C17 H18 N -
Comments: Rago, Alexander J.; Ye, Rong; Liu, Xin; Dong, Guangbin A four-component reaction to access 3,3-disubstituted indolines <i>via</i> the palladium-norbornene-catalyzed <i>ortho</i> amination/<i>ipso</i> conjunctive coupling. Chemical science 15(4) (2024) 1318-1323
Space group: P 21 21 21
Cell volume: 1348.08
Cell parameters: 8.5075; 9.6128; 16.4841; 90; 90; 90;  

COD ID: 1570562
CIF file Formula: - C30 H36 Cl2 N10 Ni O S2 -
Comments: Dharmasivam, Mahendiran; Kaya, Busra; Wijesinghe, Tharushi P.; Richardson, Vera; Harmer, Jeffrey R.; Gonzalvez, Miguel A.; Lewis, William; Azad, Mahan Gholam; Bernhardt, Paul V.; Richardson, Des R. Differential transmetallation of complexes of the anti-cancer thiosemicarbazone, Dp4e4mT: effects on anti-proliferative efficacy, redox activity, oxy-myoglobin and oxy-hemoglobin oxidation. Chemical science 15(3) (2024) 974-990
Space group: P -1
Cell volume: 1730.7
Cell parameters: 9.141; 14.09; 14.188; 94.82; 92.36; 107.67;  

COD ID: 1570563
CIF file Formula: - C30 H35 Cl Cu N10 O5 S2 -
Comments: Dharmasivam, Mahendiran; Kaya, Busra; Wijesinghe, Tharushi P.; Richardson, Vera; Harmer, Jeffrey R.; Gonzalvez, Miguel A.; Lewis, William; Azad, Mahan Gholam; Bernhardt, Paul V.; Richardson, Des R. Differential transmetallation of complexes of the anti-cancer thiosemicarbazone, Dp4e4mT: effects on anti-proliferative efficacy, redox activity, oxy-myoglobin and oxy-hemoglobin oxidation. Chemical science 15(3) (2024) 974-990
Space group: P -1
Cell volume: 1691.94
Cell parameters: 9.5625; 13.6735; 13.8397; 73.376; 77.366; 86.693;  

COD ID: 1570564
CIF file Formula: - C30 H32 N10 S2 Zn -
Comments: Dharmasivam, Mahendiran; Kaya, Busra; Wijesinghe, Tharushi P.; Richardson, Vera; Harmer, Jeffrey R.; Gonzalvez, Miguel A.; Lewis, William; Azad, Mahan Gholam; Bernhardt, Paul V.; Richardson, Des R. Differential transmetallation of complexes of the anti-cancer thiosemicarbazone, Dp4e4mT: effects on anti-proliferative efficacy, redox activity, oxy-myoglobin and oxy-hemoglobin oxidation. Chemical science 15(3) (2024) 974-990
Space group: P -1
Cell volume: 1556.9
Cell parameters: 10.7315; 10.8268; 14.7436; 109.844; 91.411; 103.463;  

COD ID: 1570565
CIF file Formula: - C30 H34 Ga N11 O4 S2 -
Comments: Dharmasivam, Mahendiran; Kaya, Busra; Wijesinghe, Tharushi P.; Richardson, Vera; Harmer, Jeffrey R.; Gonzalvez, Miguel A.; Lewis, William; Azad, Mahan Gholam; Bernhardt, Paul V.; Richardson, Des R. Differential transmetallation of complexes of the anti-cancer thiosemicarbazone, Dp4e4mT: effects on anti-proliferative efficacy, redox activity, oxy-myoglobin and oxy-hemoglobin oxidation. Chemical science 15(3) (2024) 974-990
Space group: P -1
Cell volume: 1713.04
Cell parameters: 8.7832; 11.7181; 17.1171; 92.486; 102.138; 94.766;  

COD ID: 1570566
CIF file Formula: - C31 H38 Cl Co N10 O2 S2 -
Comments: Dharmasivam, Mahendiran; Kaya, Busra; Wijesinghe, Tharushi P.; Richardson, Vera; Harmer, Jeffrey R.; Gonzalvez, Miguel A.; Lewis, William; Azad, Mahan Gholam; Bernhardt, Paul V.; Richardson, Des R. Differential transmetallation of complexes of the anti-cancer thiosemicarbazone, Dp4e4mT: effects on anti-proliferative efficacy, redox activity, oxy-myoglobin and oxy-hemoglobin oxidation. Chemical science 15(3) (2024) 974-990
Space group: C 1 2/c 1
Cell volume: 7561.3
Cell parameters: 22.7746; 14.2349; 23.3316; 90; 91.509; 90;  

COD ID: 1570567
CIF file Formula: - C15 H16 Cl N5 Pd S -
Comments: Dharmasivam, Mahendiran; Kaya, Busra; Wijesinghe, Tharushi P.; Richardson, Vera; Harmer, Jeffrey R.; Gonzalvez, Miguel A.; Lewis, William; Azad, Mahan Gholam; Bernhardt, Paul V.; Richardson, Des R. Differential transmetallation of complexes of the anti-cancer thiosemicarbazone, Dp4e4mT: effects on anti-proliferative efficacy, redox activity, oxy-myoglobin and oxy-hemoglobin oxidation. Chemical science 15(3) (2024) 974-990
Space group: P -1
Cell volume: 1672.06
Cell parameters: 10.0507; 10.5184; 17.5993; 73.219; 81.923; 69.997;  

COD ID: 1570572
CIF file Formula: - C59 H104 K La Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: C 2 2 21
Cell volume: 12205.3
Cell parameters: 18.1753; 22.3961; 29.9843; 90; 90; 90;  

COD ID: 1570573
CIF file Formula: - C55.5 H100 Ce K Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: C 2 2 21
Cell volume: 12205.3
Cell parameters: 18.1753; 22.3961; 29.9843; 90; 90; 90;  

COD ID: 1570574
CIF file Formula: - C52 H96 K Nd Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/n 1
Cell volume: 5517.7
Cell parameters: 14.8785; 17.3956; 21.4878; 90; 97.196; 90;  

COD ID: 1570575
CIF file Formula: - C52 H96 K La Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/n 1
Cell volume: 5591.4
Cell parameters: 14.9492; 17.4712; 21.5754; 90; 97.134; 90;  

COD ID: 1570576
CIF file Formula: - C52 H96 K Pr Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/n 1
Cell volume: 5607.5
Cell parameters: 14.9574; 17.5114; 21.5769; 90; 97.154; 90;  

COD ID: 1570577
CIF file Formula: - C59 H104 Er K Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: F 2 d d
Cell volume: 24196.1
Cell parameters: 16.0025; 32.4257; 46.6302; 90; 90; 90;  

COD ID: 1570578
CIF file Formula: - C54 H101 Ce K O0.5 Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/c 1
Cell volume: 6089.1
Cell parameters: 21.4286; 15.456; 18.8223; 90; 102.374; 90;  

COD ID: 1570579
CIF file Formula: - C52 H96 K Lu Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/n 1
Cell volume: 5499.1
Cell parameters: 14.843; 17.3279; 21.557; 90; 97.33; 90;  

COD ID: 1570580
CIF file Formula: - C52 H95 Er K Si4 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/n 1
Cell volume: 5507.8
Cell parameters: 14.8618; 17.3571; 21.5304; 90; 97.39; 90;  

COD ID: 1570581
CIF file Formula: - C118 H208 K2 Pr2 Si8 -
Comments: Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W. It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers. Chemical science 15(4) (2024) 1338-1347
Space group: P 1 21/n 1
Cell volume: 12080.8
Cell parameters: 13.8875; 33.4663; 26.021; 90; 92.638; 90;  

COD ID: 1570585
CIF file Formula: - C26 H21 Cl N2 O3 -
Comments: Formen, Jeffrey S. S. K.; Hassan, Diandra S.; Wolf, Christian Chemometric sensing of stereoisomeric compound mixtures with a redox-responsive optical probe. Chemical science 15(4) (2024) 1498-1504
Space group: P 21 21 21
Cell volume: 2183
Cell parameters: 5.8943; 13.4561; 27.524; 90; 90; 90;  

COD ID: 1570586
CIF file Formula: - C26 H25 N O3 S Se -
Comments: Das, Kousik; Pedada, Abhilash; Singha, Tushar; Hari, Durga Prasad Strain-enabled radical spirocyclization cascades: rapid access to spirocyclobutyl lactones and - lactams. Chemical science 15(9) (2024) 3182-3191
Space group: P 1 21/n 1
Cell volume: 2355.1
Cell parameters: 14.879; 8.126; 19.752; 90; 99.543; 90;  

COD ID: 1570587
CIF file Formula: - C26 H24 Cl N O3 S -
Comments: Das, Kousik; Pedada, Abhilash; Singha, Tushar; Hari, Durga Prasad Strain-enabled radical spirocyclization cascades: rapid access to spirocyclobutyl lactones and - lactams. Chemical science 15(9) (2024) 3182-3191
Space group: P 21 21 21
Cell volume: 2216.03
Cell parameters: 6.1782; 11.4363; 31.3637; 90; 90; 90;  

COD ID: 1570588
CIF file Formula: - C128 H56 N5 Nd Ni Sc2 -
Comments: Yang, Wei; Rosenkranz, Marco; Velkos, Georgios; Ziegs, Frank; Dubrovin, Vasilii; Schiemenz, Sandra; Spree, Lukas; de Souza Barbosa, Matheus Felipe; Guillemard, Charles; Valvidares, Manuel; Büchner, Bernd; Liu, Fupin; Avdoshenko, Stanislav M.; Popov, Alexey A. Covalency <i>versus</i> magnetic axiality in Nd molecular magnets: Nd-photoluminescence, strong ligand-field, and unprecedented nephelauxetic effect in fullerenes NdM<sub>2</sub>N@C<sub>80</sub> (M = Sc, Lu, Y). Chemical science 15(6) (2024) 2141-2157
Space group: C 1 2/c 1
Cell volume: 14892
Cell parameters: 25.3; 14.98; 39.47; 90; 95.44; 90;  

COD ID: 1570589
CIF file Formula: - Cs3 O11 V -
Comments: Ribó, Eduard Garrido; Mao, Zhiwei; Hirschi, Jacob S.; Linsday, Taylor; Bach, Karlie; Walter, Eric D.; Simons, Casey R.; Zuehlsdorff, Tim J.; Nyman, May Implementing vanadium peroxides as direct air carbon capture materials. Chemical science 15(5) (2024) 1700-1713
Space group: P 1 21/n 1
Cell volume: 1162.57
Cell parameters: 8.4013; 12.0178; 11.5178; 90; 91.359; 90;  

COD ID: 1570590
CIF file Formula: - O13 Rb3 V -
Comments: Ribó, Eduard Garrido; Mao, Zhiwei; Hirschi, Jacob S.; Linsday, Taylor; Bach, Karlie; Walter, Eric D.; Simons, Casey R.; Zuehlsdorff, Tim J.; Nyman, May Implementing vanadium peroxides as direct air carbon capture materials. Chemical science 15(5) (2024) 1700-1713
Space group: P 1 21/n 1
Cell volume: 1153.65
Cell parameters: 6.8447; 23.2894; 7.8276; 90; 112.399; 90;  

COD ID: 1570591
CIF file Formula: - C31 H33 N3 O4 -
Comments: Waly, Sara M. A.; Benniston, Andrew C.; Harriman, Anthony Deducing the conformational space for an octa-proline helix. Chemical science 15(5) (2024) 1657-1671
Space group: P 1 21 1
Cell volume: 1311.55
Cell parameters: 10.3503; 8.7745; 14.9164; 90; 104.498; 90;  

COD ID: 1570592
CIF file Formula: - C17 H14 F2 -
Comments: Chakrabarti, Kaushik; Wade Wolfe, Michael M.; Guo, Shuo; Tucker, Joseph W.; Lee, Jisun; Szymczak, Nathaniel K. A metal-free strategy to construct fluoroalkyl-olefin linkages using fluoroalkanes. Chemical science 15(5) (2024) 1752-1757
Space group: P 21 21 21
Cell volume: 1272.88
Cell parameters: 8.6715; 9.651; 15.2097; 90; 90; 90;  

COD ID: 1570597
CIF file Formula: - C52 H64 F3 Fe Mn N7 O7 P3 S -
Comments: Lee, Justin L.; Biswas, Saborni; Ziller, Joseph W.; Bominaar, Emile L.; Hendrich, Michael P.; Borovik, A. S. Accessing a synthetic Fe<sup>III</sup>Mn<sup>IV</sup> core to model biological heterobimetallic active sites. Chemical science 15(8) (2024) 2817-2826
Space group: P -1
Cell volume: 5443.2
Cell parameters: 14.8784; 17.2401; 21.4396; 90.821; 90.355; 98.1446;  

COD ID: 1570598
CIF file Formula: - C53.5 H66 Cl3 F3 Fe Mn N7 O7 P3 S -
Comments: Lee, Justin L.; Biswas, Saborni; Ziller, Joseph W.; Bominaar, Emile L.; Hendrich, Michael P.; Borovik, A. S. Accessing a synthetic Fe<sup>III</sup>Mn<sup>IV</sup> core to model biological heterobimetallic active sites. Chemical science 15(8) (2024) 2817-2826
Space group: P -1
Cell volume: 3160.3
Cell parameters: 14.5521; 15.0662; 16.7358; 70.9679; 65.6681; 82.915;  

COD ID: 1570599
CIF file Formula: - C54 H65 Cl3 F6 Fe Mn N7 O10 P3 S2 -
Comments: Lee, Justin L.; Biswas, Saborni; Ziller, Joseph W.; Bominaar, Emile L.; Hendrich, Michael P.; Borovik, A. S. Accessing a synthetic Fe<sup>III</sup>Mn<sup>IV</sup> core to model biological heterobimetallic active sites. Chemical science 15(8) (2024) 2817-2826
Space group: P 1 21/c 1
Cell volume: 6658.1
Cell parameters: 16.7414; 14.8414; 26.8159; 90; 92.1641; 90;  

COD ID: 1570601
CIF file Formula: - C15 H21 B Cl I O2 -
Comments: Seidler, Gesa; Schwenzer, Max; Clausen, Florian; Daniliuc, Constantin G.; Studer, Armido Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes. Chemical science 15(5) (2024) 1672-1678
Space group: P n a 21
Cell volume: 1765.53
Cell parameters: 14.7648; 11.9997; 9.965; 90; 90; 90;  

COD ID: 1570602
CIF file Formula: - C21 H33 B O2 Si -
Comments: Seidler, Gesa; Schwenzer, Max; Clausen, Florian; Daniliuc, Constantin G.; Studer, Armido Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes. Chemical science 15(5) (2024) 1672-1678
Space group: P -1
Cell volume: 2244.36
Cell parameters: 9.2744; 11.9893; 21.6544; 98.33; 102.067; 103.257;  

COD ID: 1570603
CIF file Formula: - C23 H29 B O4 -
Comments: Seidler, Gesa; Schwenzer, Max; Clausen, Florian; Daniliuc, Constantin G.; Studer, Armido Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes. Chemical science 15(5) (2024) 1672-1678
Space group: P 1 21/n 1
Cell volume: 2126.2
Cell parameters: 6.3808; 12.5531; 26.558; 90; 91.822; 90;  

COD ID: 1570604
CIF file Formula: - C24 H31 B O2 -
Comments: Seidler, Gesa; Schwenzer, Max; Clausen, Florian; Daniliuc, Constantin G.; Studer, Armido Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes. Chemical science 15(5) (2024) 1672-1678
Space group: P 1 21/c 1
Cell volume: 4248.8
Cell parameters: 12.9545; 20.8834; 16.8105; 90; 110.893; 90;  

COD ID: 1570605
CIF file Formula: - C24 H35 B O2 Si -
Comments: Seidler, Gesa; Schwenzer, Max; Clausen, Florian; Daniliuc, Constantin G.; Studer, Armido Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes. Chemical science 15(5) (2024) 1672-1678
Space group: P 1 21/c 1
Cell volume: 2370.71
Cell parameters: 11.8688; 17.6865; 12.6092; 90; 116.407; 90;  

COD ID: 1570606
CIF file Formula: - C27 H35 B Fe O2 -
Comments: Seidler, Gesa; Schwenzer, Max; Clausen, Florian; Daniliuc, Constantin G.; Studer, Armido Borylative transition metal-free couplings of vinyl iodides with various nucleophiles, alkenes or alkynes. Chemical science 15(5) (2024) 1672-1678
Space group: P -1
Cell volume: 1205.26
Cell parameters: 9.8635; 11.6173; 12.5223; 100.723; 106.987; 111.523;  

COD ID: 1570619
CIF file Formula: - C3.39 H4.36 Mn0.12 N0.36 O0.24 -
Comments: 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 15(6) (2024) 2211-2220
Space group: P 1 21/n 1
Cell volume: 2544.8
Cell parameters: 13.155; 12.7828; 15.378; 90; 100.227; 90;  

COD ID: 1570620
CIF file Formula: - C60.33 H36.33 O64.66 Zr12 -
Comments: Shiraishi, Kyoko; Otsubo, Kazuya; Kato, Kenichi; Sadakiyo, Masaaki A novel threefold interpenetrated zirconium metal-organic framework exhibiting separation ability for strong acids. Chemical science 15(4) (2024) 1441-1448
Space group: P -3 1 m
Cell volume: 6218.3
Cell parameters: 26.659; 26.659; 10.103; 90; 90; 120;  

COD ID: 1570621
CIF file Formula: - C29 H18 F3 N -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P 42/n :2
Cell volume: 4305.78
Cell parameters: 22.8051; 22.8051; 8.2792; 90; 90; 90;  

COD ID: 1570622
CIF file Formula: - C38 H39 N -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P -1
Cell volume: 1450.31
Cell parameters: 10.9754; 12.115; 12.3347; 116.431; 95.048; 94.47;  

COD ID: 1570623
CIF file Formula: - C94 H90 N2 -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P 1 21/n 1
Cell volume: 6814.1
Cell parameters: 27.4355; 7.9543; 31.2422; 90; 91.937; 90;  

COD ID: 1570624
CIF file Formula: - C64 H42 N2 -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P 1 21/n 1
Cell volume: 4360.59
Cell parameters: 15.719; 8.3643; 33.8437; 90; 101.487; 90;  

COD ID: 1570625
CIF file Formula: - C18 H19 N0.5 -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P 1 21/c 1
Cell volume: 2840.61
Cell parameters: 15.0249; 11.6534; 16.3566; 90; 97.312; 90;  

COD ID: 1570626
CIF file Formula: - C52 H42 -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P -1
Cell volume: 2166.5
Cell parameters: 12.0253; 14.285; 15.2395; 63.792; 67.462; 77.789;  

COD ID: 1570627
CIF file Formula: - C58 H45 Cl2 N -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P -1
Cell volume: 2138.07
Cell parameters: 10.381; 14.348; 15.6103; 94.929; 102.901; 107.046;  

COD ID: 1570628
CIF file Formula: - C44 H26 Cl6 S -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P 1 21/c 1
Cell volume: 3596.33
Cell parameters: 12.2354; 14.2615; 20.8253; 90; 98.248; 90;  

COD ID: 1570629
CIF file Formula: - C84 H92 S2 -
Comments: Kato, Yugo; Nishimura, Kazutoshi; Nishii, Yuji; Hirano, Koji Direct synthesis of spirobifluorenes by formal dehydrative coupling of biaryls and fluorenones. Chemical science 15(6) (2024) 2112-2117
Space group: P 1 21/c 1
Cell volume: 6758.6
Cell parameters: 22.0314; 12.4409; 26.6247; 90; 112.159; 90;  

COD ID: 1570632
CIF file Formula: - C39 H41 Cu Ge N2 -
Comments: 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 15(2) (2024) 584-593
Space group: P -1
Cell volume: 1685.35
Cell parameters: 10.65; 11.2963; 15.0976; 111.368; 93.137; 92.33;  

COD ID: 1570633
CIF file Formula: - C40 H43 Cu Ge N2 -
Comments: 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 15(2) (2024) 584-593
Space group: P 1 21/n 1
Cell volume: 3481.76
Cell parameters: 8.9616; 19.7494; 20.04; 90; 100.99; 90;  

COD ID: 1570634
CIF file Formula: - C40 H46 Cu N3 O -
Comments: 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 15(2) (2024) 584-593
Space group: P c a 21
Cell volume: 3594.46
Cell parameters: 16.2264; 10.8168; 20.4792; 90; 90; 90;  

COD ID: 1570635
CIF file Formula: - C92 H102 Cu2 Ge2 N4 S4 -
Comments: 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 15(2) (2024) 584-593
Space group: P -1
Cell volume: 4233.9
Cell parameters: 13.1905; 18.6418; 20.1369; 66.024; 81.401; 69.363;  

COD ID: 1570636
CIF file Formula: - C50 H60 Cu Ge N3 S -
Comments: 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 15(2) (2024) 584-593
Space group: P 1 21/c 1
Cell volume: 4516.96
Cell parameters: 10.22373; 20.07164; 22.27774; 90; 98.8634; 90;  

COD ID: 1570637
CIF file Formula: - C53 H57 Cu Ge N2 -
Comments: 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 15(2) (2024) 584-593
Space group: P 1 21/n 1
Cell volume: 4549.63
Cell parameters: 12.3095; 19.8911; 18.5854; 90; 91.1959; 90;  

COD ID: 1570638
CIF file Formula: - C90 H102 Cu2 Ge2 N4 -
Comments: 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 15(2) (2024) 584-593
Space group: P -1
Cell volume: 4051.84
Cell parameters: 11.0264; 19.2655; 20.3965; 86.283; 77.281; 73.472;  

COD ID: 1570639
CIF file Formula: - C53 H57 Cu Ge N2 -
Comments: 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 15(2) (2024) 584-593
Space group: P 1 21/n 1
Cell volume: 4581.74
Cell parameters: 14.9501; 19.7103; 16.1176; 90; 105.269; 90;  

COD ID: 1570640
CIF file Formula: - C59 H57 Cu Ge N4 O2 -
Comments: 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 15(2) (2024) 584-593
Space group: P 1 21/n 1
Cell volume: 4965.4
Cell parameters: 11.48162; 30.4535; 14.25277; 90; 94.8925; 90;  

COD ID: 1570641
CIF file Formula: - C46 H55 Cu Ge N2 -
Comments: 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 15(2) (2024) 584-593
Space group: P 21 21 21
Cell volume: 4076.26
Cell parameters: 12.0126; 17.1438; 19.7933; 90; 90; 90;  

COD ID: 1570642
CIF file Formula: - C20 H26 O12 Ti2 -
Comments: 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 15(7) (2024) 2655-2664
Space group: P 1 21/c 1
Cell volume: 1145
Cell parameters: 9.0139; 14.186; 8.9545; 90; 90.487; 90;  

COD ID: 1570643
CIF file Formula: - C134 H100 O58 Ti16 -
Comments: 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 15(7) (2024) 2655-2664
Space group: P -1
Cell volume: 3417.2
Cell parameters: 15.114; 16.444; 17.284; 63.041; 64.513; 71.596;  

COD ID: 1570644
CIF file Formula: - C154 H136 O56 Ti16 -
Comments: 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 15(7) (2024) 2655-2664
Space group: P -1
Cell volume: 3814.6
Cell parameters: 16.79; 16.977; 17.003; 113.206; 113.379; 98.474;  

COD ID: 1570645
CIF file Formula: - C72 H79 O29 Ti8 -
Comments: 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 15(7) (2024) 2655-2664
Space group: P -1
Cell volume: 4189.1
Cell parameters: 13.7327; 14.2235; 23.4194; 87.685; 89.986; 66.441;  

COD ID: 1570646
CIF file Formula: - C59 H13 F25 N4 O S2 -
Comments: 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 15(6) (2024) 2047-2054
Space group: P -1
Cell volume: 2697
Cell parameters: 9.774; 14.769; 18.881; 95.08; 95.96; 92.17;  

COD ID: 1570647
CIF file Formula: - C77 H27 Cl F25 N4 O P Pd S2 -
Comments: 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 15(6) (2024) 2047-2054
Space group: P -1
Cell volume: 4738.3
Cell parameters: 16.9156; 17.3251; 19.0029; 70.416; 65.162; 76.985;  

COD ID: 1570648
CIF file Formula: - C59 H11 F25 N4 O Pd S2 -
Comments: 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 15(6) (2024) 2047-2054
Space group: P -1
Cell volume: 3292.5
Cell parameters: 12.633; 16.87; 18.51; 113.418; 96.893; 108.505;  

COD ID: 1570649
CIF file Formula: - C52 H12 F20 N4 O Pd S2 -
Comments: 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 15(6) (2024) 2047-2054
Space group: P -1
Cell volume: 5067.6
Cell parameters: 17.633; 18.145; 19.027; 104.695; 103.672; 112.112;  

COD ID: 1570650
CIF file Formula: - C87 H36 F25 N6 O P Pd2 S2 -
Comments: 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 15(6) (2024) 2047-2054
Space group: P -1
Cell volume: 3866
Cell parameters: 14.977; 16.782; 16.991; 106.814; 90.699; 107.905;  

COD ID: 1570693
CIF file Formula: - C22 H23 B F N O2 -
Comments: 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 15(6) (2024) 2236-2242
Space group: P 1 21/n 1
Cell volume: 1936.1
Cell parameters: 9.8733; 11.5417; 17.0581; 90; 95.13; 90;  

COD ID: 1570694
CIF file Formula: - C23 H26 B N O2 -
Comments: 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 15(6) (2024) 2236-2242
Space group: P -1
Cell volume: 1014.75
Cell parameters: 7.0732; 12.8154; 12.8838; 109.101; 103.862; 102.475;  

COD ID: 1570695
CIF file Formula: - C20 H28 B N O2 -
Comments: 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 15(6) (2024) 2236-2242
Space group: P 1 21/c 1
Cell volume: 1926.03
Cell parameters: 14.9832; 9.6904; 13.4858; 90; 100.376; 90;  

COD ID: 1570696
CIF file Formula: - C22 H24 B N O2 -
Comments: 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 15(6) (2024) 2236-2242
Space group: P -1
Cell volume: 1123.73
Cell parameters: 10.1597; 10.2937; 11.2498; 79.933; 89.723; 76.12;  

COD ID: 1570697
CIF file Formula: - C22 H24 B N O2 -
Comments: 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 15(6) (2024) 2236-2242
Space group: P -1
Cell volume: 949.7
Cell parameters: 9.6547; 10.2621; 10.6861; 102.169; 105.217; 103.684;  

COD ID: 1570698
CIF file Formula: - C32 H27 F2 N3 O -
Comments: 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 15(6) (2024) 2205-2210
Space group: C 1 c 1
Cell volume: 2567.6
Cell parameters: 14.9152; 9.8681; 18.7455; 90; 111.468; 90;  

COD ID: 1570699
CIF file Formula: - C33 H31 F2 N3 O2 -
Comments: 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 15(6) (2024) 2205-2210
Space group: P 1 21/n 1
Cell volume: 2761.2
Cell parameters: 10.1447; 26.4984; 10.7233; 90; 106.691; 90;  

COD ID: 1570701
CIF file Formula: - C34 H19 B -
Comments: Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science 15(8) (2024) 2984-2989
Space group: P 1 2/c 1
Cell volume: 2070.5
Cell parameters: 20.652; 4.902; 21.645; 90; 109.11; 90;  

COD ID: 1570702
CIF file Formula: - C34 H19 B -
Comments: Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science 15(8) (2024) 2984-2989
Space group: R 3 :H
Cell volume: 4988.2
Cell parameters: 34.63; 34.63; 4.803; 90; 90; 120;  

COD ID: 1570703
CIF file Formula: - C88 H64 B N3 O4 -
Comments: Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science 15(8) (2024) 2984-2989
Space group: P 1 21/c 1
Cell volume: 6264
Cell parameters: 26.86; 14.399; 16.935; 90; 106.99; 90;  

COD ID: 1570724
CIF file Formula: - C22 H23 Br N2 O2 S -
Comments: Bulger, Ana S.; Nasrallah, Daniel J.; Tena Meza, Arismel; Garg, Neil K. Enantioselective nickel-catalyzed Mizoroki-Heck cyclizations of amide electrophiles. Chemical science 15(7) (2024) 2593-2600
Space group: P 1 21 1
Cell volume: 2115.65
Cell parameters: 9.5459; 19.1854; 11.5679; 90; 93.009; 90;  

COD ID: 1570745
CIF file Formula: - C55 H63 Ge N2 P Si -
Comments: Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science 15(7) (2024) 2391-2397
Space group: P 1 21/n 1
Cell volume: 4761.1
Cell parameters: 17.1513; 13.5641; 20.7152; 90; 98.907; 90;  

COD ID: 1570746
CIF file Formula: - C63 H79 N2 O2 P Si Sn -
Comments: Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science 15(7) (2024) 2391-2397
Space group: P 1 21 1
Cell volume: 2831
Cell parameters: 12.462; 15.316; 14.954; 90; 97.32; 90;  

COD ID: 1570747
CIF file Formula: - C66 H79 Ge N2 O2 P Si -
Comments: Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science 15(7) (2024) 2391-2397
Space group: P 1 21/n 1
Cell volume: 6112
Cell parameters: 10.922; 20.846; 26.946; 90; 94.951; 90;  

COD ID: 1570748
CIF file Formula: - C59 H73 Ge N2 O P5 Si -
Comments: Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides. Chemical science 15(7) (2024) 2391-2397
Space group: P -1
Cell volume: 2831.2
Cell parameters: 13.13; 13.51; 17.559; 91.771; 105.725; 107.874;  

COD ID: 1570759
CIF file Formula: - C120 H104 Cu4 N12 O38 -
Comments: 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 15(8) (2024) 2857-2866
Space group: P 1 21/n 1
Cell volume: 8238.82
Cell parameters: 19.7309; 16.8006; 24.9013; 90; 93.538; 90;  

COD ID: 1570760
CIF file Formula: - C148.66 H167.11 Cu4 N18.66 O46.56 -
Comments: 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 15(8) (2024) 2857-2866
Space group: P 1 21/n 1
Cell volume: 8320.43
Cell parameters: 19.9031; 16.7668; 24.9964; 90; 94.081; 90;  

COD ID: 1570761
CIF file Formula: - C151.32 H173.29 Cu4 N18.66 O46.56 -
Comments: 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 15(8) (2024) 2857-2866
Space group: P 1 21/n 1
Cell volume: 8389.74
Cell parameters: 19.9329; 16.7488; 25.2197; 90; 94.831; 90;  

COD ID: 1570762
CIF file Formula: - C138.88 H142.27 Cu4 N15.16 O44.67 -
Comments: 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 15(8) (2024) 2857-2866
Space group: P 1 21/n 1
Cell volume: 8486.15
Cell parameters: 19.834; 16.8359; 25.5694; 90; 96.331; 90;  

COD ID: 1570763
CIF file Formula: - C22 H15 N O3 S -
Comments: 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 15(8) (2024) 2827-2832
Space group: P 1 21/n 1
Cell volume: 1774.1
Cell parameters: 10.854; 10.173; 16.146; 90; 95.651; 90;  

COD ID: 1570764
CIF file Formula: - C22 H15 N O3 S -
Comments: 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 15(8) (2024) 2827-2832
Space group: P -1
Cell volume: 869.6
Cell parameters: 8.9567; 10.129; 11.0747; 115.736; 95.407; 101.18;  

COD ID: 1570765
CIF file Formula: - C22 H15 N O3 S -
Comments: 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 15(8) (2024) 2827-2832
Space group: C 1 2/c 1
Cell volume: 3491.1
Cell parameters: 13.7479; 17.9258; 14.2154; 90; 94.773; 90;  

COD ID: 1570766
CIF file Formula: - C22 H15 N O3 S -
Comments: 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 15(8) (2024) 2827-2832
Space group: P -1
Cell volume: 859.28
Cell parameters: 8.9045; 10.4068; 11.071; 63.033; 71.405; 75.259;  

COD ID: 1570767
CIF file Formula: - C21 H13 N O4 S -
Comments: 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 15(8) (2024) 2827-2832
Space group: P 1 21/n 1
Cell volume: 1716.8
Cell parameters: 8.086; 5.5939; 38.073; 90; 94.504; 90;  

COD ID: 1570769
CIF file Formula: - C130 H148 Cl4 Cu4 N16 -
Comments: Kazmierczak, Nathanael P.; Lopez, Nathan E.; Luedecke, Kaitlin M.; Hadt, Ryan G. Determining the key vibrations for spin relaxation in ruffled Cu(ii) porphyrins <i>via</i> resonance Raman spectroscopy. Chemical science 15(7) (2024) 2380-2390
Space group: I 41
Cell volume: 5631.4
Cell parameters: 10.8836; 10.8836; 47.541; 90; 90; 90;  

COD ID: 1570770
CIF file Formula: - C21 H26 N2 O4 Si -
Comments: Guerzoni, Michael G.; van Ingen, Yara; Babaahmadi, Rasool; Wirth, Thomas; Richards, Emma; Melen, Rebecca L. An un-forgotten classic: the nitro-Mannich reaction between nitrones and silyl nitronates catalysed by B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>. Chemical science 15(7) (2024) 2648-2654
Space group: P 21 21 21
Cell volume: 2122.52
Cell parameters: 9.9467; 10.7574; 19.8365; 90; 90; 90;  

COD ID: 1570771
CIF file Formula: - C19 H26 N2 O3 Si -
Comments: Guerzoni, Michael G.; van Ingen, Yara; Babaahmadi, Rasool; Wirth, Thomas; Richards, Emma; Melen, Rebecca L. An un-forgotten classic: the nitro-Mannich reaction between nitrones and silyl nitronates catalysed by B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>. Chemical science 15(7) (2024) 2648-2654
Space group: C 1 c 1
Cell volume: 4088.3
Cell parameters: 15.3631; 11.8472; 22.4626; 90; 90.492; 90;  

COD ID: 1570772
CIF file Formula: - C32 H13 B F15 N O -
Comments: Guerzoni, Michael G.; van Ingen, Yara; Babaahmadi, Rasool; Wirth, Thomas; Richards, Emma; Melen, Rebecca L. An un-forgotten classic: the nitro-Mannich reaction between nitrones and silyl nitronates catalysed by B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>. Chemical science 15(7) (2024) 2648-2654
Space group: P 1 21/c 1
Cell volume: 2840.9
Cell parameters: 13.0639; 11.4369; 19.0593; 90; 93.949; 90;  

COD ID: 1570773
CIF file Formula: - C32 H13 B F15 N O -
Comments: Guerzoni, Michael G.; van Ingen, Yara; Babaahmadi, Rasool; Wirth, Thomas; Richards, Emma; Melen, Rebecca L. An un-forgotten classic: the nitro-Mannich reaction between nitrones and silyl nitronates catalysed by B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>. Chemical science 15(7) (2024) 2648-2654
Space group: P 1 21/c 1
Cell volume: 2851.55
Cell parameters: 18.4252; 8.0582; 20.1712; 90; 107.799; 90;  

COD ID: 1570774
CIF file Formula: - C31 H11 B F15 N O -
Comments: Guerzoni, Michael G.; van Ingen, Yara; Babaahmadi, Rasool; Wirth, Thomas; Richards, Emma; Melen, Rebecca L. An un-forgotten classic: the nitro-Mannich reaction between nitrones and silyl nitronates catalysed by B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>. Chemical science 15(7) (2024) 2648-2654
Space group: P -1
Cell volume: 1381.1
Cell parameters: 9.0442; 9.8687; 16.26; 83.784; 80.686; 75.18;  

COD ID: 1570780
CIF file Formula: - Ba2 F31 K3 Zr6 -
Comments: Yan, Mei; Tang, Ru-Ling; Yao, Wen-Dong; Liu, Wenlong; Guo, Sheng-Ping Exploring a new short-wavelength nonlinear optical fluoride material featuring unprecedented polar <i>cis</i>-[Zr<sub>6</sub>F<sub>34</sub>]<sup>10-</sup> clusters. Chemical science 15(8) (2024) 2883-2888
Space group: P 63 c m
Cell volume: 1183.87
Cell parameters: 9.4435; 9.4435; 15.3288; 90; 90; 120;  

COD ID: 1570781
CIF file Formula: - C78 H65 Cl F6 P5 Pd3 Sb -
Comments: Jeddi, Neda; Scott, Neil W. J.; Tanner, Theo; Beaumont, Simon K.; Fairlamb, Ian J. S. Evidence for Suzuki-Miyaura cross-couplings catalyzed by ligated Pd<sub>3</sub>-clusters: from cradle to grave. Chemical science 15(8) (2024) 2763-2777
Space group: P 1 21/c 1
Cell volume: 6950.78
Cell parameters: 15.28922; 16.70934; 27.2586; 90; 93.5087; 90;  

COD ID: 1570782
CIF file Formula: - C17 H10 Br N O3 -
Comments: He, Yi; Wang, Juanjuan; Zhu, Tongtong; Zheng, Zhaojing; Wei, Hao Nitrogen atom insertion into arenols to access benzazepines. Chemical science 15(7) (2024) 2612-2617
Space group: P 1 21/c 1
Cell volume: 1471.45
Cell parameters: 5.4496; 20.6183; 13.2918; 90; 99.854; 90;  

COD ID: 1570783
CIF file Formula: - C21 H15 N O3 -
Comments: He, Yi; Wang, Juanjuan; Zhu, Tongtong; Zheng, Zhaojing; Wei, Hao Nitrogen atom insertion into arenols to access benzazepines. Chemical science 15(7) (2024) 2612-2617
Space group: P 1 21/n 1
Cell volume: 1594.73
Cell parameters: 7.762; 12.9308; 15.9453; 90; 94.829; 90;  

COD ID: 1570784
CIF file Formula: - C15 H12 N2 O3 -
Comments: He, Yi; Wang, Juanjuan; Zhu, Tongtong; Zheng, Zhaojing; Wei, Hao Nitrogen atom insertion into arenols to access benzazepines. Chemical science 15(7) (2024) 2612-2617
Space group: P 1 21/n 1
Cell volume: 1252.78
Cell parameters: 7.7369; 9.7927; 16.8291; 90; 100.727; 90;  

COD ID: 1570785
CIF file Formula: - C22 H27 Cu F15 P -
Comments: Sievers, Robin; Reimann, Marc; Kub, Nico G.; Rupf, Susanne M.; Kaupp, Martin; Malischewski, Moritz Synthesis and structural characterization of stable coinage metal (Cu, Ag, Au) cyclopentadienyl complexes. Chemical science 15(8) (2024) 2990-2995
Space group: P 1 21/n 1
Cell volume: 2638.06
Cell parameters: 9.2818; 14.7927; 19.3153; 90; 95.886; 90;  

COD ID: 1570786
CIF file Formula: - C22 H27 Ag F15 P -
Comments: Sievers, Robin; Reimann, Marc; Kub, Nico G.; Rupf, Susanne M.; Kaupp, Martin; Malischewski, Moritz Synthesis and structural characterization of stable coinage metal (Cu, Ag, Au) cyclopentadienyl complexes. Chemical science 15(8) (2024) 2990-2995
Space group: P -1
Cell volume: 1343.2
Cell parameters: 9.4791; 10.7301; 14.7059; 90.169; 90.23; 116.097;  

COD ID: 1570787
CIF file Formula: - C22 H27 Au F15 P -
Comments: Sievers, Robin; Reimann, Marc; Kub, Nico G.; Rupf, Susanne M.; Kaupp, Martin; Malischewski, Moritz Synthesis and structural characterization of stable coinage metal (Cu, Ag, Au) cyclopentadienyl complexes. Chemical science 15(8) (2024) 2990-2995
Space group: P -1
Cell volume: 2679.07
Cell parameters: 10.7338; 17.1617; 17.323; 112.222; 102.595; 104.552;  

COD ID: 1570788
CIF file Formula: - C39 H63 Nd -
Comments: Nodaraki, Lydia E.; Liu, Jingjing; Ariciu, Ana-Maria; Ortu, Fabrizio; Oakley, Meagan S.; Birnoschi, Letitia; Gransbury, Gemma K.; Cobb, Philip J.; Emerson-King, Jack; Chilton, Nicholas F.; Mills, David P.; McInnes, Eric J. L.; Tuna, Floriana Metal-carbon bonding in early lanthanide substituted cyclopentadienyl complexes probed by pulsed EPR spectroscopy. Chemical science 15(8) (2024) 3003-3010
Space group: P 1 21/n 1
Cell volume: 3630.28
Cell parameters: 10.7938; 19.4422; 17.8596; 90; 104.394; 90;  

COD ID: 1570789
CIF file Formula: - C39 H63 La -
Comments: Nodaraki, Lydia E.; Liu, Jingjing; Ariciu, Ana-Maria; Ortu, Fabrizio; Oakley, Meagan S.; Birnoschi, Letitia; Gransbury, Gemma K.; Cobb, Philip J.; Emerson-King, Jack; Chilton, Nicholas F.; Mills, David P.; McInnes, Eric J. L.; Tuna, Floriana Metal-carbon bonding in early lanthanide substituted cyclopentadienyl complexes probed by pulsed EPR spectroscopy. Chemical science 15(8) (2024) 3003-3010
Space group: P -1
Cell volume: 3662.9
Cell parameters: 10.7001; 18.4935; 19.7113; 83.299; 77.365; 74.64;  

COD ID: 1570790
CIF file Formula: - C136 H198 Mn4 N8 O9 P8 -
Comments: Thiyagarajan, Subramanian; Diskin-Posner, Yael; Montag, Michael; Milstein, David Manganese-catalyzed base-free addition of saturated nitriles to unsaturated nitriles by template catalysis. Chemical science 15(7) (2024) 2571-2577
Space group: P 1 21/c 1
Cell volume: 3354.94
Cell parameters: 10.4236; 17.9728; 17.9093; 90; 90.648; 90;  

COD ID: 1570791
CIF file Formula: - C34 H49 Mn N2 O2 P2 -
Comments: Thiyagarajan, Subramanian; Diskin-Posner, Yael; Montag, Michael; Milstein, David Manganese-catalyzed base-free addition of saturated nitriles to unsaturated nitriles by template catalysis. Chemical science 15(7) (2024) 2571-2577
Space group: P 1 21 1
Cell volume: 3380
Cell parameters: 9.5026; 16.911; 21.3649; 90; 100.11; 90;  

COD ID: 1570793
CIF file Formula: - C85 H94 B N5 -
Comments: Du, Mingxu; Mai, Minqiang; Zhang, Dongdong; Duan, Lian; Zhang, Yuewei Stereo effects for efficient synthesis of orange-red multiple resonance emitters centered on a pyridine ring. Chemical science 15(9) (2024) 3148-3154
Space group: P -1
Cell volume: 3812.69
Cell parameters: 13.9175; 14.8192; 19.2412; 89.702; 77.628; 79.792;  

COD ID: 1570794
CIF file Formula: - C36 H49 Ag N2 O -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: P 1 21/c 1
Cell volume: 3358.75
Cell parameters: 10.681; 13.7656; 22.8895; 90; 93.616; 90;  

COD ID: 1570795
CIF file Formula: - C33.5 H39 Ag N2 -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: P -1
Cell volume: 1498.5
Cell parameters: 10.1212; 11.216; 14.9017; 109.269; 90.061; 109.016;  

COD ID: 1570796
CIF file Formula: - C30 H37 Ag N2 -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: P b c a
Cell volume: 5259.2
Cell parameters: 15.7456; 16.8545; 19.8172; 90; 90; 90;  

COD ID: 1570797
CIF file Formula: - C22 H29 Ag N2 -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: P 1 21/n 1
Cell volume: 4135.5
Cell parameters: 17.3928; 14.3855; 17.9551; 90; 112.995; 90;  

COD ID: 1570798
CIF file Formula: - C33 H53 Ag N2 O4 Si -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: P 1 21/n 1
Cell volume: 3439.2
Cell parameters: 11.1099; 16.5691; 19.2966; 90; 104.487; 90;  

COD ID: 1570799
CIF file Formula: - C33 H51 Ag N2 O4 Si -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: P 1 21/n 1
Cell volume: 3434.31
Cell parameters: 11.1581; 16.6129; 19.1762; 90; 104.952; 90;  

COD ID: 1570800
CIF file Formula: - C27 H44 Ag N3 Si2 -
Comments: Hansen, Colin; Docherty, Scott R.; Cao, Weicheng; Yakimov, Alexander V.; Copéret, Christophe <sup>109</sup>Ag NMR chemical shift as a descriptor for Brønsted acidity from molecules to materials. Chemical science 15(8) (2024) 3028-3032
Space group: F d d 2
Cell volume: 12656
Cell parameters: 20.852; 44.031; 13.785; 90; 90; 90;  

COD ID: 1570801
CIF file Formula: - C26 H38 O6 -
Comments: Yan, Dexiu; Matsuda, Yudai Global genome mining-driven discovery of an unusual biosynthetic logic for fungal polyketide-terpenoid hybrids. Chemical science 15(8) (2024) 3011-3017
Space group: P 1
Cell volume: 1202
Cell parameters: 9.061; 11.978; 12.657; 107.62; 110.74; 93.69;  

COD ID: 1570802
CIF file Formula: - C18 H11 N O -
Comments: Jiang, Wenlin; Liu, Ming; Li, Yanxun; Lin, Francis R.; Jen, Alex K.-Y. Rational molecular design of multifunctional self-assembled monolayers for efficient hole selection and buried interface passivation in inverted perovskite solar cells. Chemical science 15(8) (2024) 2778-2785
Space group: C 1 2/c 1
Cell volume: 2423.6
Cell parameters: 21.6821; 5.327; 22.9919; 90; 114.126; 90;  

COD ID: 1570803
CIF file Formula: - C18 H11 N S -
Comments: Jiang, Wenlin; Liu, Ming; Li, Yanxun; Lin, Francis R.; Jen, Alex K.-Y. Rational molecular design of multifunctional self-assembled monolayers for efficient hole selection and buried interface passivation in inverted perovskite solar cells. Chemical science 15(8) (2024) 2778-2785
Space group: P n a 21
Cell volume: 2580.46
Cell parameters: 15.7172; 5.2891; 31.0413; 90; 90; 90;  

COD ID: 1570804
CIF file Formula: - C17 H11 N3 O3 -
Comments: Lv, Youming; Ye, Hebo; You, Lei Multiple control of azoquinoline based molecular photoswitches. Chemical science 15(9) (2024) 3290-3299
Space group: P 1 21 1
Cell volume: 671.12
Cell parameters: 3.9819; 14.7672; 11.4435; 90; 94.161; 90;  

COD ID: 1570805
CIF file Formula: - C18 H15 N3 O6 S -
Comments: Lv, Youming; Ye, Hebo; You, Lei Multiple control of azoquinoline based molecular photoswitches. Chemical science 15(9) (2024) 3290-3299
Space group: P -1
Cell volume: 852.44
Cell parameters: 9.1825; 9.2868; 10.5049; 91.395; 104.674; 99.577;  

COD ID: 1570806
CIF file Formula: - C34 H24 N6 O8 Zn -
Comments: Lv, Youming; Ye, Hebo; You, Lei Multiple control of azoquinoline based molecular photoswitches. Chemical science 15(9) (2024) 3290-3299
Space group: P -1
Cell volume: 1461.12
Cell parameters: 7.4257; 13.6826; 15.0095; 80.434; 78.161; 81.361;  

COD ID: 1570807
CIF file Formula: - C34 H22 Co N6 O7 -
Comments: Lv, Youming; Ye, Hebo; You, Lei Multiple control of azoquinoline based molecular photoswitches. Chemical science 15(9) (2024) 3290-3299
Space group: P -1
Cell volume: 1432.66
Cell parameters: 10.3354; 10.6777; 13.1615; 97.249; 95.452; 92.065;  

COD ID: 1570808
CIF file Formula: - C16 H11 N3 O2 -
Comments: Lv, Youming; Ye, Hebo; You, Lei Multiple control of azoquinoline based molecular photoswitches. Chemical science 15(9) (2024) 3290-3299
Space group: P 1 21/n 1
Cell volume: 1262.24
Cell parameters: 6.963; 12.2129; 15.0009; 90; 98.316; 90;  

COD ID: 1570812
CIF file Formula: - C4 H12 Br5 F26 N -
Comments: Möbs, Martin; Graubner, Tim; Karttunen, Antti J.; Kraus, Florian [Br<sub>4</sub>F<sub>21</sub>]<sup>-</sup> - a unique molecular tetrahedral interhalogen ion containing a μ<sub>4</sub>-bridging fluorine atom surrounded by BrF<sub>5</sub> molecules. Chemical science 15(9) (2024) 3273-3278
Space group: P 21 3
Cell volume: 2400.2
Cell parameters: 13.389; 13.389; 13.389; 90; 90; 90;  

COD ID: 1570813
CIF file Formula: - C50 H51 B F15 K N O4 -
Comments: Morales, Agustín; Gonçalves, Caroline; Sournia-Saquet, Alix; Vendier, Laure; Lledós, Agustí; Baslé, Olivier; Bontemps, Sébastien Single electron reduction of NHC-CO<sub>2</sub>-borane compounds. Chemical science 15(9) (2024) 3165-3173
Space group: I 1 2/a 1
Cell volume: 10606.9
Cell parameters: 23.8532; 21.0638; 21.3167; 90; 97.97; 90;  

COD ID: 1570814
CIF file Formula: - C42 H32 B F15 N2 O2 -
Comments: Morales, Agustín; Gonçalves, Caroline; Sournia-Saquet, Alix; Vendier, Laure; Lledós, Agustí; Baslé, Olivier; Bontemps, Sébastien Single electron reduction of NHC-CO<sub>2</sub>-borane compounds. Chemical science 15(9) (2024) 3165-3173
Space group: C 1 c 1
Cell volume: 3712.85
Cell parameters: 11.4874; 20.6397; 15.6705; 90; 92.13; 90;  

COD ID: 1570815
CIF file Formula: - C46 H36 B F15 N2 O2 -
Comments: Morales, Agustín; Gonçalves, Caroline; Sournia-Saquet, Alix; Vendier, Laure; Lledós, Agustí; Baslé, Olivier; Bontemps, Sébastien Single electron reduction of NHC-CO<sub>2</sub>-borane compounds. Chemical science 15(9) (2024) 3165-3173
Space group: P 1 21/n 1
Cell volume: 4223.62
Cell parameters: 12.0583; 16.6138; 21.2222; 90; 96.569; 90;  

COD ID: 1570816
CIF file Formula: - C43 H37 B Cl2 F15 N O2 -
Comments: Morales, Agustín; Gonçalves, Caroline; Sournia-Saquet, Alix; Vendier, Laure; Lledós, Agustí; Baslé, Olivier; Bontemps, Sébastien Single electron reduction of NHC-CO<sub>2</sub>-borane compounds. Chemical science 15(9) (2024) 3165-3173
Space group: C 1 2/c 1
Cell volume: 8207
Cell parameters: 32.364; 11.022; 23.039; 90; 93.043; 90;  

COD ID: 1570817
CIF file Formula: - C12 H36 Ga3 Ho -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: I 41/a :2
Cell volume: 8201.7
Cell parameters: 17.6111; 17.6111; 26.4443; 90; 90; 90;  

COD ID: 1570818
CIF file Formula: - C12 H36 Dy Ga3 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: C 1 2/c 1
Cell volume: 2084.8
Cell parameters: 10.8711; 15.7025; 12.4891; 90; 102.07; 90;  

COD ID: 1570819
CIF file Formula: - C35 H58 Al B Ho N7 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P -1
Cell volume: 2040.7
Cell parameters: 11.8446; 12.0811; 15.8693; 81.388; 80.802; 66.125;  

COD ID: 1570820
CIF file Formula: - C55 H91 B N9 O3 Y -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P 1 21 1
Cell volume: 2825.6
Cell parameters: 11.4785; 17.511; 14.619; 90; 105.928; 90;  

COD ID: 1570821
CIF file Formula: - C44 H69 B Ho N7 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P -1
Cell volume: 2252.1
Cell parameters: 10.767; 12.621; 17.188; 77.029; 81.681; 88.061;  

COD ID: 1570822
CIF file Formula: - C38.5 H62 Al0.86 B Dy Ga0.14 N7 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P 1 21/n 1
Cell volume: 4024.7
Cell parameters: 9.564; 23.328; 18.369; 90; 100.874; 90;  

COD ID: 1570823
CIF file Formula: - C46.5 H71 B Dy N9 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: C 1 2/c 1
Cell volume: 9452.8
Cell parameters: 41.94; 11.5627; 19.9969; 90; 102.894; 90;  

COD ID: 1570824
CIF file Formula: - C43 H68 Al B Ho N7 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: C 1 c 1
Cell volume: 4430.4
Cell parameters: 21.5531; 11.2886; 19.1515; 90; 108.049; 90;  

COD ID: 1570825
CIF file Formula: - C49.5 H76 B Dy N8 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P 1 21/n 1
Cell volume: 5033.5
Cell parameters: 12.1758; 17.8931; 23.26; 90; 96.643; 90;  

COD ID: 1570826
CIF file Formula: - C46.5 H71 B Ho N9 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: C 1 2/c 1
Cell volume: 9453.4
Cell parameters: 41.814; 11.5565; 20.0524; 90; 102.683; 90;  

COD ID: 1570827
CIF file Formula: - C44 H72 B2 Dy N7 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: C 1 2/c 1
Cell volume: 9384
Cell parameters: 42.723; 10.3005; 21.324; 90; 90.449; 90;  

COD ID: 1570828
CIF file Formula: - C48 H80 B Ho N8 O -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P -1
Cell volume: 4722.8
Cell parameters: 10.851; 20.269; 22.192; 96.949; 96.699; 100.067;  

COD ID: 1570829
CIF file Formula: - C37 H61 B Dy N7 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P 1 21/c 1
Cell volume: 3968.3
Cell parameters: 11.6084; 18.3503; 18.8307; 90; 98.396; 90;  

COD ID: 1570830
CIF file Formula: - C39.5 H67 B Ga Ho N6 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P -1
Cell volume: 2222.7
Cell parameters: 9.8291; 13.4472; 18.5931; 96.149; 100.699; 110.456;  

COD ID: 1570831
CIF file Formula: - C42 H69 B Dy N7 O1.5 -
Comments: Rieser, Theresa E.; Schädle, Dorothea; Maichle-Mössmer, Cäcilia; Anwander, Reiner Terminal dysprosium and holmium organoimides. Chemical science 15(10) (2024) 3562-3570
Space group: P n a 21
Cell volume: 8491.1
Cell parameters: 19.7303; 11.5097; 37.3911; 90; 90; 90;  

COD ID: 1570832
CIF file Formula: - C23 H46 O17 -
Comments: Arishi, Amr A.; Shang, Zhuo; Lacey, Ernest; Crombie, Andrew; Vuong, Daniel; Li, Hang; Bracegirdle, Joe; Turner, Peter; Lewis, William; Flematti, Gavin R.; Piggott, Andrew M.; Chooi, Yit-Heng Discovery and heterologous biosynthesis of glycosylated polyketide luteodienoside A reveals unprecedented glucinol-mediated product offloading by a fungal carnitine <i>O</i>-acyltransferase domain. Chemical science 15(9) (2024) 3349-3356
Space group: P 21 21 21
Cell volume: 2827.75
Cell parameters: 6.60006; 7.7434; 55.33; 90; 90; 90;  

COD ID: 1570834
CIF file Formula: - C6 H12 Cd Cl3 N3 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 2/c 1
Cell volume: 1089.65
Cell parameters: 7.6542; 8.5911; 16.6247; 90; 94.622; 90;  

COD ID: 1570835
CIF file Formula: - C6 H12 Br3 Cd N3 O0 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 2/c 1
Cell volume: 1169.6
Cell parameters: 7.9948; 8.6736; 16.9504; 90; 95.696; 90;  

COD ID: 1570836
CIF file Formula: - C6 H11 Cd Cl2 N3 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 21/m 1
Cell volume: 489.81
Cell parameters: 7.1135; 7.7569; 8.8801; 90; 91.575; 90;  

COD ID: 1570837
CIF file Formula: - C6 H11 Br2 Cd N3 O0 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 21/c 1
Cell volume: 1026.47
Cell parameters: 9.0513; 8.0055; 14.166; 90; 90.092; 90;  

COD ID: 1570838
CIF file Formula: - C6 H11 Br2 Cd N3 O0 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 21/m 1
Cell volume: 525.72
Cell parameters: 7.2184; 8.1651; 8.9205; 90; 90.782; 90;  

COD ID: 1570839
CIF file Formula: - C6 H11 Cd Cl2 N3 O0 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 21/c 1
Cell volume: 959.6
Cell parameters: 8.9307; 7.6716; 14.0159; 90; 92.145; 90;  

COD ID: 1570844
CIF file Formula: - C25 H41 N2 O -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: P -1
Cell volume: 2342
Cell parameters: 9.3426; 13.6019; 19.5752; 75.524; 76.84; 89.604;  

COD ID: 1570845
CIF file Formula: - C38 H50 N2 -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: P -1
Cell volume: 1573.84
Cell parameters: 9.9626; 12.7843; 13.6552; 69.243; 75.674; 87.52;  

COD ID: 1570846
CIF file Formula: - C29 H45 N3 -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: P 1 21/c 1
Cell volume: 2687.1
Cell parameters: 10.4427; 24.913; 11.5295; 90; 116.382; 90;  

COD ID: 1570847
CIF file Formula: - C47 H65 N3 -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: P 1 21/c 1
Cell volume: 3940.6
Cell parameters: 10.1396; 20.3171; 19.4251; 90; 100.025; 90;  

COD ID: 1570848
CIF file Formula: - C46 H63 N3 -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: P 1 21/c 1
Cell volume: 3930
Cell parameters: 20.277; 10.5458; 18.401; 90; 92.839; 90;  

COD ID: 1570849
CIF file Formula: - C36 H50 N2 Se -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: P 1 21/c 1
Cell volume: 3252.4
Cell parameters: 15.926; 15.8347; 14.355; 90; 116.049; 90;  

COD ID: 1570850
CIF file Formula: - C24 H32 N2 Se -
Comments: Vermersch, François; Wang, Victor T.; Abdellaoui, Mehdi; Jazzar, Rodolphe; Bertrand, Guy Ambiphilicity of ring-expanded N-heterocyclic carbenes. Chemical science 15(10) (2024) 3707-3710
Space group: C 1 2/c 1
Cell volume: 4344.5
Cell parameters: 19.8071; 13.3759; 17.5615; 90; 110.97; 90;  

COD ID: 1570851
CIF file Formula: - C93 H124 Lu2 N6 -
Comments: Jiang, Wen; Rajeshkumar, Thayalan; Guo, Mengyue; Lin, Yuejian; Maron, Laurent; Zhang, Lixin Rare-earth metal ethylene and ethyne complexes. Chemical science 15(10) (2024) 3495-3501
Space group: P -1
Cell volume: 4417
Cell parameters: 10.8568; 19.2449; 21.6617; 87.096; 78.386; 85.535;  

COD ID: 1570852
CIF file Formula: - C102 H153 Al4 N10 Y2 -
Comments: Jiang, Wen; Rajeshkumar, Thayalan; Guo, Mengyue; Lin, Yuejian; Maron, Laurent; Zhang, Lixin Rare-earth metal ethylene and ethyne complexes. Chemical science 15(10) (2024) 3495-3501
Space group: P 1 21 1
Cell volume: 5136.2
Cell parameters: 21.3577; 11.1948; 21.482; 90; 90.068; 90;  

COD ID: 1570853
CIF file Formula: - C92 H128 Al2 N6 Y2 -
Comments: Jiang, Wen; Rajeshkumar, Thayalan; Guo, Mengyue; Lin, Yuejian; Maron, Laurent; Zhang, Lixin Rare-earth metal ethylene and ethyne complexes. Chemical science 15(10) (2024) 3495-3501
Space group: P -1
Cell volume: 4240.7
Cell parameters: 13.5651; 18.5143; 19.5102; 63.387; 78.245; 77.166;  

COD ID: 1570854
CIF file Formula: - C49 H66 Al N3 Y -
Comments: Jiang, Wen; Rajeshkumar, Thayalan; Guo, Mengyue; Lin, Yuejian; Maron, Laurent; Zhang, Lixin Rare-earth metal ethylene and ethyne complexes. Chemical science 15(10) (2024) 3495-3501
Space group: P 1 21/c 1
Cell volume: 4679.4
Cell parameters: 11.4571; 19.681; 21.041; 90; 99.503; 90;  

COD ID: 1570855
CIF file Formula: - C49 H73 Al Lu N3 -
Comments: Jiang, Wen; Rajeshkumar, Thayalan; Guo, Mengyue; Lin, Yuejian; Maron, Laurent; Zhang, Lixin Rare-earth metal ethylene and ethyne complexes. Chemical science 15(10) (2024) 3495-3501
Space group: P 1 21/c 1
Cell volume: 4662
Cell parameters: 11.4749; 19.6122; 20.979; 90; 99.088; 90;  

COD ID: 1570856
CIF file Formula: - C110 H176 Al4 N6 Y2 -
Comments: Jiang, Wen; Rajeshkumar, Thayalan; Guo, Mengyue; Lin, Yuejian; Maron, Laurent; Zhang, Lixin Rare-earth metal ethylene and ethyne complexes. Chemical science 15(10) (2024) 3495-3501
Space group: P 1 21/c 1
Cell volume: 10725
Cell parameters: 21.5841; 30.8815; 16.132; 90; 94.119; 90;  

COD ID: 1570859
CIF file Formula: - C48 H57 Au3 N6 O3 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P 1 21/c 1
Cell volume: 4686.75
Cell parameters: 20.0056; 29.2892; 8.03827; 90; 95.696; 90;  

COD ID: 1570860
CIF file Formula: - C49.25 H59.5 Au3 Cl2.5 N6 O3 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P -1
Cell volume: 2569.7
Cell parameters: 8.3005; 17.0876; 19.6636; 68.3; 87.8; 82.613;  

COD ID: 1570861
CIF file Formula: - C109 H140 Au6 Cl8 N18 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P -1
Cell volume: 6130.61
Cell parameters: 15.634; 17.1978; 25.4548; 94.8137; 107.046; 107.447;  

COD ID: 1570862
CIF file Formula: - C132.75 H163.5 Au6 Cl25.5 N18 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P -1
Cell volume: 9035.4
Cell parameters: 20.8869; 21.3091; 21.4286; 96.246; 97.033; 105.196;  

COD ID: 1570863
CIF file Formula: - C241.5 H301.5 Au12 Cl51 N40 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P -1
Cell volume: 16466.2
Cell parameters: 27.6564; 27.7466; 28.2657; 112.451; 94.9615; 119.208;  

COD ID: 1570864
CIF file Formula: - C280 H276 Au12 Cl12 D4 N40 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P -1
Cell volume: 13975.5
Cell parameters: 22.1659; 24.2178; 26.9851; 91.9058; 104.092; 94.9457;  

COD ID: 1570865
CIF file Formula: - C312 H298 Au12 Cl52 N40 -
Comments: Eren, Noga; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay Molecular imine cages with π-basic Au<sub>3</sub>(pyrazolate) faces. Chemical science 15(10) (2024) 3539-3544
Space group: P -1
Cell volume: 17227.7
Cell parameters: 27.2311; 27.3567; 27.4198; 62.4166; 79.9283; 72.2345;  

COD ID: 1570866
CIF file Formula: - C27 H60 Cl6 N2 O12 Sb -
Comments: Han, Xiao; Cheng, Puxin; Han, Shanshan; Wang, Zhihua; Guan, Junjie; Han, Wenqing; Shi, Rongchao; Chen, Songhua; Zheng, Yongshen; Xu, Jialiang; Bu, Xian-He Multi-stimuli-responsive luminescence enabled by crown ether anchored chiral antimony halide phosphors. Chemical science 15(10) (2024) 3530-3538
Space group: P 43 21 2
Cell volume: 3993.5
Cell parameters: 10.1199; 10.1199; 38.9943; 90; 90; 90;  

COD ID: 1570867
CIF file Formula: - C27 H60 Cl6 N2 O12 Sb -
Comments: Han, Xiao; Cheng, Puxin; Han, Shanshan; Wang, Zhihua; Guan, Junjie; Han, Wenqing; Shi, Rongchao; Chen, Songhua; Zheng, Yongshen; Xu, Jialiang; Bu, Xian-He Multi-stimuli-responsive luminescence enabled by crown ether anchored chiral antimony halide phosphors. Chemical science 15(10) (2024) 3530-3538
Space group: P 1 21/m 1
Cell volume: 2028.37
Cell parameters: 10.3335; 14.7221; 13.4584; 90; 97.826; 90;  

COD ID: 1570868
CIF file Formula: - C6 H24 Cl7 N4 Sb -
Comments: Han, Xiao; Cheng, Puxin; Han, Shanshan; Wang, Zhihua; Guan, Junjie; Han, Wenqing; Shi, Rongchao; Chen, Songhua; Zheng, Yongshen; Xu, Jialiang; Bu, Xian-He Multi-stimuli-responsive luminescence enabled by crown ether anchored chiral antimony halide phosphors. Chemical science 15(10) (2024) 3530-3538
Space group: P 21 21 21
Cell volume: 1874.61
Cell parameters: 9.1622; 10.5718; 19.3536; 90; 90; 90;  

COD ID: 1570869
CIF file Formula: - C27 H60 Cl6 N2 O12 Sb -
Comments: Han, Xiao; Cheng, Puxin; Han, Shanshan; Wang, Zhihua; Guan, Junjie; Han, Wenqing; Shi, Rongchao; Chen, Songhua; Zheng, Yongshen; Xu, Jialiang; Bu, Xian-He Multi-stimuli-responsive luminescence enabled by crown ether anchored chiral antimony halide phosphors. Chemical science 15(10) (2024) 3530-3538
Space group: P 41 21 2
Cell volume: 3988.87
Cell parameters: 10.11536; 10.11536; 38.9841; 90; 90; 90;  

COD ID: 1570870
CIF file Formula: - C29 H34 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P 1 21/c 1
Cell volume: 2413.3
Cell parameters: 9.2535; 14.9; 17.885; 90; 101.861; 90;  

COD ID: 1570871
CIF file Formula: - C54 H53 Br O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P -1
Cell volume: 2156.01
Cell parameters: 12.8327; 13.0654; 15.244; 94.104; 114.041; 108.338;  

COD ID: 1570872
CIF file Formula: - C33 H36 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P 1 21/c 1
Cell volume: 2657.1
Cell parameters: 7.2553; 20.45; 18.243; 90; 100.989; 90;  

COD ID: 1570873
CIF file Formula: - C35 H38 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P 1 21/n 1
Cell volume: 2802.8
Cell parameters: 8.6293; 12.4614; 26.146; 90; 94.519; 90;  

COD ID: 1570874
CIF file Formula: - C52 H48 Cl2 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P -1
Cell volume: 2101.6
Cell parameters: 12.819; 13.093; 14.822; 93.696; 114.031; 108.413;  

COD ID: 1570875
CIF file Formula: - C53 H51 I O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P -1
Cell volume: 2136.32
Cell parameters: 12.8029; 13.1018; 15.0559; 93.947; 113.886; 108.27;  

COD ID: 1570876
CIF file Formula: - C51 H46 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P -1
Cell volume: 3878.46
Cell parameters: 11.3897; 18.137; 19.2706; 83.875; 81.204; 81.729;  

COD ID: 1570877
CIF file Formula: - C53 H49 Cl3 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P 1 21/n 1
Cell volume: 4455
Cell parameters: 18.7443; 10.4995; 24.1927; 90; 110.663; 90;  

COD ID: 1570878
CIF file Formula: - C37 H38 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P b c a
Cell volume: 5837.5
Cell parameters: 13.254; 11.559; 38.103; 90; 90; 90;  

COD ID: 1570879
CIF file Formula: - C52 H48 Br2 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P -1
Cell volume: 2113
Cell parameters: 12.795; 13.079; 14.955; 93.844; 114.095; 108.298;  

COD ID: 1570880
CIF file Formula: - C51 H46 O -
Comments: Liao, Qiuyan; Li, Aisen; Huang, Arui; Wang, Jiaqiang; Chang, Kai; Li, Hehua; Yao, Pengfei; Zhong, Cheng; Xie, Peidong; Wang, Jinfeng; Li, Zhen; Li, Qianqian Controllable π-π coupling of intramolecular dimer models in aggregated states. Chemical science 15(12) (2024) 4364-4373
Space group: P -1
Cell volume: 3885.01
Cell parameters: 11.3923; 18.1449; 19.2809; 83.916; 81.263; 81.85;  


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