Crystallography Open Database
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COD ID  |
Links | Formula  |
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Cell parameters | Cell volume |
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|---|---|---|---|---|---|---|
| 1573721 | CIF | C58 H52 Co F24 N6 O P4 Re2 | P n n a | 22.3235; 15.8553; 17.5716 90; 90; 90 | 6219.39 | Csucker, Joshua; Grundmann, Nora Sophie; Blacque, Olivier; Spingler, Bernhard; Alberto, Roger The role of [Re(η6-arene)2]+ substituents in electro- and photocatalytic water reduction with [Co(terpy)2]3+ catalysts Catalysis Science & Technology, 2025, 15, 1627-1633 |
| 1573722 | CIF | C46 H38 Co F18 N10 P3 | C 1 2/c 1 | 14.7621; 16.5626; 20.9736 90; 101.077; 90 | 5032.48 | Csucker, Joshua; Grundmann, Nora Sophie; Blacque, Olivier; Spingler, Bernhard; Alberto, Roger The role of [Re(η6-arene)2]+ substituents in electro- and photocatalytic water reduction with [Co(terpy)2]3+ catalysts Catalysis Science & Technology, 2025, 15, 1627-1633 |
| 1573723 | CIF | C54 H44 Co F30 N8 P5 Re2 | P 1 21/n 1 | 12.1888; 21.4924; 24.0881 90; 104.142; 90 | 6119 | Csucker, Joshua; Grundmann, Nora Sophie; Blacque, Olivier; Spingler, Bernhard; Alberto, Roger The role of [Re(η6-arene)2]+ substituents in electro- and photocatalytic water reduction with [Co(terpy)2]3+ catalysts Catalysis Science & Technology, 2025, 15, 1627-1633 |
| 1573724 | CIF | C54 H44 Co F24 N8 P4 Re2 | P 1 21/c 1 | 9.24728; 27.2919; 24.3585 90; 95.1273; 90 | 6122.9 | Csucker, Joshua; Grundmann, Nora Sophie; Blacque, Olivier; Spingler, Bernhard; Alberto, Roger The role of [Re(η6-arene)2]+ substituents in electro- and photocatalytic water reduction with [Co(terpy)2]3+ catalysts Catalysis Science & Technology, 2025, 15, 1627-1633 |
| 1573983 | CIF | C20 H24 Br N O2 | P 1 21 1 | 10.495; 15.3001; 11.7177 90; 97.033; 90 | 1867.4 | Masukawa, Kazuki; Kojima, Amu; Sato, Takuma; Terada, Masahiro; Nakamura, Itaru Cu-catalyzed [1,3]-asymmetric methoxy rearrangement of N-methoxyanilines: mechanistic insight Catalysis Science & Technology, 2025, 15, 2138-2142 |
| 1574058 | CIF | C33 H34 Cr O4 P2 | P c a 21 | 20.1424; 10.949; 13.4777 90; 90; 90 | 2972.36 | Zhao, Xing; Xie, Haojie; Zuo, Jing; Wang, Jihe; Zhao, Mei-Xin; Zhang, Jun PCCP ligands with a semi-rigid backbone for chromium-catalyzed selective ethylene tri-/tetramerization Catalysis Science & Technology, 2025, 15, 2713-2721 |
| 1574059 | CIF | C33 H28 Cr O4 P2 | P 1 21 1 | 11.6589; 9.9032; 14.3096 90; 112.88; 90 | 1522.2 | Zhao, Xing; Xie, Haojie; Zuo, Jing; Wang, Jihe; Zhao, Mei-Xin; Zhang, Jun PCCP ligands with a semi-rigid backbone for chromium-catalyzed selective ethylene tri-/tetramerization Catalysis Science & Technology, 2025, 15, 2713-2721 |
| 1574072 | CIF | C44.22 H41 Cl1.78 F2 N2 Pd | C 1 c 1 | 21.5561; 9.39102; 19.5924 90; 106.024; 90 | 3812.06 | Wang, Yan; Dai, Shengyu Exploring the o-aryl halogen effects of α-diimine Pd(ii) catalysts on ethylene (co)polymerization Catalysis Science & Technology, 2025, 15, 2822-2828 |
| 1574128 | CIF | C17 H31 Cl2 N Si Ti | P -1 | 6.6617; 17.3131; 28.1245 93.203; 92.284; 95.465 | 3220.61 | Kawatsu, Minaho; Fujioka, Taiga; Losio, Simona; Tritto, Incoronata; Nomura, Kotohiro (Trialkylsilyl-cyclopentadienyl)titanium(iv) dichloride complexes containing ketimide ligands, Cp′TiCl2(NCtBu2) (Cp′ = Me3SiC5H4, Et3SiC5H4), as efficient catalysts for ethylene copolymerisation with norbornene and tetracyclododecene Catalysis Science & Technology, 2025, 15, 2757-2765 |
| 1574129 | CIF | C20 H37 Cl2 N Si Ti | P 21 21 21 | 12.2674; 13.776; 14.0063 90; 90; 90 | 2367 | Kawatsu, Minaho; Fujioka, Taiga; Losio, Simona; Tritto, Incoronata; Nomura, Kotohiro (Trialkylsilyl-cyclopentadienyl)titanium(iv) dichloride complexes containing ketimide ligands, Cp′TiCl2(NCtBu2) (Cp′ = Me3SiC5H4, Et3SiC5H4), as efficient catalysts for ethylene copolymerisation with norbornene and tetracyclododecene Catalysis Science & Technology, 2025, 15, 2757-2765 |
| 1574234 | CIF | C16 H14 N4 O | P 21 21 21 | 7.0728; 12.2024; 16.3422 90; 90; 90 | 1410.42 | R., Nandini; Kempegowda, Byresh B.; Srinivasa, Sudhanva M.; Kshirsagar, Umesh A.; Malecki, Jan Grzegorz; Patil, Siddappa A.; Shaikh, Shoyebmohamad F.; Mane, Manoj V.; Dateer, Ramesh B. Sustainable copper nanocomposite for multicomponent synthesis of triazolo quinolines and triazolyl benzamide derivatives and their bioactivity study Catalysis Science & Technology, 2025, 15, 2878-2887 |
| 1574235 | CIF | C15 H11 Cl N4 O | P 21 21 21 | 7.0038; 12.3433; 16.3586 90; 90; 90 | 1414.2 | R., Nandini; Kempegowda, Byresh B.; Srinivasa, Sudhanva M.; Kshirsagar, Umesh A.; Malecki, Jan Grzegorz; Patil, Siddappa A.; Shaikh, Shoyebmohamad F.; Mane, Manoj V.; Dateer, Ramesh B. Sustainable copper nanocomposite for multicomponent synthesis of triazolo quinolines and triazolyl benzamide derivatives and their bioactivity study Catalysis Science & Technology, 2025, 15, 2878-2887 |
| 1574236 | CIF | C22 H18 N4 O2 | P -1 | 8.7311; 9.24; 12.135 98.305; 97.293; 105.502 | 919.31 | R., Nandini; Kempegowda, Byresh B.; Srinivasa, Sudhanva M.; Kshirsagar, Umesh A.; Malecki, Jan Grzegorz; Patil, Siddappa A.; Shaikh, Shoyebmohamad F.; Mane, Manoj V.; Dateer, Ramesh B. Sustainable copper nanocomposite for multicomponent synthesis of triazolo quinolines and triazolyl benzamide derivatives and their bioactivity study Catalysis Science & Technology, 2025, 15, 2878-2887 |
| 1574237 | CIF | C21 H15 F N4 O | P -1 | 7.6099; 9.9948; 12.3384 101.58; 91.165; 107.833 | 871.8 | R., Nandini; Kempegowda, Byresh B.; Srinivasa, Sudhanva M.; Kshirsagar, Umesh A.; Malecki, Jan Grzegorz; Patil, Siddappa A.; Shaikh, Shoyebmohamad F.; Mane, Manoj V.; Dateer, Ramesh B. Sustainable copper nanocomposite for multicomponent synthesis of triazolo quinolines and triazolyl benzamide derivatives and their bioactivity study Catalysis Science & Technology, 2025, 15, 2878-2887 |
| 1574238 | CIF | C22 H18 N4 O | P -1 | 7.5949; 9.8677; 12.6331 80.581; 89.927; 73.743 | 895.67 | R., Nandini; Kempegowda, Byresh B.; Srinivasa, Sudhanva M.; Kshirsagar, Umesh A.; Malecki, Jan Grzegorz; Patil, Siddappa A.; Shaikh, Shoyebmohamad F.; Mane, Manoj V.; Dateer, Ramesh B. Sustainable copper nanocomposite for multicomponent synthesis of triazolo quinolines and triazolyl benzamide derivatives and their bioactivity study Catalysis Science & Technology, 2025, 15, 2878-2887 |
| 1574355 | CIF | C56 H49 Cl N6 P2 Ru | P 1 21/c 1 | 12.8637; 24.5322; 18.1868 90; 109.991; 90 | 5393.5 | Nath, Shambhu; Singh, Amrendra K. Substrate-assisted product release in hydrogenation of LOHCs facilitated by hemilabile pyridine in Ru(ii)–NNC pincer complexes and enhanced activity of proton-responsive protic-NHC ligands Catalysis Science & Technology, 2025, 15, 2999-3008 |
| 1574356 | CIF | C56 H50 N6 O P2 Ru | P -1 | 13.4509; 14.0264; 14.305 102.178; 107.581; 95.342 | 2479.06 | Nath, Shambhu; Singh, Amrendra K. Substrate-assisted product release in hydrogenation of LOHCs facilitated by hemilabile pyridine in Ru(ii)–NNC pincer complexes and enhanced activity of proton-responsive protic-NHC ligands Catalysis Science & Technology, 2025, 15, 2999-3008 |
| 1574394 | CIF | C14 H13 N O2 | P 1 21/c 1 | 6.6579; 22.13; 7.8468 90; 101.462; 90 | 1133.08 | Paramanik, Krishnendu; Bandopadhyay, Nilaj; Agrawalla, Suraj Kumar; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar Highly efficient phenalenyl–copper bifunctional photoredox catalyst for direct C–H bond arylation of arenes and heteroarenes Catalysis Science & Technology, 2025, 15, 3325-3331 |
| 1574395 | CIF | C16 H22 N2 O | P -1 | 6.6423; 13.8452; 16.6714 79.252; 85.493; 83.62 | 1494.31 | Paramanik, Krishnendu; Bandopadhyay, Nilaj; Agrawalla, Suraj Kumar; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar Highly efficient phenalenyl–copper bifunctional photoredox catalyst for direct C–H bond arylation of arenes and heteroarenes Catalysis Science & Technology, 2025, 15, 3325-3331 |
| 1574396 | CIF | C29 H22.33333 Cl Cu N2 O3.66667 | P -1 | 11.9198; 13.4831; 22.5889 84.99; 84.584; 82.389 | 3572.03 | Paramanik, Krishnendu; Bandopadhyay, Nilaj; Agrawalla, Suraj Kumar; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar Highly efficient phenalenyl–copper bifunctional photoredox catalyst for direct C–H bond arylation of arenes and heteroarenes Catalysis Science & Technology, 2025, 15, 3325-3331 |
| 1574636 | CIF | C27 H26 Br Cl Co N7 O5 | P -1 | 9.1862; 12.1495; 14.5113 111.807; 96.893; 100.568 | 1446.42 | Kukreti, Prashant; Chauhan, Rahul; Ghosh, Kaushik A passage from pincer complexes to rationally designed phosphine-free Co(iii) catalysts supported by a pentadentate ligand for activation of alcohols: studies on sp3 C–H alkylation of 9H-fluorene and quinoline synthesis Catalysis Science & Technology, 2025, 15, 3816-3826 |
| 1574637 | CIF | C50 H46 Cl4 Co2 N12 O10 | P -1 | 8.6873; 16.7926; 18.9662 85.258; 76.904; 86.461 | 2683 | Kukreti, Prashant; Chauhan, Rahul; Ghosh, Kaushik A passage from pincer complexes to rationally designed phosphine-free Co(iii) catalysts supported by a pentadentate ligand for activation of alcohols: studies on sp3 C–H alkylation of 9H-fluorene and quinoline synthesis Catalysis Science & Technology, 2025, 15, 3816-3826 |
| 1574743 | CIF | C18 H29 B F4 N3 Rh | C 1 2 1 | 20.6843; 8.2612; 15.1611 90; 117.168; 90 | 2304.9 | Böth, André; Kaltwasser, Florian; Priedigkeit, Christian; Atwi, Boshra; Frey, Wolfgang; Buchmeiser, Michael R.; Tallarek, Ulrich Influence of the supported ionic-liquid layer thickness on Z-selectivity in 1-alkyne hydrosilylation under continuous flow Catalysis Science & Technology, 2025, 15, 4012-4023 |
| 1574744 | CIF | C26 H31 B Cl2 F4 N3 Rh | P -1 | 9.756; 11.147; 13.527 75.446; 83.737; 73.626 | 1365 | Böth, André; Kaltwasser, Florian; Priedigkeit, Christian; Atwi, Boshra; Frey, Wolfgang; Buchmeiser, Michael R.; Tallarek, Ulrich Influence of the supported ionic-liquid layer thickness on Z-selectivity in 1-alkyne hydrosilylation under continuous flow Catalysis Science & Technology, 2025, 15, 4012-4023 |
| 1574994 | CIF | C19 H18 Cl2 N2 O2 S | P b c n | 28.9107; 14.6104; 9.1891 90; 90; 90 | 3881.4 | Vijay, Ragupathi; Yogesh, Dasari; Shanmugam, Ramasamy; Lingaiah, Nakka; Ponpandian, Thanasekaran; Gunasekar, Gunniya Hariyanandam A metal-free porous organic polymer-based heterogeneous catalyst for the borrowing hydrogen-mediated N-alkylation of sulfonamides with alcohols Catalysis Science & Technology, 2025, 15, 4684-4691 |
| 1575106 | CIF | C25 H37 N3 O4 S | P 1 21 1 | 7.608; 14.414; 11.847 90; 102.228; 90 | 1269.7 | Yang, Zhongzhen; Li, Li; Chen, Jian; Hou, Jinyu; Fan, Hongying; Zhang, Xue; Lv, Guanghui; Wu, Yong Cost-effective chiral auxiliary-assisted remote asymmetric C(sp3)–H alkylation of hydroxamic acid derivatives with glycine derivatives Catalysis Science & Technology, 2025, 15, 4866-4871 |
| 1575233 | CIF | C50 H40 Cl2 N4 Ni2 O2 P2 | P 1 21/n 1 | 15.2233; 11.5814; 25.9382 90; 99.271; 90 | 4513.4 | Sabharwal, Gazal; Dwivedi, Khilesh C.; Balakrishna, Maravanji S. Multifunctional PNN-NiII pincer catalyst for C–C and C–N bond formation via alkylation, cross-coupling, and hydroamination reactions Catalysis Science & Technology, 2025, 15, 5275-5284 |
| 1575234 | CIF | C28 H26 Cl5 N2 Ni O2 P | P -1 | 10.5132; 10.9249; 14.5672 107.373; 107.332; 95.323 | 1493.66 | Sabharwal, Gazal; Dwivedi, Khilesh C.; Balakrishna, Maravanji S. Multifunctional PNN-NiII pincer catalyst for C–C and C–N bond formation via alkylation, cross-coupling, and hydroamination reactions Catalysis Science & Technology, 2025, 15, 5275-5284 |
| 1575235 | CIF | C25 H21 N2 O2 P | P 21 21 21 | 9.2533; 14.3859; 15.5532 90; 90; 90 | 2070.4 | Sabharwal, Gazal; Dwivedi, Khilesh C.; Balakrishna, Maravanji S. Multifunctional PNN-NiII pincer catalyst for C–C and C–N bond formation via alkylation, cross-coupling, and hydroamination reactions Catalysis Science & Technology, 2025, 15, 5275-5284 |
| 1575277 | CIF | C70 H66 N6 O16 Zn2 | P -1 | 11.013; 15.456; 18.53 86.382; 89.951; 79.749 | 3097.4 | Chanda, Alokananda; Mandal, Sanjay K. Synthesis of metal–organic rectangles decorated with primary amide groups for the synergistic Lewis acid and Brønsted base heterogeneous catalysis Catalysis Science & Technology, 2025, 15, 6379-6390 |
| 1575278 | CIF | C70 H66 Cd2 N6 O14 | P -1 | 11.0764; 15.4916; 18.8224 86.924; 89.289; 80.435 | 3180.2 | Chanda, Alokananda; Mandal, Sanjay K. Synthesis of metal–organic rectangles decorated with primary amide groups for the synergistic Lewis acid and Brønsted base heterogeneous catalysis Catalysis Science & Technology, 2025, 15, 6379-6390 |
| 1575307 | CIF | C30 H28 Cu N10 O8 | P 1 21/c 1 | 13.043; 12.8084; 9.2763 90; 103.57; 90 | 1506.44 | Shekhawat, Bhawana; Ahamed, Subuhan; Gahlaut, Puneet Singh; Ghosh, Saurav; Gautam, Deepak; Mondal, Kartik Chandra; Jana, Barun Developing highly active Cu(ii)-triazolyl-pyridine complexes for C–H functionalization of 9H-fluorene and indole via a borrowing hydrogen strategy Catalysis Science & Technology, 2025, 15, 6001-6010 |
| 1575346 | CIF | C24 H18 F2 N2 O | P 1 21/n 1 | 9.7905; 10.0718; 19.157 90; 101.244; 90 | 1852.77 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575347 | CIF | C20 H18 N2 | P -1 | 11.1239; 12.7204; 13.2024 63.376; 66.687; 81.235 | 1533 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575348 | CIF | C107 H99 Cl21 N12 | P 1 21 1 | 14.4049; 18.5983; 20.5244 90; 101.301; 90 | 5392.01 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575349 | CIF | C26 H24 N2 O3 | P 1 21/n 1 | 11.5413; 10.3509; 17.336 90; 90.988; 90 | 2070.7 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575350 | CIF | C27 H23 Br2 N7 Zn | P 1 21/n 1 | 13.4176; 10.0308; 20.418 90; 90.608; 90 | 2747.9 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575351 | CIF | C27 H23 Cl2 N7 Zn | P 1 21/n 1 | 12.9508; 12.6674; 15.626 90; 92.365; 90 | 2561.31 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575352 | CIF | C35 H27 Cl2 N7 Zn | C 1 2/c 1 | 20.8911; 16.258; 23.8268 90; 115.63; 90 | 7296.4 | Chauhan, Rahul; Kukreti, Prashant; Sharma, Keshav; Singh, Ovender; Ghosh, Kaushik Well-defined zinc(ii) catalysts for sustainable synthesis of bis(indolyl)methanes via the activation of aromatic and aliphatic alcohols Catalysis Science & Technology, 2025, 15, 6693-6702 |
| 1575447 | CIF | C29 H30 N2 O2 | P 1 21/n 1 | 11.9352; 9.6405; 22.561 90; 102.676; 90 | 2532.6 | Mohite, Manali A.; Balakrishna, Maravanji S. Efficient C(sp3)–H alkylation of fluorene and bisindolylmethane synthesis catalysed by a PNN-Ni complex using alcohols Catalysis Science & Technology, 2025, 15, 5713-5723 |
| 1575448 | CIF | C26 H19 N O2 | P -1 | 9.162; 9.3673; 12.3869 82.918; 72.624; 69.889 | 952.46 | Mohite, Manali A.; Balakrishna, Maravanji S. Efficient C(sp3)–H alkylation of fluorene and bisindolylmethane synthesis catalysed by a PNN-Ni complex using alcohols Catalysis Science & Technology, 2025, 15, 5713-5723 |
| 1575449 | CIF | C27 H20 Br2 | P -1 | 8.9193; 10.1578; 13.6811 69.54; 87.768; 68.277 | 1073 | Mohite, Manali A.; Balakrishna, Maravanji S. Efficient C(sp3)–H alkylation of fluorene and bisindolylmethane synthesis catalysed by a PNN-Ni complex using alcohols Catalysis Science & Technology, 2025, 15, 5713-5723 |
| 1575450 | CIF | C26 H17 Br2 N O2 | P 1 21/n 1 | 10.1389; 11.2656; 18.8705 90; 91.136; 90 | 2155 | Mohite, Manali A.; Balakrishna, Maravanji S. Efficient C(sp3)–H alkylation of fluorene and bisindolylmethane synthesis catalysed by a PNN-Ni complex using alcohols Catalysis Science & Technology, 2025, 15, 5713-5723 |
| 1575589 | CIF | C25 H30 Al Cl4 Li N2 O7 | P -1 | 14.0391; 14.1908; 16.3182 75.8345; 72.468; 71.7946 | 2903.83 | Piyawongsiri, Thitirat; Gaston, Anand J.; Abdul Rahman, Maisarah; Hughes, Jack W. J.; Rudman, George E.; Lowy, Phoebe A.; Nichol, Gary S.; Morrison, Carole A.; Phomphrai, Khamphee; Garden, Jennifer A. Heterometallic Li/Zn, Li/Al and Li/In catalysts for <i>rac</i>-lactide ring-opening polymerisation: "ate" or "non-ate" pathways? Catalysis science & technology, 2025, 15, 6113-6121 |
| 1575590 | CIF | C50.44 H56.88 Cl10.88 Li2 N4 O12 Zn2 | P 1 21/c 1 | 15.915; 24.9116; 16.1264 90; 99.907; 90 | 6298.3 | Piyawongsiri, Thitirat; Gaston, Anand J.; Abdul Rahman, Maisarah; Hughes, Jack W. J.; Rudman, George E.; Lowy, Phoebe A.; Nichol, Gary S.; Morrison, Carole A.; Phomphrai, Khamphee; Garden, Jennifer A. Heterometallic Li/Zn, Li/Al and Li/In catalysts for <i>rac</i>-lactide ring-opening polymerisation: "ate" or "non-ate" pathways? Catalysis science & technology, 2025, 15, 6113-6121 |
| 1575591 | CIF | C97 H106 Cl10 Li8 N8 O24 | P 1 21/n 1 | 22.8774; 19.3305; 26.1585 90; 115.824; 90 | 10412.9 | Piyawongsiri, Thitirat; Gaston, Anand J.; Abdul Rahman, Maisarah; Hughes, Jack W. J.; Rudman, George E.; Lowy, Phoebe A.; Nichol, Gary S.; Morrison, Carole A.; Phomphrai, Khamphee; Garden, Jennifer A. Heterometallic Li/Zn, Li/Al and Li/In catalysts for <i>rac</i>-lactide ring-opening polymerisation: "ate" or "non-ate" pathways? Catalysis science & technology, 2025, 15, 6113-6121 |
| 1575592 | CIF | C23 H24 Cl2 In Li N2 O6 | P 1 21/c 1 | 9.241; 19.9078; 13.6849 90; 96.153; 90 | 2503.08 | Piyawongsiri, Thitirat; Gaston, Anand J.; Abdul Rahman, Maisarah; Hughes, Jack W. J.; Rudman, George E.; Lowy, Phoebe A.; Nichol, Gary S.; Morrison, Carole A.; Phomphrai, Khamphee; Garden, Jennifer A. Heterometallic Li/Zn, Li/Al and Li/In catalysts for <i>rac</i>-lactide ring-opening polymerisation: "ate" or "non-ate" pathways? Catalysis science & technology, 2025, 15, 6113-6121 |
| 1575710 | CIF | C7 H6 O3 | P 21 21 21 | 6.736; 8.2286; 11.389 90; 90; 90 | 631.27 | Katkar, Ashwini Vishwasrao; Charpe, Vaibhav Pramod; Hwang, Kuo Chu Synthesis of hydroxyl functionalized aryl/alkyl ketones via visible-light-driven cross-coupling of benzoquinones and alcohols at room temperature Catalysis Science & Technology, 2025, 15, 5980-5985 |
| 1575711 | CIF | C15 H14 O5 | P 1 21/c 1 | 9.3362; 8.1868; 17.6318 90; 100.416; 90 | 1325.45 | Katkar, Ashwini Vishwasrao; Charpe, Vaibhav Pramod; Hwang, Kuo Chu Synthesis of hydroxyl functionalized aryl/alkyl ketones via visible-light-driven cross-coupling of benzoquinones and alcohols at room temperature Catalysis Science & Technology, 2025, 15, 5980-5985 |
| 1575712 | CIF | C13 H9 F O3 | P 21 21 21 | 4.4623; 11.6506; 19.6409 90; 90; 90 | 1021.1 | Katkar, Ashwini Vishwasrao; Charpe, Vaibhav Pramod; Hwang, Kuo Chu Synthesis of hydroxyl functionalized aryl/alkyl ketones via visible-light-driven cross-coupling of benzoquinones and alcohols at room temperature Catalysis Science & Technology, 2025, 15, 5980-5985 |
| 1575713 | CIF | C8 H7 O | C m c 21 | 12.8443; 10.8782; 8.8986 90; 90; 90 | 1243.34 | Katkar, Ashwini Vishwasrao; Charpe, Vaibhav Pramod; Hwang, Kuo Chu Synthesis of hydroxyl functionalized aryl/alkyl ketones via visible-light-driven cross-coupling of benzoquinones and alcohols at room temperature Catalysis Science & Technology, 2025, 15, 5980-5985 |
| 1575714 | CIF | C14 H12 O3 | P 1 21/c 1 | 7.82007; 23.6447; 12.4839 90; 107.187; 90 | 2205.24 | Katkar, Ashwini Vishwasrao; Charpe, Vaibhav Pramod; Hwang, Kuo Chu Synthesis of hydroxyl functionalized aryl/alkyl ketones via visible-light-driven cross-coupling of benzoquinones and alcohols at room temperature Catalysis Science & Technology, 2025, 15, 5980-5985 |
| 1575809 | CIF | C19 H19 F24 N2 O5 Ti | P 1 21/n 1 | 14.4959; 12.8299; 16.1978 90; 97.922; 90 | 2983.73 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575810 | CIF | C20 H36 F12 N4 O6 Ti2 | P 1 21/n 1 | 12.1293; 12.741; 20.1157 90; 92.442; 90 | 3105.85 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575811 | CIF | C20 H34 F12 N4 O6 Ti2 | P -1 | 9.5425; 9.6023; 9.937 67.895; 79.245; 63.17 | 752.63 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575812 | CIF | C18 H18 F24 N2 O4 Ti | P b c a | 15.9682; 12.0478; 28.9061 90; 90; 90 | 5561 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575813 | CIF | C21 H30 F18 N2 O8 Ti2 | P b c a | 19.5163; 17.4673; 19.7943 90; 90; 90 | 6747.82 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575814 | CIF | C31 H40 F24 N4 O6 Ti2 | P n a 21 | 24.6382; 12.0552; 62.6466 90; 90; 90 | 18607.2 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575815 | CIF | C37.5 H59.5 Cl1.5 F24 N5 O17 Ti5 | P 1 21/c 1 | 15.4951; 13.2894; 32.9588 90; 94.742; 90 | 6763.66 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575816 | CIF | C27.5 H36 F24 N4 O6 Ti2 | P n a 21 | 24.66436; 12.04568; 62.6972 90; 90; 90 | 18627.3 | Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis Catalysis Science & Technology, 2025, 15, 6744-6756 |
| 1575817 | CIF | C30 H26 Br4 Fe2 N6 | P 1 21/c 1 | 14.985; 11.002; 20.12 90; 102.416; 90 | 3240 | Pradhan, Chandini; Dubey, Shivansh; Samal, Pragnya Paramita; Krishnamurty, Sailaja; Punji, Benudhar syn-Selective hydrosilylation and hydroboration of alkynes at room temperature catalyzed by a phosphine-free (NNN)Fe(ii) complex Catalysis Science & Technology, 2025, 15, 6716-6725 |
| 1575841 | CIF | C49 H54 Br Mn O6 P2 | P -1 | 9.3612; 10.4559; 24.2055 79.16; 85.944; 80.855 | 2295.34 | Jiménez, Verónica; González, Carmen; Serrano, Joaquín López; Fernández de Córdova, Francisco; Pizzano, Antonio Non-bifunctional Mn catalysts based on phosphine–phosphites for the hydrogenation of carbonyl substrates Catalysis Science & Technology, 2025, 15, 6666-6677 |
| 1575940 | CIF | C44 H37 Br2 Cl2 F4 N3 Ni O | P 1 21/c 1 | 12.3883; 17.3876; 19.7078 90; 101.242; 90 | 4163.66 | Zeng, Yifan; Wang, Yizhou; Singh, Kuldip; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua Correlating electronic properties of a nickel polymerisation catalyst with the branching density of a polyethylene Catalysis Science & Technology, 2025, 15, 5335-5345 |
| 1575941 | CIF | C42 H33 Br2 F4 N3 Ni | C 1 2/c 1 | 37.6585; 10.2241; 22.1231 90; 122.034; 90 | 7220.9 | Zeng, Yifan; Wang, Yizhou; Singh, Kuldip; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua Correlating electronic properties of a nickel polymerisation catalyst with the branching density of a polyethylene Catalysis Science & Technology, 2025, 15, 5335-5345 |
| 1575942 | CIF | C85 H61 Br4 Cl9 F14 N4 Ni2 | C 1 2/c 1 | 31.6383; 10.6227; 27.4917 90; 107.361; 90 | 8818.6 | Zeng, Yifan; Wang, Yizhou; Singh, Kuldip; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua Correlating electronic properties of a nickel polymerisation catalyst with the branching density of a polyethylene Catalysis Science & Technology, 2025, 15, 5335-5345 |
| 1575943 | CIF | C44 H35 Br3 F4 N4 Ni | C 1 c 1 | 16.7042; 13.9391; 36.092 90; 102.438; 90 | 8206.5 | Zeng, Yifan; Wang, Yizhou; Singh, Kuldip; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua Correlating electronic properties of a nickel polymerisation catalyst with the branching density of a polyethylene Catalysis Science & Technology, 2025, 15, 5335-5345 |
| 1575944 | CIF | C47 H39.5 Br2 F4 N6.5 Ni O2 | C 1 2/c 1 | 32.1203; 17.5007; 21.208 90; 130.266; 90 | 9096.8 | Zeng, Yifan; Wang, Yizhou; Singh, Kuldip; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua Correlating electronic properties of a nickel polymerisation catalyst with the branching density of a polyethylene Catalysis Science & Technology, 2025, 15, 5335-5345 |
| 1575945 | CIF | C188 H196 Br8 F16 N8 Ni4 O10 | P -1 | 11.7367; 16.4401; 23.1393 100.01; 94.007; 101.121 | 4289.5 | Zeng, Yifan; Wang, Yizhou; Singh, Kuldip; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua Correlating electronic properties of a nickel polymerisation catalyst with the branching density of a polyethylene Catalysis Science & Technology, 2025, 15, 5335-5345 |
| 1575972 | CIF | C19 H17 Cl3 Cr N3 O | P 1 21/n 1 | 15.8; 8.357; 16.344 90; 103.866; 90 | 2095.2 | Narjinari, Himani; Dhole, Sunil; Kumar, Akshai Catalytic Value Addition of Glycerol to Lactic Acid by Chromium Chloride and its Corresponding Pincer Complex Catalysis Science & Technology, 2025 |
| 1575973 | CIF | C29 H40 B Cl3 F4 N3 O3 Rh Si | P 1 21/c 1 | 7.181; 19.2695; 25.099 90; 98.181; 90 | 3437.7 | Atwi, Boshra; Wang, Dongren; Bruckner, Johanna R.; Frey, Wolfgang; Buchmeiser, Michael R. Confinement-induced Z-selectivity in the rhodium N-heterocyclic carbene-catalyzed hydroboration of terminal alkynes Catalysis Science & Technology, 2025, 15, 7059-7066 |
| 1575974 | CIF | C29 H40 Cl4 N3 O3 Rh Si | P 1 21/n 1 | 7.1511; 18.5598; 24.6117 90; 94.408; 90 | 3256.9 | Atwi, Boshra; Wang, Dongren; Bruckner, Johanna R.; Frey, Wolfgang; Buchmeiser, Michael R. Confinement-induced Z-selectivity in the rhodium N-heterocyclic carbene-catalyzed hydroboration of terminal alkynes Catalysis Science & Technology, 2025, 15, 7059-7066 |
| 1575975 | CIF | C28 H43 B F4 N3 O4 Rh Si | P -1 | 11.089; 12.165; 14.201 99.026; 101.031; 116.881 | 1611 | Atwi, Boshra; Wang, Dongren; Bruckner, Johanna R.; Frey, Wolfgang; Buchmeiser, Michael R. Confinement-induced Z-selectivity in the rhodium N-heterocyclic carbene-catalyzed hydroboration of terminal alkynes Catalysis Science & Technology, 2025, 15, 7059-7066 |
| 1576130 | CIF | C18 H24 F12 N4 O2 P2 | P 1 21/n 1 | 5.83359; 11.4194; 18.4894 90; 93.5921; 90 | 1229.27 | Reusser, Esaïe; Albrecht, Martin Tunable bis(pyridinium amidate) ligands efficiently promote palladium-catalyzed ethylene polymerization Catalysis Science & Technology, 2025 |
| 1576131 | CIF | C16 H20 F12 N4 O2 P2 | P 1 21/c 1 | 7.13858; 21.77525; 7.76094 90; 108.082; 90 | 1146.81 | Reusser, Esaïe; Albrecht, Martin Tunable bis(pyridinium amidate) ligands efficiently promote palladium-catalyzed ethylene polymerization Catalysis Science & Technology, 2025 |
| 1576132 | CIF | C14 H14 N4 O2 | P 1 21/c 1 | 7.29001; 24.7363; 7.53443 90; 113.324; 90 | 1247.64 | Reusser, Esaïe; Albrecht, Martin Tunable bis(pyridinium amidate) ligands efficiently promote palladium-catalyzed ethylene polymerization Catalysis Science & Technology, 2025 |
| 1576133 | CIF | C38 H48 F15 K N10 O4 P2.5 Pd2 | P 1 21/c 1 | 21.4383; 22.0849; 13.37677 90; 102.768; 90 | 6176.79 | Reusser, Esaïe; Albrecht, Martin Tunable bis(pyridinium amidate) ligands efficiently promote palladium-catalyzed ethylene polymerization Catalysis Science & Technology, 2025 |
| 1576219 | CIF | C22 H26 Cl Fe N2 O5 | P -1 | 10.305; 11.2133; 20.326 87.874; 82.5; 68.349 | 2164.19 | Usman, Mohammad; Hussein, Mohamed A. T.; Kandiel, Tarek; Yamani, Zain Hassan; Shaikh, M. Nasiruzzaman Catalytic Ammonia Oxidation via High-Spin Fe(III) Complex: DFT-Driven Mechanistic Elucidation Catalysis Science & Technology, 2025 |
| 1576314 | CIF | C11 H10 Cl2 N4 Zn | P -1 | 7.5445; 7.6703; 11.5765 77.414; 84.498; 83.299 | 647.63 | Kukreti, Prashant; Chauhan, Rahul; Sharma, Keshav; Hitomi, Yutaka; Ghosh, Kaushik Metal-ligand cooperative strategy of Zn-catalyst for multicomponent synthesis of highly substituted pyrazolines, pyrimidines, and quinolines: A combined experimental and DFT optimized study Catalysis Science & Technology, 2025 |
| 1576387 | CIF | C28 H23 Cl2 N9 O4 Pd | P 1 21/c 1 | 8.1522; 23.0108; 16.0988 90; 91.122; 90 | 3019.37 | Gahlaut, Puneet Singh; Shekhawat, Bhawana; Mondal, Partha; Jana, Barun Efficient C-2 Arylation of Azoles via [κ 2 N] Pd (II)-Triazolyl-Pyridine Complexes Enabled by Silver in HFIP Catalysis Science & Technology, 2025 |
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