Crystallography Open Database
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| 7251228 | CIF | C54 H58 Br2 Cu2 N10 O15 | P -1 | 14.0326; 15.3151; 15.7791 102.979; 109.334; 107.627 | 2843.7 | Kumari, Pratima; Kumar, Aman; Kataria, Ramesh; Kaushik, Navin Kumar; Ahmed, Mukhtar; Ansari, Azaj; Ekta,; Brahma, Mettle; Maruthi, Mulaka; Babu, Yangala Sudheer; Singh, Bijender; Kumar, Vinod Synthesis, characterization and biological studies of pyrazole-linked Schiff bases and their copper(ii) complexes as potential therapeutics RSC Advances, 2025, 15, 42299-42314 |
| 7251229 | CIF | C19 H26 Cl F6 N2 P Ru S | P 21 21 21 | 9.907; 13.111; 18.3887 90; 90; 90 | 2388.52 | Bhunya, Debasis; Datta, Riya; Maity, Ribhu; Saha, Alipe; Sen, Sujata; Brandao, Paula; Pattanayak, Satyajit; Maity, Tithi; Sarkar, Keka; Samanta, Bidhan Chandra Design and synthesis of bioactive Ru(ii) complexes: antibacterial activity, biocompatibility and biomolecular binding RSC Advances, 2025, 15, 42573-42587 |
| 7251243 | CIF | C25 H43 Cl P2 Se | P 1 21/n 1 | 6.6637; 19.2509; 22.2228 90; 95.852; 90 | 2835.9 | Aghion, Iulia-Andreea; Septelean, Raluca A.; Lucaci, David; Moraru, Ionut-Tudor; Soran, Albert P.; Ciocan, Catalin C.; Licarete, Emilia; Banciu, Manuela; Nemes, Gabriela Synthesis and coordination ability of the first phosphavinyl(selenoxo)phosphorane: an electronic story RSC Advances, 2025, 15, 43426-43435 |
| 7251244 | CIF | C26 H45 Cl5 P2 Pd Se | P n m a | 9.6344; 13.6183; 25.1598 90; 90; 90 | 3301.1 | Aghion, Iulia-Andreea; Septelean, Raluca A.; Lucaci, David; Moraru, Ionut-Tudor; Soran, Albert P.; Ciocan, Catalin C.; Licarete, Emilia; Banciu, Manuela; Nemes, Gabriela Synthesis and coordination ability of the first phosphavinyl(selenoxo)phosphorane: an electronic story RSC Advances, 2025, 15, 43426-43435 |
| 7251245 | CIF | C21 H21 N3 O5 | P 31 2 1 | 9.5132; 9.5132; 39.0933 90; 90; 120 | 3063.98 | Zhang, Guangshuai; Chen, Xin; Liu, Yan; Peng, Rui; Xu, Mengwei; Yan, Si; Xiao, Jin; Liu, Zishu; Min, Qing; Liao, Gang; Wang, Xiaoji; Qin, Shuanglin NaHMDS/B(C6F5)3-promoted diastereoselective Friedel–Crafts alkylation of indoles/pyrroles with N-tert-butanesulfinylimines: towards the asymmetric synthesis of bisindole alkaloid Calcicamide B RSC Advances, 2025, 15, 43421-43425 |
| 7251246 | CIF | C17 H18 Bi2 I8 N4 O | P -1 | 7.5699; 9.652; 11.5436 76.552; 86.66; 84.383 | 815.82 | Hrizi, Chakib; Hamdouni, Monia; Essid, Marwa; Nouiri, Mourad; Khatyr, Abderrahim; Knorr, Michael; Viau, Lydie; Schmidt, Annika; Strohmann, Carsten; Chaabouni, Slaheddine Extending lead-free organic–inorganic semiconducting materials to new polymeric structures: 2,2′-bipyridinium iodoantimonate and quinoxalinium iodobismuthate RSC Advances, 2025, 15, 43523-43541 |
| 7251247 | CIF | C10 H9 I4 N2 Sb | C 1 c 1 | 12.2685; 18.2626; 7.5924 90; 91.864; 90 | 1700.21 | Hrizi, Chakib; Hamdouni, Monia; Essid, Marwa; Nouiri, Mourad; Khatyr, Abderrahim; Knorr, Michael; Viau, Lydie; Schmidt, Annika; Strohmann, Carsten; Chaabouni, Slaheddine Extending lead-free organic–inorganic semiconducting materials to new polymeric structures: 2,2′-bipyridinium iodoantimonate and quinoxalinium iodobismuthate RSC Advances, 2025, 15, 43523-43541 |
| 7251310 | CIF | C8 H14 Cl5 N2 Sb | P 1 21/n 1 | 10.8365; 11.8067; 12.0281 90; 106.92; 90 | 1472.3 | Alibi, Amin; Elleuch, Nour; Oueslati, Abderrazek; Shova, Sergiu; Boujelbene, Mohamed Synthesis, optical features, and electrical properties of a new antimony-based hybrid halide (C8H14N2)[SbCl5] RSC Advances, 2025, 15, 45840-45854 |
| 7251311 | CIF | C13 H15 Cu N3 O6 | P 1 21/n 1 | 8.5673; 10.4935; 16.3022 90; 97.043; 90 | 1454.52 | Khan, Md. Adnan; Shruti, Sonal; Sengupta, Swaraj; Khan, Sahanwaj; Bhardwaj, Prabhakar; Kumar, Pankaj; Naskar, Subhendu Water-soluble binuclear aquo Cu(ii) complex with an amide ligand as an electrocatalyst for the OER, HER and CO2RR RSC Advances, 2025, 15, 46425-46433 |
| 7251312 | CIF | C13 H15 N3 O5 | P -1 | 8.3624; 8.5232; 9.6931 92.749; 92.29; 96.721 | 684.61 | Khan, Md. Adnan; Shruti, Sonal; Sengupta, Swaraj; Khan, Sahanwaj; Bhardwaj, Prabhakar; Kumar, Pankaj; Naskar, Subhendu Water-soluble binuclear aquo Cu(ii) complex with an amide ligand as an electrocatalyst for the OER, HER and CO2RR RSC Advances, 2025, 15, 46425-46433 |
| 7251313 | CIF | C17 H13 N O3 | P 1 21/n 1 | 10.0247; 10.2858; 13.4724 90; 110.611; 90 | 1300.25 | Miwa, Marino; Ito, Akitaka Fluorescent solvatochromism and nonfluorescence processes of charge-transfer-type molecules with a 4-nitrophenyl moiety RSC Advances, 2025, 15, 46297-46307 |
| 7251314 | CIF | C17 H14 O | P 1 21/c 1 | 11.5001; 17.6022; 5.9565 90; 94.087; 90 | 1202.69 | Miwa, Marino; Ito, Akitaka Fluorescent solvatochromism and nonfluorescence processes of charge-transfer-type molecules with a 4-nitrophenyl moiety RSC Advances, 2025, 15, 46297-46307 |
| 7251315 | CIF | C52 H99 N30 O36 | I 4 | 28.306; 28.306; 18.617 90; 90; 90 | 14916 | Rincón, David A; Zaorska, Ewelina; Malinska, Maura Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding. RSC advances, 2025, 15, 45555-45572 |
| 7251316 | CIF | C52 H87 Cl2 F2 N30 O30 | I 4 | 28.6126; 28.6126; 18.3038 90; 90; 90 | 14985 | Rincón, David A; Zaorska, Ewelina; Malinska, Maura Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding. RSC advances, 2025, 15, 45555-45572 |
| 7251317 | CIF | C50 H71 N32 Na3.5 O35 | P n n 2 | 28.9179; 26.6083; 10.629 90; 90; 90 | 8178.5 | Rincón, David A; Zaorska, Ewelina; Malinska, Maura Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding. RSC advances, 2025, 15, 45555-45572 |
| 7251318 | CIF | C73 H182 Cl F N44 O74 | C 2 2 21 | 32.4607; 39.283; 20.2199 90; 90; 90 | 25783.5 | Rincón, David A; Zaorska, Ewelina; Malinska, Maura Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding. RSC advances, 2025, 15, 45555-45572 |
| 7251340 | CIF | C12 H10 N2 O2 S | P n a 21 | 19.4454; 5.3607; 10.9087 90; 90; 90 | 1137.13 | Pavić, Luka; Miočić, Filip; Razum, Marta; Sarjanović, Josipa; Pisk, Jana From structure to function: tunable electrical and catalytic properties in rare Mo(vi)-thiophene-2-carboxylic acid hydrazone complexes obtained mechanochemically RSC Advances, 2025, 15, 46194-46206 |
| 7251341 | CIF | C15 H16 Mo N2 O6 S | P 1 21/c 1 | 7.7429; 10.6417; 21.2775 90; 91.132; 90 | 1752.87 | Pavić, Luka; Miočić, Filip; Razum, Marta; Sarjanović, Josipa; Pisk, Jana From structure to function: tunable electrical and catalytic properties in rare Mo(vi)-thiophene-2-carboxylic acid hydrazone complexes obtained mechanochemically RSC Advances, 2025, 15, 46194-46206 |
| 7251342 | CIF | C13 H12 Mo N2 O5 S | P b c n | 14.8458; 7.2875; 26.5865 90; 90; 90 | 2876.36 | Pavić, Luka; Miočić, Filip; Razum, Marta; Sarjanović, Josipa; Pisk, Jana From structure to function: tunable electrical and catalytic properties in rare Mo(vi)-thiophene-2-carboxylic acid hydrazone complexes obtained mechanochemically RSC Advances, 2025, 15, 46194-46206 |
| 7251360 | CIF | C26 H22 F6 N2 O2 | P -1 | 9.5617; 10.833; 11.9272 96.483; 106.465; 99.458 | 1151.9 | Akhtar, Nasim; Lekanne Deprez, Siebe; Jayawardana, Senuri G.; Davis, Macallister; Fonseca Guerra, Célia; García-López, Víctor From amides to thioamides: understanding enhanced anion binding in acyclic receptors RSC Advances, 2025, 15, 46908-46913 |
| 7251361 | CIF | C30 H28 Cl0 N2 O2 | P 1 21/n 1 | 9.5813; 27.725; 9.8074 90; 114.246; 90 | 2375.4 | Akhtar, Nasim; Lekanne Deprez, Siebe; Jayawardana, Senuri G.; Davis, Macallister; Fonseca Guerra, Célia; García-López, Víctor From amides to thioamides: understanding enhanced anion binding in acyclic receptors RSC Advances, 2025, 15, 46908-46913 |
| 7251362 | CIF | C12 H9 Cl F N O3 | P -1 | 7.1404; 8.9074; 9.3379 72.15; 81.114; 85.545 | 558.25 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251363 | CIF | C14 H13 Cl F N O3 | P -1 | 9.0561; 9.0599; 9.325 69.818; 69.854; 71.629 | 657.2 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251364 | CIF | C14 H19 Cl F N O6 | P -1 | 7.8889; 9.0771; 12.3827 99.027; 97.434; 107.192 | 821.95 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251365 | CIF | C11 H7 Cl F N O3 | P -1 | 7.1789; 8.4907; 9.3255 73.107; 71.053; 76.278 | 507.98 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251366 | CIF | C13 H11 Cl F N O3 | P 1 21/c 1 | 11.992; 25.5932; 8.1786 90; 91.831; 90 | 2508.8 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251367 | CIF | C14 H15 Cl F N O4 | P 1 21/c 1 | 4.3523; 15.2232; 22.9957 90; 92.056; 90 | 1522.6 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251368 | CIF | C15 H15 Cl F N O3 | P 1 21/n 1 | 10.4187; 11.4345; 12.6311 90; 101.018; 90 | 1477 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251369 | CIF | C13 H11 Cl F N O3 | P -1 | 8.2284; 8.97; 9.4084 69.237; 74.254; 69.76 | 600.4 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251370 | CIF | C10 H5 Cl F N O3 | P 1 21/n 1 | 6.291; 8.2326; 17.968 90; 97.441; 90 | 922.7 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251371 | CIF | C15 H11 Cl F N4 O3 | P 1 21/n 1 | 8.8502; 20.148; 9.0629 90; 108.764; 90 | 1530.2 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251372 | CIF | C15 H14 Cl4 F N O3 | P 1 21/n 1 | 7.2079; 27.556; 9.2363 90; 92.329; 90 | 1833 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251373 | CIF | C16 H17 Cl F N O3 | P 1 21/c 1 | 10.2295; 16.2593; 9.9934 90; 113.612; 90 | 1523 | Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar Exploring weak noncovalent interactions in a few halo-substituted quinolones. RSC advances, 2025, 15, 37216-37225 |
| 7251374 | CIF | C39 H28 N2 Se | P 1 21/c 1 | 10.967; 26.809; 9.828 90; 96.41; 90 | 2871.5 | Issac, Jerome; Priyadharsan, R. Rameshbabu; Chidambaranathan, Kamalanathan; Karthikeyan, Subramanian; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi Phenyl selenoxide functionalized TPA/TPE π-conjugated imidazo[1,2-<i>a</i>]pyridine: a fluorescent probe for the selective detection of water in organic solvents. RSC advances, 2025, 15, 44205-44212 |
| 7251375 | CIF | C28 H26 N2 O4 | C 1 2/c 1 | 32.7304; 4.4327; 32.3534 90; 96.961; 90 | 4659.4 | Tanbakouchian, Zahra; Zolfigol, Mohammad Ali; Tonekaboni, Maryam-Sadat; Kozakiewicz-Piekarz, Anna; Bikas, Rahman Regioselective Cu(i)-catalyzed intramolecular hydroacylation and dimerization of propargylarylaldehydes. RSC advances, 2025, 15, 44254-44259 |
| 7251376 | CIF | C11 H14 N2 O2 S | P 1 21 1 | 5.8421; 9.9787; 10.4247 90; 101.544; 90 | 595.43 | Shandu, Malibongwe P.; Ngwenya, Andile R.; Lamola, Jairus L.; Moshapo, Paseka T. Base-mediated three-component system for the synthesis of <i>S</i>-substituted <i>N</i>-acyl ureas. RSC advances, 2025, 15, 44246-44251 |
| 7251377 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.24314; 6.13919; 8.70641 90; 101.075; 90 | 379.938 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251378 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.24488; 6.14439; 8.7053 90; 101.106; 90 | 380.262 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251379 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.23374; 6.13187; 8.69579 90; 101.094; 90 | 378.505 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251380 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.243; 6.13597; 8.70648 90; 101.07; 90 | 379.741 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251381 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.24395; 6.13599; 8.70666 90; 101.071; 90 | 379.799 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251382 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.23467; 6.13615; 8.69951 90; 101.04; 90 | 379.051 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251383 | CIF | C6 H8 As N O3 | P 1 21 1 | 7.24136; 6.13653; 8.70452 90; 101.074; 90 | 379.599 | Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments RSC Advances, 2025, 15, 46749-46760 |
| 7251384 | CIF | C62 H58 Cu F6 N4 O8 P | P -1 | 14.7809; 14.8375; 15.4905 115.129; 114.546; 92.324 | 2698.9 | Cetin, M. Mustafa; Mazumdar, Arindam; Cordes, David B.; Fidan, Vahap Gazi; Yang, Zhen; Mayer, Michael F. Rotaxane synthesis via a dynamic [2]catenane-ring-opening, axle-cleaving double cross metathesis RSC Advances, 2025, 15, 47117-47127 |
| 7251385 | CIF | C62 H58 Cu F6 N4 O8 P | P 1 21/c 1 | 16.7265; 7.8498; 43.035 90; 96.345; 90 | 5615.9 | Cetin, M. Mustafa; Mazumdar, Arindam; Cordes, David B.; Fidan, Vahap Gazi; Yang, Zhen; Mayer, Michael F. Rotaxane synthesis via a dynamic [2]catenane-ring-opening, axle-cleaving double cross metathesis RSC Advances, 2025, 15, 47117-47127 |
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