Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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7249226 | CIF | C28 H42 N6 O4 Zr | P 1 21/n 1 | 9.6548; 15.7838; 19.7193 90; 90.246; 90 | 3005 | Flores-Romero, Víctor; LeBlanc, Jesse; Chen, Zichuan; Lavoie, Gino G. Ti and Zr complexes bearing guanidine-phenolate ligands: coordination chemistry and polymerization studies RSC Advances, 2024, 14, 25889-25899 |
7249227 | CIF | C28 H42 N6 O4 Ti | P 1 21/n 1 | 23.2014; 10.7004; 24.3975 90; 95.7949; 90 | 6026.1 | Flores-Romero, Víctor; LeBlanc, Jesse; Chen, Zichuan; Lavoie, Gino G. Ti and Zr complexes bearing guanidine-phenolate ligands: coordination chemistry and polymerization studies RSC Advances, 2024, 14, 25889-25899 |
7249242 | CIF | C24 H26 I2 N4 Pd | P 1 21/n 1 | 9.578; 16.2412; 33.3733 90; 96.353; 90 | 5159.6 | Joshi, Om Prakash; Thirumoorthi, Ramalingam; Pardasani, Ram T.; Ray, Sriparna; Dash, Chandrakanta Palladium(ii) complexes bearing mesoionic carbene ligands: catalytic application in domino Sonogashira coupling/cyclization reactions for one-pot synthesis of benzofuran and indole derivatives. RSC advances, 2024, 14, 27141-27152 |
7249243 | CIF | C54 H28 Fe2 N10 O22 | C 1 2/c 1 | 16.017; 14.142; 26.803 90; 90.347; 90 | 6071 | Sendh, Jagajiban; Baruah, Jubaraj B. Bi-component sensing platform for the detection of Cd<sup>2+</sup>, Fe<sup>2+</sup>and Fe<sup>3+</sup> ions. RSC advances, 2024, 14, 27153-27161 |
7249244 | CIF | C32 H20 Fe N5 O12 | P -1 | 7.808; 14.712; 14.844 117.038; 92.27; 98.607 | 1490 | Sendh, Jagajiban; Baruah, Jubaraj B. Bi-component sensing platform for the detection of Cd<sup>2+</sup>, Fe<sup>2+</sup>and Fe<sup>3+</sup> ions. RSC advances, 2024, 14, 27153-27161 |
7249245 | CIF | C17 H18 N2 O6 | P 1 21/c 1 | 10.9599; 10.3802; 14.7603 90; 92.621; 90 | 1677.46 | Singh, Vishal; Rajput, Khushbu; Singh, Sundaram; Srivastava, Vandana Montmorillonite K-10 catalyzed synthesis of Hantzsch dihydropyridine derivatives from methyl arenes <i>via in situ</i> generated ammonia under microwave irradiation in neat conditions. RSC advances, 2024, 14, 27086-27091 |
7249246 | CIF | C19 H14 F5 N O2 | P b c a | 18.7156; 8.5123; 21.5158 90; 90; 90 | 3427.7 | Janecký, Lukáš; Klepetářová, Blanka; Beier, Petr Transformation of 5-acylated <i>N</i>-fluoroalkyl-1,2,3-triazoles to trifluoromethylated ring-fused isoquinolines, 1,3-oxazines, and 1,3-oxazin-6-ones <i>via</i> ketenimines. RSC advances, 2024, 14, 26938-26942 |
7249247 | CIF | C15 H11 F4 N O2 | P -1 | 4.8502; 10.1006; 14.4402 109.303; 97.3122; 95.91 | 654.23 | Janecký, Lukáš; Klepetářová, Blanka; Beier, Petr Transformation of 5-acylated <i>N</i>-fluoroalkyl-1,2,3-triazoles to trifluoromethylated ring-fused isoquinolines, 1,3-oxazines, and 1,3-oxazin-6-ones <i>via</i> ketenimines. RSC advances, 2024, 14, 26938-26942 |
7249248 | CIF | C15 H8 F3 N O2 S | P 1 21/c 1 | 11.2617; 14.3039; 9.125 90; 109.16; 90 | 1388.48 | Janecký, Lukáš; Klepetářová, Blanka; Beier, Petr Transformation of 5-acylated <i>N</i>-fluoroalkyl-1,2,3-triazoles to trifluoromethylated ring-fused isoquinolines, 1,3-oxazines, and 1,3-oxazin-6-ones <i>via</i> ketenimines. RSC advances, 2024, 14, 26938-26942 |
7249272 | CIF | C28 H16 Cd N2 O12 | C 1 2/c 1 | 13.8767; 13.7096; 26.8754 90; 103.797; 90 | 4965.4 | Hou, Yaxin; Liu, Yang; Chai, Juan A Cd-based MOF: iodine capture and enhanced efficiency of perovskite solar cells RSC Advances, 2024, 14, 27697-27702 |
7249273 | CIF | C7 H8 N2 O3 S | P b c n | 22.162; 7.1809; 10.8505 90; 90; 90 | 1726.8 | Pate, Sophie; Taujanskas, Joshua; Wells, Robyn; Robertson, Craig M.; O'Neill, Paul M.; Stachulski, Andrew V. Convenient syntheses of 2-acylamino-4-halothiazoles and acylated derivatives using a versatile Boc-intermediate RSC Advances, 2024, 14, 27894-27903 |
7249274 | CIF | C5 H5 Cl N2 O S | P -1 | 5.0499; 7.4591; 9.4964 90.462; 91.106; 108.081 | 339.94 | Pate, Sophie; Taujanskas, Joshua; Wells, Robyn; Robertson, Craig M.; O'Neill, Paul M.; Stachulski, Andrew V. Convenient syntheses of 2-acylamino-4-halothiazoles and acylated derivatives using a versatile Boc-intermediate RSC Advances, 2024, 14, 27894-27903 |
7249275 | CIF | C42 H30 Cl2 N4 O12 S2 | P n a 21 | 20.4035; 8.6054; 23.5849 90; 90; 90 | 4141 | Pate, Sophie; Taujanskas, Joshua; Wells, Robyn; Robertson, Craig M.; O'Neill, Paul M.; Stachulski, Andrew V. Convenient syntheses of 2-acylamino-4-halothiazoles and acylated derivatives using a versatile Boc-intermediate RSC Advances, 2024, 14, 27894-27903 |
7249276 | CIF | C14 H11 Co N5 O4 | P -1 | 7.6951; 8.025; 11.2161 83.335; 76.981; 81.112 | 664.34 | Mei, Zhen-Zhong; Wang, Hong-Yu; Ren, Chao; Yang, Ying; Gu, Jin-Zhong Hydrothermal synthesis, structures, and catalytic performance of five coordination compounds driven by 5-aminoisophthalic acid RSC Advances, 2024, 14, 28160-28167 |
7249277 | CIF | C14 H11 Cd N5 O4 | P -1 | 7.8965; 8.168; 11.425 83.743; 77.408; 81.266 | 708.63 | Mei, Zhen-Zhong; Wang, Hong-Yu; Ren, Chao; Yang, Ying; Gu, Jin-Zhong Hydrothermal synthesis, structures, and catalytic performance of five coordination compounds driven by 5-aminoisophthalic acid RSC Advances, 2024, 14, 28160-28167 |
7249278 | CIF | C28 H38 N10 Ni2 O16 | P 1 21/c 1 | 11.9238; 8.0959; 18.3412 90; 95.998; 90 | 1760.85 | Mei, Zhen-Zhong; Wang, Hong-Yu; Ren, Chao; Yang, Ying; Gu, Jin-Zhong Hydrothermal synthesis, structures, and catalytic performance of five coordination compounds driven by 5-aminoisophthalic acid RSC Advances, 2024, 14, 28160-28167 |
7249279 | CIF | C32 H25 N4 Ni O5 | P 1 21/n 1 | 11.0968; 22.3594; 11.6156 90; 107.065; 90 | 2755.15 | Mei, Zhen-Zhong; Wang, Hong-Yu; Ren, Chao; Yang, Ying; Gu, Jin-Zhong Hydrothermal synthesis, structures, and catalytic performance of five coordination compounds driven by 5-aminoisophthalic acid RSC Advances, 2024, 14, 28160-28167 |
7249280 | CIF | C60 H55 N9 Ni3 O14 | P 1 | 10.1262; 13.2389; 13.3575 88.8838; 75.6606; 74.27 | 1667.76 | Mei, Zhen-Zhong; Wang, Hong-Yu; Ren, Chao; Yang, Ying; Gu, Jin-Zhong Hydrothermal synthesis, structures, and catalytic performance of five coordination compounds driven by 5-aminoisophthalic acid RSC Advances, 2024, 14, 28160-28167 |
7249281 | CIF | C27 H35 Br2 Co N5 O2 | P 1 21/c 1 | 9.5063; 16.1542; 19.9926 90; 95.61; 90 | 3055.49 | Zahradníková, Eva; Pichon, Céline; Duhayon, Carine; Sutter, Jean-Pascal; Halaš, Petr; Drahoš, Bohuslav Synthesis, structural and magnetic properties of cobalt(ii) complexes with pyridine-based macrocyclic ligand containing two pyridine pendant arms RSC Advances, 2024, 14, 28138-28147 |
7249282 | CIF | C29 H35 Co N7 O2 S2 | P -1 | 9.4553; 9.5655; 18.0521 84.509; 85.684; 69.475 | 1520.53 | Zahradníková, Eva; Pichon, Céline; Duhayon, Carine; Sutter, Jean-Pascal; Halaš, Petr; Drahoš, Bohuslav Synthesis, structural and magnetic properties of cobalt(ii) complexes with pyridine-based macrocyclic ligand containing two pyridine pendant arms RSC Advances, 2024, 14, 28138-28147 |
7249283 | CIF | C27 H35 Cl0.51 Co I1.49 N5 O4.05 | P 1 21/c 1 | 9.8084; 16.5786; 20.3177 90; 92.489; 90 | 3300.73 | Zahradníková, Eva; Pichon, Céline; Duhayon, Carine; Sutter, Jean-Pascal; Halaš, Petr; Drahoš, Bohuslav Synthesis, structural and magnetic properties of cobalt(ii) complexes with pyridine-based macrocyclic ligand containing two pyridine pendant arms RSC Advances, 2024, 14, 28138-28147 |
7249284 | CIF | C28 H35 Cl Co N6 O7 | P 1 21/c 1 | 10.1831; 15.8178; 19.919 90; 93.777; 90 | 3201.47 | Zahradníková, Eva; Pichon, Céline; Duhayon, Carine; Sutter, Jean-Pascal; Halaš, Petr; Drahoš, Bohuslav Synthesis, structural and magnetic properties of cobalt(ii) complexes with pyridine-based macrocyclic ligand containing two pyridine pendant arms RSC Advances, 2024, 14, 28138-28147 |
7249285 | CIF | C27 H35 Cl Co N8 O6 | P 1 21/c 1 | 10.2781; 15.7954; 19.6987 90; 95.297; 90 | 3184.36 | Zahradníková, Eva; Pichon, Céline; Duhayon, Carine; Sutter, Jean-Pascal; Halaš, Petr; Drahoš, Bohuslav Synthesis, structural and magnetic properties of cobalt(ii) complexes with pyridine-based macrocyclic ligand containing two pyridine pendant arms RSC Advances, 2024, 14, 28138-28147 |
7249286 | CIF | C29 H35 Co N7 O2 S2 | P n a 21 | 9.2098; 32.9484; 9.7803 90; 90; 90 | 2967.81 | Zahradníková, Eva; Pichon, Céline; Duhayon, Carine; Sutter, Jean-Pascal; Halaš, Petr; Drahoš, Bohuslav Synthesis, structural and magnetic properties of cobalt(ii) complexes with pyridine-based macrocyclic ligand containing two pyridine pendant arms RSC Advances, 2024, 14, 28138-28147 |
7249332 | CIF | C57 H72 Cl2 Fe N5 O7 | P -1 | 10.1982; 15.7867; 35.274 87.532; 83.977; 72.535 | 5386.9 | Poungsripong, Peeranuch; Boonprab, Theerapoom; Harding, Phimphaka; Murray, Keith S.; Phonsri, Wasinee; Zhang, Ningjin; Kitchen, Jonathan A.; Harding, David J. Synthesis, mixed-spin-state structure and Langmuir-Blodgett deposition of amphiphilic Fe(iii) quinolylsalicylaldiminate complexes. RSC advances, 2024, 14, 28716-28723 |
7249333 | CIF | C28 H37 N2 O2.5 | P -1 | 11.284; 12.1389; 19.1724 87.836; 79.244; 74.869 | 2490.4 | Poungsripong, Peeranuch; Boonprab, Theerapoom; Harding, Phimphaka; Murray, Keith S.; Phonsri, Wasinee; Zhang, Ningjin; Kitchen, Jonathan A.; Harding, David J. Synthesis, mixed-spin-state structure and Langmuir-Blodgett deposition of amphiphilic Fe(iii) quinolylsalicylaldiminate complexes. RSC advances, 2024, 14, 28716-28723 |
7249352 | CIF | C14 H20 N8 O6 | P 1 21 1 | 4.4615; 15.3156; 13.0669 90; 97.558; 90 | 885.11 | Konovalova, Irina S.; Shishkina, Svitlana V.; Wyshusek, Maik; Patzer, Michael; Reiss, Guido J. Supramolecular architecture of theophylline polymorphs, monohydrate and co-crystals with iodine: study from the energetic viewpoint RSC Advances, 2024, 14, 29774-29788 |
7249353 | CIF | C7 H8 N4 O2 | P 1 n 1 | 3.8744; 12.8898; 8.1167 90; 98.965; 90 | 400.4 | Konovalova, Irina S.; Shishkina, Svitlana V.; Wyshusek, Maik; Patzer, Michael; Reiss, Guido J. Supramolecular architecture of theophylline polymorphs, monohydrate and co-crystals with iodine: study from the energetic viewpoint RSC Advances, 2024, 14, 29774-29788 |
7249354 | CIF | C7 H8 I N4 O2 | P 1 21/c 1 | 6.0794; 16.9054; 9.2013 90; 99.973; 90 | 931.37 | Konovalova, Irina S.; Shishkina, Svitlana V.; Wyshusek, Maik; Patzer, Michael; Reiss, Guido J. Supramolecular architecture of theophylline polymorphs, monohydrate and co-crystals with iodine: study from the energetic viewpoint RSC Advances, 2024, 14, 29774-29788 |
7249355 | CIF | C7 H5 Br N4 | P b c m | 4.1492; 19.9564; 9.7232 90; 90; 90 | 805.11 | Maurya, Anand; Patel, Upendra Kumar; Kumar, Sanjeev; Agarwal, Alka Molybdenum trioxide as a newer diversified economic catalyst for the transformation of nitroarenes to arylamine and 5-substituted-1H-tetrazole RSC Advances, 2024, 14, 29505-29517 |
7249357 | CIF | C8 H58 O53 S4 Zr6 | C 1 c 1 | 13.9608; 27.9958; 14.7493 90; 116.436; 90 | 5161.9 | Garzón-Serrano, Andrea Y.; Lozano, Johan D.; Perez, Leon D.; Sierra, César A.; Macías, Mario A. Zr6O8 core cluster with formula unit [Zr6O4(OH)4(OH2)8(CH3COO)4(SO4)4]·nH2O obtained under mild conditions RSC Advances, 2024, 14, 29910-29918 |
7249369 | CIF | C46 H50 N2 O2 | P -1 | 9.8359; 13.2198; 15.2566 85.451; 82.673; 69.423 | 1840.79 | Dangar, Shilpa; Roy, Tiyasa; Noskar, Suman; Bisai, Alakesh Total synthesis of bicyclomahanimbine by Cu(ii)-promoted photoredox process. RSC advances, 2024, 14, 30110-30115 |
7249370 | CIF | C28 H28 Cl2 N6 Ni O9 | P -1 | 10.8951; 12.6583; 12.8328 87.684; 77.714; 72.944 | 1652.77 | Rajeev, Anjana; Muthuramalingam, Sethuraman; Sankaralingam, Muniyandi Selective synthesis of cyclic alcohols from cycloalkanes using nickel(ii) complexes of tetradentate amidate ligands RSC Advances, 2024, 14, 30440-30451 |
7249371 | CIF | C23 H27 Cl2 N5 Ni O10 | P 1 21/c 1 | 17.786; 7.4291; 21.345 90; 101.411; 90 | 2764.6 | Rajeev, Anjana; Muthuramalingam, Sethuraman; Sankaralingam, Muniyandi Selective synthesis of cyclic alcohols from cycloalkanes using nickel(ii) complexes of tetradentate amidate ligands RSC Advances, 2024, 14, 30440-30451 |
7249393 | CIF | C33 H31 B N9 Na | P -3 | 14.9362; 14.9362; 8.0716 90; 90; 120 | 1559.45 | Thomas, Jarrod R.; Mifsud, Jonathan T.; Sulway, Scott A. Optimised syntheses and purifications of 3-aryl/heterocyclic dihydrobis- and hydrotris-(pyrazolyl)borate ligands as their alkali salts RSC Advances, 2024, 14, 30713-30718 |
7249394 | CIF | C27 H25 B N9 Na S3 | R 3 c :H | 17.1463; 17.1463; 17.0555 90; 90; 120 | 4342.5 | Thomas, Jarrod R.; Mifsud, Jonathan T.; Sulway, Scott A. Optimised syntheses and purifications of 3-aryl/heterocyclic dihydrobis- and hydrotris-(pyrazolyl)borate ligands as their alkali salts RSC Advances, 2024, 14, 30713-30718 |
7249395 | CIF | C14 H12 B K N4 O2 | P n m a | 11.7918; 23.2058; 5.2271 90; 90; 90 | 1430.33 | Thomas, Jarrod R.; Mifsud, Jonathan T.; Sulway, Scott A. Optimised syntheses and purifications of 3-aryl/heterocyclic dihydrobis- and hydrotris-(pyrazolyl)borate ligands as their alkali salts RSC Advances, 2024, 14, 30713-30718 |
7249396 | CIF | C27 H25 B K N9 S3 | R 3 c :H | 17.4388; 17.4388; 16.8446 90; 90; 120 | 4436.3 | Thomas, Jarrod R.; Mifsud, Jonathan T.; Sulway, Scott A. Optimised syntheses and purifications of 3-aryl/heterocyclic dihydrobis- and hydrotris-(pyrazolyl)borate ligands as their alkali salts RSC Advances, 2024, 14, 30713-30718 |
7249397 | CIF | C32 H28 B2 N12 Na2 | C 1 2/c 1 | 15.7237; 10.8738; 20.0182 90; 111.251; 90 | 3189.9 | Thomas, Jarrod R.; Mifsud, Jonathan T.; Sulway, Scott A. Optimised syntheses and purifications of 3-aryl/heterocyclic dihydrobis- and hydrotris-(pyrazolyl)borate ligands as their alkali salts RSC Advances, 2024, 14, 30713-30718 |
7249398 | CIF | C32 H28 B2 Li2 N12 | C 1 2/c 1 | 10.5827; 21.2856; 14.616 90; 104.567; 90 | 3186.6 | Thomas, Jarrod R.; Mifsud, Jonathan T.; Sulway, Scott A. Optimised syntheses and purifications of 3-aryl/heterocyclic dihydrobis- and hydrotris-(pyrazolyl)borate ligands as their alkali salts RSC Advances, 2024, 14, 30713-30718 |
7249399 | CIF | C23 H18 N2 | P n a 21 | 9.851; 10.127; 16.933 90; 90; 90 | 1689.3 | Zhang, Hong; Jiang, Yunhe; Sun, Xiaoxue; Liang, Tianyu; Wang, Xiang; Li, Yang A new synthesis of indolo[2,3-b]quinolines from 3-acetyl-N-alkyl-2-chloroindoles with 2-aminobenzophenone RSC Advances, 2024, 14, 30707-30712 |
7249400 | CIF | C24 H19 Cl N2 | P b c a | 8.5868; 13.6623; 31.998 90; 90; 90 | 3753.9 | Zhang, Hong; Jiang, Yunhe; Sun, Xiaoxue; Liang, Tianyu; Wang, Xiang; Li, Yang A new synthesis of indolo[2,3-b]quinolines from 3-acetyl-N-alkyl-2-chloroindoles with 2-aminobenzophenone RSC Advances, 2024, 14, 30707-30712 |
7249404 | CIF | C14 H9 F2 N O3 | P 1 21/c 1 | 19.806; 4.4215; 16.055 90; 113.91; 90 | 1285.3 | Khorasani, Fereshteh; Ranjbar-Karimi, Reza; Mohammadiannejad, Kazem Utilizing perhalopyridine-based alkynes as suitable precursors for the synthesis of novel poly(1,2,3-triazolyl)-substituted perhalopyridines RSC Advances, 2024, 14, 30873-30885 |
7249405 | CIF | C15 H9 Br Cl4 N4 O | C 1 2/c 1 | 13.02; 9.949; 27.886 90; 93.46; 90 | 3605.7 | Khorasani, Fereshteh; Ranjbar-Karimi, Reza; Mohammadiannejad, Kazem Utilizing perhalopyridine-based alkynes as suitable precursors for the synthesis of novel poly(1,2,3-triazolyl)-substituted perhalopyridines RSC Advances, 2024, 14, 30873-30885 |
7249406 | CIF | C20 H20 Br4 N2 O4 Zn | C 1 2/c 1 | 21.5606; 4.5954; 25.0465 90; 110.368; 90 | 2326.44 | Gishan, Md; Middya, Puspendu; Drew, Michael G. B.; Frontera, Antonio; Chattopadhyay, Shouvik Synthesis, structural characterization, and theoretical analysis of novel zinc(ii) schiff base complexes with halogen and hydrogen bonding interactions RSC Advances, 2024, 14, 30896-30911 |
7249407 | CIF | C26 H34 N2 O8 Zn | A e a 2 | 21.494; 13.8469; 9.6418 90; 90; 90 | 2869.6 | Gishan, Md; Middya, Puspendu; Drew, Michael G. B.; Frontera, Antonio; Chattopadhyay, Shouvik Synthesis, structural characterization, and theoretical analysis of novel zinc(ii) schiff base complexes with halogen and hydrogen bonding interactions RSC Advances, 2024, 14, 30896-30911 |
7249408 | CIF | C22 H26 Br2 N2 O4 Zn | P 1 21/n 1 | 12.5138; 11.9667; 16.7858 90; 108.173; 90 | 2388.27 | Gishan, Md; Middya, Puspendu; Drew, Michael G. B.; Frontera, Antonio; Chattopadhyay, Shouvik Synthesis, structural characterization, and theoretical analysis of novel zinc(ii) schiff base complexes with halogen and hydrogen bonding interactions RSC Advances, 2024, 14, 30896-30911 |
7249415 | CIF | C14 H24 B N | P -1 | 8.552; 9.056; 9.909 68.308; 71.722; 79.828 | 675.5 | Snyder, Madison J.; Alawaed, Abdulkhaliq A.; Li, Chunge; Pacentine, Samantha; Hamann, Henry J.; Ramachandran, P. Veeraraghavan TiF<sub>4</sub>-mediated, one-pot, reductive amination of carboxylic acids with borane-ammonia. RSC advances, 2024, 14, 31205-31209 |
7249416 | CIF | C13 H17 N3 O2 | P 1 21/c 1 | 8.6436; 18.9145; 8.3234 90; 99.035; 90 | 1343.9 | Ajormal, Fatemeh; Bikas, Rahman; Ghasemzadeh, Hossein; Noshiranzadeh, Nader; Kozakiewicz-Piekarz, Anna Green and recyclable catalyst based on chitosan/CuFe2O4 nanocomposite hydrogel for one-step synthesis of 1,2,3-triazoles RSC Advances, 2024, 14, 31320-31331 |
7249429 | CIF | C30 H25 Br N4 O3 P Re | P 1 21/n 1 | 12.3314; 13.5371; 17.361 90; 102.929; 90 | 2824.62 | Valdivieso, Jorge P.; Erickson, Alexander N.; Gardinier, James R. Group 7 carbonyl complexes of a PNN-heteroscorpionate ligand RSC Advances, 2024, 14, 31502-31516 |
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