Crystallography Open Database
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Searching journal of publication like 'CrystEngComm' volume of publication is 28
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7251056 | CIF | C16 H12 N2 O2 | P 1 21/c 1 | 14.5096; 17.8805; 10.3906 90; 110.379; 90 | 2527 | Constantin, Ana M.; Mele, Francesco; Botla, Vinayak; Ca', Nicola Della; Maggi, Raimondo; Maestri, Giovanni; Cerveri, Alessandro; Sundermann, Remie M.; Cauzzi, Daniele; Pancrazzi, Francesco; Mazzeo, Paolo P. A deep dive into mechanochemical organic reactions by accurate crystallographic analysis via TAAM refinement CrystEngComm, 2026, 28, 2029-2035 |
| 7251057 | CIF | C17 H14 N2 O2 | P 1 21/c 1 | 11.954; 7.454; 15.468 90; 95.33; 90 | 1372.3 | Constantin, Ana M.; Mele, Francesco; Botla, Vinayak; Ca', Nicola Della; Maggi, Raimondo; Maestri, Giovanni; Cerveri, Alessandro; Sundermann, Remie M.; Cauzzi, Daniele; Pancrazzi, Francesco; Mazzeo, Paolo P. A deep dive into mechanochemical organic reactions by accurate crystallographic analysis via TAAM refinement CrystEngComm, 2026, 28, 2029-2035 |
| 7251080 | CIF | C10 H3 F5 S | P -1 | 6.4378; 7.2041; 19.8873 94.374; 90.518; 94.324 | 916.94 | Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm, 2026, 28, 390-395 |
| 7251081 | CIF | C19 H23 F5 S Si | P 1 21/n 1 | 8.5617; 19.8126; 11.6723 90; 94.529; 90 | 1973.78 | Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm, 2026, 28, 390-395 |
| 7251082 | CIF | C13 H11 F5 S Si | P c a 21 | 30.7633; 6.8541; 13.4097 90; 90; 90 | 2827.5 | Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm, 2026, 28, 390-395 |
| 7251083 | CIF | C16 H17 F5 S Si | P -1 | 7.453; 7.5747; 17.1723 85.62; 80.227; 61.642 | 840.72 | Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm, 2026, 28, 390-395 |
| 7251237 | CIF | C16 H25 N19 O14 | P -1 | 4.8568; 7.9049; 18.9454 79.632; 87.383; 77.432 | 698.33 | Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua Synthesis of energetic materials derived from hydroxynitropyrazine CrystEngComm, 2026, 28, 163-168 |
| 7251238 | CIF | C4 H9 Li N4 Na O11 | P -1 | 7.8258; 8.446; 10.152 90.324; 100.963; 116.811 | 584.7 | Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua Synthesis of energetic materials derived from hydroxynitropyrazine CrystEngComm, 2026, 28, 163-168 |
| 7251239 | CIF | C20 H15 K9 N20 O38 | P -1 | 8.3085; 16.2606; 18.1267 73.099; 88.41; 86.483 | 2338.63 | Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua Synthesis of energetic materials derived from hydroxynitropyrazine CrystEngComm, 2026, 28, 163-168 |
| 7251248 | CIF | Ca8.61 Cd0.69 La0.82 O28 P7 | R 3 c :H | 10.4631; 10.4631; 37.42078 90; 90; 120 | 3547.84 | Sipina, Elena V.; Zhukovskaya, Evgeniya S.; Morozov, Vladimir A.; Stefanovich, Sergey Yu.; Grebenev, Vadim V.; Belik, Alexei A.; Lazoryak, Bogdan I.; Deyneko, Dina V. β-Ca3(PO4)2-related structure and dielectric properties of Ca8CdLa(PO4)7 CrystEngComm, 2026, 28, 143-151 |
| 7251435 | CIF | C36 H33 Cl Cu N3 O4 P2 | P 1 21/n 1 | 13.1077; 19.8491; 13.2457 90; 96.073; 90 | 3426.9 | Mao, Zhen; Li, Hai-Jian; He, Xue; Liu, Sui-Jun; Wen, He-Rui; He, Li-Hua; Chen, Jing-Lin Tricolor reversible luminescence switching of a mechano-/vapo-chromic mononuclear Cu(i) complex CrystEngComm, 2026, 28, 1877-1882 |
| 7251436 | CIF | C39 H39 Cl Cu N3 O5 P2 | I 1 2/a 1 | 20.8314; 17.0911; 22.858 90; 105.845; 90 | 7828.9 | Mao, Zhen; Li, Hai-Jian; He, Xue; Liu, Sui-Jun; Wen, He-Rui; He, Li-Hua; Chen, Jing-Lin Tricolor reversible luminescence switching of a mechano-/vapo-chromic mononuclear Cu(i) complex CrystEngComm, 2026, 28, 1877-1882 |
| 7251437 | CIF | C14 H8 N2 O8 | P -1 | 5.074; 5.261; 12.385 90.1; 97.94; 95.82 | 325.71 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251438 | CIF | C18.33 H19.09 Mn N3.44 O10.94 | C 1 2/c 1 | 31.934; 4.75; 29.072 90; 99.72; 90 | 4346.5 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251439 | CIF | C20 H20 Ca N4 O10 | P 1 21/c 1 | 13.425; 17.687; 9.629 90; 91.03; 90 | 2286 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251440 | CIF | C16 H14 N2 O9 | C 1 2 1 | 20.7529; 5.6389; 16.0661 90; 118.704; 90 | 1649.07 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251441 | CIF | C18 H16 N2 O8 | P -1 | 5.7316; 6.1988; 12.473 85.726; 80.66; 81.607 | 432.01 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251442 | CIF | C18.45 H19.38 N3.48 O10.98 Zn | C 1 2/c 1 | 32.04; 4.74; 29.17 90; 99.52; 90 | 4369 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251443 | CIF | C38 H34 Co2 N6 O18 | P 1 21 1 | 8.635; 20.581; 12.07 90; 101.8; 90 | 2099.7 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251444 | CIF | C20 H20 Mn N4 O10 | P -1 | 9.88; 10.14; 13.57 84.31; 71.44; 63.63 | 1153.2 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251445 | CIF | C20 H20 Co N4 O10 | P -1 | 9.6362; 10.1021; 13.5166 84.244; 71.817; 63.4 | 1116.56 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251446 | CIF | C17 H13 Cd N3 O9 | P 21 21 21 | 4.79; 15.013; 25.31 90; 90; 90 | 1820.1 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251447 | CIF | C20 H20 Cd N4 O10 | P -1 | 4.973; 9.0826; 12.8166 91.128; 92.195; 94.386 | 576.63 | Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm, 2026, 28, 736-747 |
| 7251448 | CIF | C208 H258 Ag6 N16 O28 S16 Ti6 | P -1 | 21.765; 21.8911; 26.7368 70.548; 77.185; 87.923 | 11702.9 | Han, Qian; Wang, Xiao-Wei; Zhu, Hong-Yan; Li, Lan-Yan; Yu, Wei-Dong; Liu, Chao Anchored Ag+ sites on a thiacalix[4]arene-stabilized Ti-oxo cluster enable efficient CO2-to-CO electroreduction CrystEngComm, 2026, 28, 806-811 |
| 7251449 | CIF | C76 H104 N4 O12 S4 Ti2 | P 1 21/n 1 | 12.8614; 13.3481; 23.7581 90; 91.259; 90 | 4077.7 | Han, Qian; Wang, Xiao-Wei; Zhu, Hong-Yan; Li, Lan-Yan; Yu, Wei-Dong; Liu, Chao Anchored Ag+ sites on a thiacalix[4]arene-stabilized Ti-oxo cluster enable efficient CO2-to-CO electroreduction CrystEngComm, 2026, 28, 806-811 |
| 7251450 | CIF | C22 H22 N2 O4 | P -1 | 5.9187; 8.0533; 10.5862 99.782; 96.732; 102.517 | 479.17 | Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G. Four polymorphic structures of a symmetric azo dye CrystEngComm, 2026, 28, 1781-1790 |
| 7251451 | CIF | C22 H22 N2 O4 | P 1 21/c 1 | 13.4185; 9.8231; 7.2136 90; 90.961; 90 | 950.7 | Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G. Four polymorphic structures of a symmetric azo dye CrystEngComm, 2026, 28, 1781-1790 |
| 7251452 | CIF | C22 H22 N2 O4 | P 21 21 21 | 3.9172; 9.6395; 50.1648 90; 90; 90 | 1894.22 | Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G. Four polymorphic structures of a symmetric azo dye CrystEngComm, 2026, 28, 1781-1790 |
| 7251453 | CIF | C11 H13 N O2 | P n a 21 | 22.6748; 8.4634; 5.3937 90; 90; 90 | 1035.08 | Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G. Four polymorphic structures of a symmetric azo dye CrystEngComm, 2026, 28, 1781-1790 |
| 7251454 | CIF | C11 H11 N O4 | P -1 | 6.9802; 8.0029; 10.9422 69.905; 72.221; 68.201 | 521.8 | Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G. Four polymorphic structures of a symmetric azo dye CrystEngComm, 2026, 28, 1781-1790 |
| 7251455 | CIF | C22 H22 N2 O4 | P 1 21 1 | 8.8556; 10.0594; 21.7173 90; 98.001; 90 | 1915.79 | Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G. Four polymorphic structures of a symmetric azo dye CrystEngComm, 2026, 28, 1781-1790 |
| 7251456 | CIF | C73 H76 Br2 O10 | C 1 c 1 | 11.3658; 25.1078; 22.8023 90; 104.364; 90 | 6303.7 | Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F. Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene CrystEngComm, 2026, 28, 1331-1338 |
| 7251457 | CIF | C71 H72 Br2 O10 | C 1 2/c 1 | 11.1392; 25.2833; 22.6009 90; 103.461; 90 | 6190.4 | Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F. Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene CrystEngComm, 2026, 28, 1331-1338 |
| 7251458 | CIF | C106 H128 Br4 O12 | C 1 2/c 1 | 39.404; 10.6754; 24.3659 90; 107.392; 90 | 9781 | Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F. Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene CrystEngComm, 2026, 28, 1331-1338 |
| 7251459 | CIF | C102 H120 Br4 O12 | C 1 2/c 1 | 38.7491; 10.4816; 23.9295 90; 107.054; 90 | 9291.7 | Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F. Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene CrystEngComm, 2026, 28, 1331-1338 |
| 7251460 | CIF | C22 H34 Cl2 N4 O | P 1 21/c 1 | 7.3871; 17.4215; 18.6866 90; 100.156; 90 | 2367.18 | Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G. 1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions CrystEngComm, 2026, 28, 990-999 |
| 7251461 | CIF | C36 H40 N4 O4 | P -1 | 10.9536; 12.2674; 12.3465 92.853; 98.138; 105.889 | 1572.7 | Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G. 1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions CrystEngComm, 2026, 28, 990-999 |
| 7251462 | CIF | C30 H36 N4 O4 | P n n a | 9.4959; 17.181; 23.879 90; 90; 90 | 3895.8 | Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G. 1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions CrystEngComm, 2026, 28, 990-999 |
| 7251463 | CIF | C74 H80 N8 O8 | P b c n | 30.0803; 26.6383; 26.8475 90; 90; 90 | 21512.6 | Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G. 1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions CrystEngComm, 2026, 28, 990-999 |
| 7251464 | CIF | C101 H100 N8 O16 | I 41/a :2 | 22.70732; 22.70732; 17.5665 90; 90; 90 | 9057.68 | Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G. 1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions CrystEngComm, 2026, 28, 990-999 |
| 7251465 | CIF | C24 H28 N2 O3 | P 1 21 1 | 11.867; 5.9451; 14.816 90; 105.328; 90 | 1008.1 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251466 | CIF | C34 H48 N2 O5 | P -1 | 8.159; 9.147; 23.118 84.592; 81.785; 68.743 | 1589.7 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251467 | CIF | C28 H37 Cl N2 O5 | P -1 | 10.2784; 10.5283; 15.382 76.476; 85.972; 89.973 | 1614.2 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251468 | CIF | C26 H32 N2 O5 | C 1 2/c 1 | 24.2682; 11.0691; 18.7201 90; 97.1082; 90 | 4990.1 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251469 | CIF | C26 H35 N3 O4 | P -1 | 6.923; 9.5568; 20.6857 78.3703; 89.8695; 71.8961 | 1271.46 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251470 | CIF | C24 H32 N2 O5 | P -1 | 6.721; 8.395; 21.299 80.462; 89.652; 80.149 | 1167.4 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251471 | CIF | C26 H34 N2 O5 | P -1 | 7.072; 9.552; 20.43 78.051; 80.463; 69.442 | 1257.7 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251472 | CIF | C28 H36 N2 O7 | P 1 21/n 1 | 17.796; 6.5459; 25.136 90; 109.131; 90 | 2766.4 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251473 | CIF | C26 H33 Br N2 O5 | P n a 21 | 28.4445; 9.0341; 10.3513 90; 90; 90 | 2660 | Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies CrystEngComm, 2026, 28, 1621-1635 |
| 7251474 | CIF | C6 H4 Ag2 N4 O6 S | I 1 2/a 1 | 7.201; 9.608; 15.507 90; 103.18; 90 | 1044.6 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251475 | CIF | C20 H14 Ag Cl N4 O5 Se2 | P -1 | 3.814; 10.3541; 14.2499 92.62; 95.335; 94.139 | 558.06 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251476 | CIF | C28 H22 Ag2 F12 N10 Sb2 Se4 | P 1 21/c 1 | 12.2862; 10.8853; 15.1578 90; 100.846; 90 | 1990.98 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251477 | CIF | C44 H30 Ag2 Cl2 N10 O8 S4 | P -1 | 7.4983; 9.4191; 16.203 91.584; 90.423; 104.261 | 1108.6 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251478 | CIF | C16 H16 Ag Cl N4 O4 Se2 | P -1 | 7.4239; 13.407; 20.291 107.42; 98.47; 93.08 | 1895.7 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251479 | CIF | C6 H4 Ag2 N4 O6 Se | I 1 2/a 1 | 7.1843; 9.6347; 15.7023 90; 102.367; 90 | 1061.67 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251480 | CIF | C10 H6 Ag N3 O3 Se | P 1 2/n 1 | 6.88; 12.017; 6.963 90; 117.27; 90 | 511.7 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251481 | CIF | C14 H11 Ag B F4 N5 Se2 | P -1 | 7.8775; 10.6277; 12.0636 68.86; 88.968; 69.456 | 875.25 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251482 | CIF | C12 H10 Ag B F4 N4 O S2 | P 1 21 1 | 6.9919; 11.3238; 10.4854 90; 106.456; 90 | 796.17 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251483 | CIF | C14 H12 Ag N5 O3 Se2 | P -1 | 7.3648; 9.9357; 11.3068 96.414; 91.408; 104.754 | 793.87 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251484 | CIF | C30 H18 Ag3 N9 O9 S3 | P 1 21/c 1 | 6.7953; 35.947; 13.5656 90; 101.474; 90 | 3247.5 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251485 | CIF | C8 H10 Ag N3 O4 Se | P b c a | 13.3558; 7.1039; 23.5974 90; 90; 90 | 2238.88 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251486 | CIF | C16 H16 Ag N5 O3 Se2 | P 1 21/n 1 | 7.0765; 14.922; 17.437 90; 98.577; 90 | 1820.7 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251487 | CIF | C28 H24 Ag2 N10 O6 Se4 | P 1 21/c 1 | 7.456; 21.169; 11.074 90; 109.36; 90 | 1649 | Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly CrystEngComm, 2026, 28, 1206-1214 |
| 7251488 | CIF | C17 H21 N3 O S | P 1 21/n 1 | 12.7047; 8.0199; 16.4944 90; 105.648; 90 | 1618.33 | Joshi, Kirthi; Sangwan, Shruti; Jose, K. V. Jovan; Agarwal, Vipin.; Nangia, Ashwini K. Solid-state conformations of pharmaceutical polymorphs in solution: validation and invalidation by NMR. CrystEngComm, 2026, 28, 1339-1350 |
| 7251489 | CIF | C17 H21 N3 O S | C 1 c 1 | 13.9971; 16.3389; 7.7318 90; 114.482; 90 | 1609.26 | Joshi, Kirthi; Sangwan, Shruti; Jose, K. V. Jovan; Agarwal, Vipin.; Nangia, Ashwini K. Solid-state conformations of pharmaceutical polymorphs in solution: validation and invalidation by NMR. CrystEngComm, 2026, 28, 1339-1350 |
| 7251490 | CIF | C17 H21 N3 O S | P 21 21 21 | 7.325; 12.993; 16.832 90; 90; 90 | 1602 | Joshi, Kirthi; Sangwan, Shruti; Jose, K. V. Jovan; Agarwal, Vipin.; Nangia, Ashwini K. Solid-state conformations of pharmaceutical polymorphs in solution: validation and invalidation by NMR. CrystEngComm, 2026, 28, 1339-1350 |
| 7251491 | CIF | C12 H11 N9 O4 Zn2 | I 4/m | 12.8268; 12.8268; 25.8853 90; 90; 90 | 4258.8 | Bu, Qiyi; Zhang, Yushu; Wang, Li; Liu, Jiaqi; Wang, Yong; Li, Jinping A triazolate-based MOF with amino-induced triazolate reorientation enabling pore-size regulation for CO2/CH4 separation CrystEngComm, 2026, 28, 1485-1488 |
| 7251492 | CIF | C8 H18 O13 Pb Re2 | P 1 21/c 1 | 7.9684; 28.1002; 7.9792 90; 100.755; 90 | 1755.27 | Charkin, Dmitri; Grishaev, Vasili; Kireev, Vadim; Volkov, Sergey; Arsent'ev, Maxim; Vorobiev, Stepan; Gosteva, Alevtina; Kompanchenko, Alena; Khasanov, Kirill; Krzhizhanovskaya, Maria; Aksenov, Sergey; Petříček, Václav The first lead perrhenate crown ether complex [Pb(12-crown-4)(H2O)(ReO4)2]: from rotation of the ReO4 tetrahedra in the (3 + 1)D space using constrained Legendre functions to rotation in the 3D space CrystEngComm, 2026, 28, 1000-1007 |
| 7251493 | CIF | C13 H21 N2 O6 | P -1 | 7.8703; 9.391; 11.0106 72.161; 78.64; 84.085 | 758.69 | Zhang, Jing; Feng, Yi; Cao, Yun-Dong; Fan, Lin-Lin; Lv, Cai-Li; Cheng, Lei; Gao, Guang-Gang; Liu, Hong Solvated pyromellitic acid-modified separator for stable lithium metal anodes and high-performance Li–S batteries CrystEngComm, 2026, 28, 1135-1146 |
| 7251494 | CIF | C10 H11 F2 N O | P 21 21 21 | 5.1128; 6.7751; 27.331 90; 90; 90 | 946.7 | Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments CrystEngComm, 2026, 28, 1494-1507 |
| 7251495 | CIF | C10 H11 F2 N O | P -1 | 5.1799; 9.618; 10.442 81.822; 80.772; 74.442 | 492 | Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments CrystEngComm, 2026, 28, 1494-1507 |
| 7251496 | CIF | C10 H11 F2 N O | P c a 21 | 12.0624; 9.4612; 8.6588 90; 90; 90 | 988.18 | Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments CrystEngComm, 2026, 28, 1494-1507 |
| 7251497 | CIF | C20 H22 F4 N2 O2 | P 1 21/n 1 | 9.51; 11.0959; 19.198 90; 102.991; 90 | 1974 | Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments CrystEngComm, 2026, 28, 1494-1507 |
| 7251498 | CIF | C8 H13 N O6 S | P 21 21 21 | 6.8391; 11.2218; 13.7253 90; 90; 90 | 1053.38 | García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study CrystEngComm, 2026, 28, 951-961 |
| 7251499 | CIF | C22 H34 Cl2 Cu N6 O8 | P -1 | 8.1875; 8.7569; 9.8704 94.856; 103.393; 103.024 | 663.7 | García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study CrystEngComm, 2026, 28, 951-961 |
| 7251500 | CIF | C7.33 H11.33 Cl0.67 N2 O2.33 | C 1 2/c 1 | 51.723; 7.3982; 13.4262 90; 97.297; 90 | 5096 | García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study CrystEngComm, 2026, 28, 951-961 |
| 7251501 | CIF | C12 H17 N3 O6 | P -1 | 7.0597; 8.8765; 11.2263 89.195; 88.506; 68.574 | 654.65 | García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study CrystEngComm, 2026, 28, 951-961 |
| 7251502 | CIF | C10 H10 Br2 Cl5 I2 N2 Sb | P 1 21/n 1 | 14.9208; 7.0913; 20.9159 90; 97.395; 90 | 2194.66 | Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Adonin, Sergey A. Supramolecular diiodo-chlorometalates(iii) of group 15 elements with halogen-substituted pyridiniums: an interplay of cation⋯anion and I2⋯halometalate halogen bonds CrystEngComm, 2026, 28, 1197-1205 |
| 7251503 | CIF | C10 H10 Cl7 I2 N2 Sb | P 1 21/n 1 | 14.5435; 7.1608; 20.82 90; 96.131; 90 | 2155.86 | Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Adonin, Sergey A. Supramolecular diiodo-chlorometalates(iii) of group 15 elements with halogen-substituted pyridiniums: an interplay of cation⋯anion and I2⋯halometalate halogen bonds CrystEngComm, 2026, 28, 1197-1205 |
| 7251504 | CIF | C10 H10 Bi Br2 Cl5 I2 N2 | P 1 21/n 1 | 14.89; 7.1531; 20.9598 90; 98.109; 90 | 2210.1 | Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Adonin, Sergey A. Supramolecular diiodo-chlorometalates(iii) of group 15 elements with halogen-substituted pyridiniums: an interplay of cation⋯anion and I2⋯halometalate halogen bonds CrystEngComm, 2026, 28, 1197-1205 |
| 7251505 | CIF | C10 H10 Bi Cl7 I2 N2 | P 1 21/n 1 | 14.5781; 7.2057; 20.8721 90; 97.312; 90 | 2174.69 | Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Adonin, Sergey A. Supramolecular diiodo-chlorometalates(iii) of group 15 elements with halogen-substituted pyridiniums: an interplay of cation⋯anion and I2⋯halometalate halogen bonds CrystEngComm, 2026, 28, 1197-1205 |
| 7251506 | CIF | C19 H21 Cd2 Cl4 N5 O | P 1 21/n 1 | 14.665; 10.8323; 15.619 90; 105.691; 90 | 2388.7 | Liu, Tong; Jing, Xue-Mei; Chen, Jia-Li; Ding, Xue-Yao; Han, Song-De; Xue, Zhen-Zhen; Huang, Hong-Hua; Pan, Jie Room temperature phosphorescence and photochromism in a series of pyridine-based hybrid compounds CrystEngComm, 2026, 28, 748-761 |
| 7251507 | CIF | C30 H24 Cd3 Cl6 N8 | P 1 21/c 1 | 10.201; 9.3121; 18.5118 90; 98.526; 90 | 1739.05 | Liu, Tong; Jing, Xue-Mei; Chen, Jia-Li; Ding, Xue-Yao; Han, Song-De; Xue, Zhen-Zhen; Huang, Hong-Hua; Pan, Jie Room temperature phosphorescence and photochromism in a series of pyridine-based hybrid compounds CrystEngComm, 2026, 28, 748-761 |
| 7251508 | CIF | C19 H21 Cd N7 O7 | P 1 21/c 1 | 27.4056; 10.3739; 16.0893 90; 93.455; 90 | 4565.9 | Liu, Tong; Jing, Xue-Mei; Chen, Jia-Li; Ding, Xue-Yao; Han, Song-De; Xue, Zhen-Zhen; Huang, Hong-Hua; Pan, Jie Room temperature phosphorescence and photochromism in a series of pyridine-based hybrid compounds CrystEngComm, 2026, 28, 748-761 |
| 7251509 | CIF | C18 H19 Cd N7 O7 | P b c a | 10.3394; 15.8855; 27.2314 90; 90; 90 | 4472.66 | Liu, Tong; Jing, Xue-Mei; Chen, Jia-Li; Ding, Xue-Yao; Han, Song-De; Xue, Zhen-Zhen; Huang, Hong-Hua; Pan, Jie Room temperature phosphorescence and photochromism in a series of pyridine-based hybrid compounds CrystEngComm, 2026, 28, 748-761 |
| 7251510 | CIF | C5 H5 O6 Zn | P 1 21/n 1 | 5.2167; 16.333; 8.1547 90; 98.052; 90 | 688 | Vakil, Farhat; Aldauij, Omar K.; Afzal, Asif; Kumar, Manjeet; Ansari, Azaj; Shahid, M.; Abdelrahman, Ehab A. A Zn-based MOF with honeycomb topology for highly efficient iodine uptake from vapor and liquid phases: synthesis, crystal structure, topology and dual-phase sorption performance CrystEngComm, 2026, 28, 1147-1162 |
| 7251511 | CIF | C43 H34 N6 O7 | P -1 | 9.6784; 10.806; 17.5157 77.538; 78.893; 78.392 | 1730.68 | Wzgarda-Raj, Kinga Supramolecular interactions and aromaticity in phenazine–hydroxybenzoic acid co-crystals CrystEngComm, 2026, 28, 1791-1800 |
| 7251512 | CIF | C69 H50 N8 O9 | P -1 | 8.6222; 16.8759; 20.4571 69.73; 83.52; 80.248 | 2747.24 | Wzgarda-Raj, Kinga Supramolecular interactions and aromaticity in phenazine–hydroxybenzoic acid co-crystals CrystEngComm, 2026, 28, 1791-1800 |
| 7251513 | CIF | C7 H10 N4 O4 | P 1 21/c 1 | 5.854; 16.7182; 9.2006 90; 101.171; 90 | 883.39 | Churakov, Andrei V.; Mikhaylov, Alexey A.; Mel'nik, Elena A.; Egorov, Pavel A.; Lev, Ovadia; Medvedev, Alexander G.; Prikhodchenko, Petr V. Peroxosolvates of purine derivatives: structural insights into possible H2O2-purine interactions in biological systems CrystEngComm, 2026, 28, 1115-1124 |
| 7251514 | CIF | C7 H10 N4 O4 | P b c a | 13.6261; 7.1632; 18.3896 90; 90; 90 | 1794.94 | Churakov, Andrei V.; Mikhaylov, Alexey A.; Mel'nik, Elena A.; Egorov, Pavel A.; Lev, Ovadia; Medvedev, Alexander G.; Prikhodchenko, Petr V. Peroxosolvates of purine derivatives: structural insights into possible H2O2-purine interactions in biological systems CrystEngComm, 2026, 28, 1115-1124 |
| 7251515 | CIF | C10 H14 N8 O8 | P -1 | 7.2682; 7.4476; 15.3478 89.808; 77.703; 65.604 | 735.9 | Churakov, Andrei V.; Mikhaylov, Alexey A.; Mel'nik, Elena A.; Egorov, Pavel A.; Lev, Ovadia; Medvedev, Alexander G.; Prikhodchenko, Petr V. Peroxosolvates of purine derivatives: structural insights into possible H2O2-purine interactions in biological systems CrystEngComm, 2026, 28, 1115-1124 |
| 7251516 | CIF | C10 H10 N8 O4 | P -1 | 6.2828; 7.0513; 14.9231 85.761; 88.382; 65.266 | 598.83 | Churakov, Andrei V.; Mikhaylov, Alexey A.; Mel'nik, Elena A.; Egorov, Pavel A.; Lev, Ovadia; Medvedev, Alexander G.; Prikhodchenko, Petr V. Peroxosolvates of purine derivatives: structural insights into possible H2O2-purine interactions in biological systems CrystEngComm, 2026, 28, 1115-1124 |
| 7251517 | CIF | C12 H15 N5 O4 | P 1 21/c 1 | 20.1096; 6.5746; 20.4108 90; 102.085; 90 | 2638.76 | Churakov, Andrei V.; Mikhaylov, Alexey A.; Mel'nik, Elena A.; Egorov, Pavel A.; Lev, Ovadia; Medvedev, Alexander G.; Prikhodchenko, Petr V. Peroxosolvates of purine derivatives: structural insights into possible H2O2-purine interactions in biological systems CrystEngComm, 2026, 28, 1115-1124 |
| 7251518 | CIF | C84 H68 Cd3 N2 O16 | C 1 c 1 | 46.4009; 6.3419; 22.613 90; 91.963; 90 | 6650.4 | Luo, Yuqian; Lu, Yongyang; Wu, Ziqiang; Ye, Chunyin; Zhang, ChuanLei Flexible-functionalized Cd-MOFs for photocatalytic CO2 reduction: tuning framework flexibility via ligand design CrystEngComm, 2026, 28, 912-918 |
| 7251519 | CIF | C4 H14 Cu N12 O8 | P 1 21/n 1 | 8.3514; 8.029; 10.685 90; 102.056; 90 | 700.66 | Yang, Feng; He, Zhiwei; Zhang, Rongzheng; Wang, Quan MOFs with hydrazide and 3-amino-1,2,4-oxadiazole-substituted hydroxytetrazole as novel nitrogen-rich ligands: a new class of energetic materials for ammonium perchlorate decomposition catalysis CrystEngComm, 2026, 28, 1931-1937 |
| 7251520 | CIF | C3 H2 Ag N7 O2 | P 1 21/n 1 | 4.8266; 21.9823; 6.3898 90; 106.562; 90 | 649.83 | Yang, Feng; He, Zhiwei; Zhang, Rongzheng; Wang, Quan MOFs with hydrazide and 3-amino-1,2,4-oxadiazole-substituted hydroxytetrazole as novel nitrogen-rich ligands: a new class of energetic materials for ammonium perchlorate decomposition catalysis CrystEngComm, 2026, 28, 1931-1937 |
| 7251521 | CIF | C6 H12 Cu N14 O8 | P 1 21/c 1 | 8.0601; 9.1901; 10.8846 90; 91.301; 90 | 806.05 | Yang, Feng; He, Zhiwei; Zhang, Rongzheng; Wang, Quan MOFs with hydrazide and 3-amino-1,2,4-oxadiazole-substituted hydroxytetrazole as novel nitrogen-rich ligands: a new class of energetic materials for ammonium perchlorate decomposition catalysis CrystEngComm, 2026, 28, 1931-1937 |
| 7251522 | CIF | C2 H3 Ag N6 O2 | P 1 21/n 1 | 4.8588; 8.3454; 13.9313 90; 93.658; 90 | 563.74 | Yang, Feng; He, Zhiwei; Zhang, Rongzheng; Wang, Quan MOFs with hydrazide and 3-amino-1,2,4-oxadiazole-substituted hydroxytetrazole as novel nitrogen-rich ligands: a new class of energetic materials for ammonium perchlorate decomposition catalysis CrystEngComm, 2026, 28, 1931-1937 |
| 7251523 | CIF | C13 H18 Cl N13 O7 Pb2 S2 | P -1 | 9.7827; 11.0949; 12.8327 64.981; 77.088; 85.954 | 1229.78 | Mahmoudi, Ghodrat; Garcia-Santos, Isabel; Iglesias-Pereiro, Tamara; Castiñeiras, Alfonso; Gurbanov, Atash V.; Tutar, Ömer Faruk; Zangrando, Ennio; Panova, Elizaveta V.; Frontera, Antonio; Safin, Damir A. A lead(ii) supramolecular coordination polymer, obtained from polydonor N′-(amino(pyrazin-2-yl)methylene)thiosemicarbazide, stabilized by tetrel bonds and other non-covalent interactions CrystEngComm, 2026, 28, 1383-1393 |
| 7251524 | CIF | C23 H42 N7 Ni O19 P | P 1 | 6.9004; 10.0094; 13.4169 69.587; 85.819; 89.459 | 866.06 | Lv, Jialin; Shan, Penghua; Lan, Ruoning; Zhu, Yirui; Hu, Qian; Li, Zhongkui; Han, Ju; Lian, Zeyu; Zhu, Yanhong Controllable construction of base pairing and chirality study in supramolecular assemblies based on guanine nucleotides CrystEngComm, 2026, 28, 1286-1298 |
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