Crystallography Open Database
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Searching journal of publication like 'CrystEngComm' volume of publication is 28
| COD ID: 7251080 | |
| CIF file | Formula: - C10 H3 F5 S - Comments: Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm 28(2) (2026) 390-395 Space group: P -1 Cell volume: 916.94 Cell parameters: 6.4378; 7.2041; 19.8873; 94.374; 90.518; 94.324; |
| COD ID: 7251081 | |
| CIF file | Formula: - C19 H23 F5 S Si - Comments: Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm 28(2) (2026) 390-395 Space group: P 1 21/n 1 Cell volume: 1973.78 Cell parameters: 8.5617; 19.8126; 11.6723; 90; 94.529; 90; |
| COD ID: 7251082 | |
| CIF file | Formula: - C13 H11 F5 S Si - Comments: Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm 28(2) (2026) 390-395 Space group: P c a 21 Cell volume: 2827.5 Cell parameters: 30.7633; 6.8541; 13.4097; 90; 90; 90; |
| COD ID: 7251083 | |
| CIF file | Formula: - C16 H17 F5 S Si - Comments: Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene CrystEngComm 28(2) (2026) 390-395 Space group: P -1 Cell volume: 840.72 Cell parameters: 7.453; 7.5747; 17.1723; 85.62; 80.227; 61.642; |
| COD ID: 7251237 | |
| CIF file | Formula: - C16 H25 N19 O14 - Comments: Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua Synthesis of energetic materials derived from hydroxynitropyrazine CrystEngComm 28(1) (2026) 163-168 Space group: P -1 Cell volume: 698.33 Cell parameters: 4.8568; 7.9049; 18.9454; 79.632; 87.383; 77.432; |
| COD ID: 7251238 | |
| CIF file | Formula: - C4 H9 Li N4 Na O11 - Comments: Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua Synthesis of energetic materials derived from hydroxynitropyrazine CrystEngComm 28(1) (2026) 163-168 Space group: P -1 Cell volume: 584.7 Cell parameters: 7.8258; 8.446; 10.152; 90.324; 100.963; 116.811; |
| COD ID: 7251239 | |
| CIF file | Formula: - C20 H15 K9 N20 O38 - Comments: Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua Synthesis of energetic materials derived from hydroxynitropyrazine CrystEngComm 28(1) (2026) 163-168 Space group: P -1 Cell volume: 2338.63 Cell parameters: 8.3085; 16.2606; 18.1267; 73.099; 88.41; 86.483; |
| COD ID: 7251248 | |
| CIF file | Formula: - Ca8.61 Cd0.69 La0.82 O28 P7 - Comments: 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 28(1) (2026) 143-151 Space group: R 3 c :H Cell volume: 3547.84 Cell parameters: 10.4631; 10.4631; 37.42078; 90; 90; 120; |
| COD ID: 7251437 | |
| CIF file | Formula: - C14 H8 N2 O8 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P -1 Cell volume: 325.71 Cell parameters: 5.074; 5.261; 12.385; 90.1; 97.94; 95.82; |
| COD ID: 7251438 | |
| CIF file | Formula: - C18.33 H19.09 Mn N3.44 O10.94 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: C 1 2/c 1 Cell volume: 4346.5 Cell parameters: 31.934; 4.75; 29.072; 90; 99.72; 90; |
| COD ID: 7251439 | |
| CIF file | Formula: - C20 H20 Ca N4 O10 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P 1 21/c 1 Cell volume: 2286 Cell parameters: 13.425; 17.687; 9.629; 90; 91.03; 90; |
| COD ID: 7251440 | |
| CIF file | Formula: - C16 H14 N2 O9 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: C 1 2 1 Cell volume: 1649.07 Cell parameters: 20.7529; 5.6389; 16.0661; 90; 118.704; 90; |
| COD ID: 7251441 | |
| CIF file | Formula: - C18 H16 N2 O8 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P -1 Cell volume: 432.01 Cell parameters: 5.7316; 6.1988; 12.473; 85.726; 80.66; 81.607; |
| COD ID: 7251442 | |
| CIF file | Formula: - C18.45 H19.38 N3.48 O10.98 Zn - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: C 1 2/c 1 Cell volume: 4369 Cell parameters: 32.04; 4.74; 29.17; 90; 99.52; 90; |
| COD ID: 7251443 | |
| CIF file | Formula: - C38 H34 Co2 N6 O18 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P 1 21 1 Cell volume: 2099.7 Cell parameters: 8.635; 20.581; 12.07; 90; 101.8; 90; |
| COD ID: 7251444 | |
| CIF file | Formula: - C20 H20 Mn N4 O10 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P -1 Cell volume: 1153.2 Cell parameters: 9.88; 10.14; 13.57; 84.31; 71.44; 63.63; |
| COD ID: 7251445 | |
| CIF file | Formula: - C20 H20 Co N4 O10 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P -1 Cell volume: 1116.56 Cell parameters: 9.6362; 10.1021; 13.5166; 84.244; 71.817; 63.4; |
| COD ID: 7251446 | |
| CIF file | Formula: - C17 H13 Cd N3 O9 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P 21 21 21 Cell volume: 1820.1 Cell parameters: 4.79; 15.013; 25.31; 90; 90; 90; |
| COD ID: 7251447 | |
| CIF file | Formula: - C20 H20 Cd N4 O10 - Comments: Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R. Conformational preferences of diimide-based dicarboxylate species and their coordination polymers CrystEngComm 28(3) (2026) 736-747 Space group: P -1 Cell volume: 576.63 Cell parameters: 4.973; 9.0826; 12.8166; 91.128; 92.195; 94.386; |
| COD ID: 7251448 | |
| CIF file | Formula: - C208 H258 Ag6 N16 O28 S16 Ti6 - Comments: 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 28(4) (2026) 806-811 Space group: P -1 Cell volume: 11702.9 Cell parameters: 21.765; 21.8911; 26.7368; 70.548; 77.185; 87.923; |
| COD ID: 7251449 | |
| CIF file | Formula: - C76 H104 N4 O12 S4 Ti2 - Comments: 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 28(4) (2026) 806-811 Space group: P 1 21/n 1 Cell volume: 4077.7 Cell parameters: 12.8614; 13.3481; 23.7581; 90; 91.259; 90; |
| COD ID: 7251456 | |
| CIF file | Formula: - C73 H76 Br2 O10 - Comments: 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 28(8) (2026) 1331-1338 Space group: C 1 c 1 Cell volume: 6303.7 Cell parameters: 11.3658; 25.1078; 22.8023; 90; 104.364; 90; |
| COD ID: 7251457 | |
| CIF file | Formula: - C71 H72 Br2 O10 - Comments: 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 28(8) (2026) 1331-1338 Space group: C 1 2/c 1 Cell volume: 6190.4 Cell parameters: 11.1392; 25.2833; 22.6009; 90; 103.461; 90; |
| COD ID: 7251458 | |
| CIF file | Formula: - C106 H128 Br4 O12 - Comments: 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 28(8) (2026) 1331-1338 Space group: C 1 2/c 1 Cell volume: 9781 Cell parameters: 39.404; 10.6754; 24.3659; 90; 107.392; 90; |
| COD ID: 7251459 | |
| CIF file | Formula: - C102 H120 Br4 O12 - Comments: 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 28(8) (2026) 1331-1338 Space group: C 1 2/c 1 Cell volume: 9291.7 Cell parameters: 38.7491; 10.4816; 23.9295; 90; 107.054; 90; |
| COD ID: 7251460 | |
| CIF file | Formula: - C22 H34 Cl2 N4 O - Comments: 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 28(5) (2026) 990-999 Space group: P 1 21/c 1 Cell volume: 2367.18 Cell parameters: 7.3871; 17.4215; 18.6866; 90; 100.156; 90; |
| COD ID: 7251461 | |
| CIF file | Formula: - C36 H40 N4 O4 - Comments: 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 28(5) (2026) 990-999 Space group: P -1 Cell volume: 1572.7 Cell parameters: 10.9536; 12.2674; 12.3465; 92.853; 98.138; 105.889; |
| COD ID: 7251462 | |
| CIF file | Formula: - C30 H36 N4 O4 - Comments: 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 28(5) (2026) 990-999 Space group: P n n a Cell volume: 3895.8 Cell parameters: 9.4959; 17.181; 23.879; 90; 90; 90; |
| COD ID: 7251463 | |
| CIF file | Formula: - C74 H80 N8 O8 - Comments: 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 28(5) (2026) 990-999 Space group: P b c n Cell volume: 21512.6 Cell parameters: 30.0803; 26.6383; 26.8475; 90; 90; 90; |
| COD ID: 7251464 | |
| CIF file | Formula: - C101 H100 N8 O16 - Comments: 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 28(5) (2026) 990-999 Space group: I 41/a :2 Cell volume: 9057.68 Cell parameters: 22.70732; 22.70732; 17.5665; 90; 90; 90; |
| COD ID: 7251474 | |
| CIF file | Formula: - C6 H4 Ag2 N4 O6 S - Comments: 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 28(7) (2026) 1206-1214 Space group: I 1 2/a 1 Cell volume: 1044.6 Cell parameters: 7.201; 9.608; 15.507; 90; 103.18; 90; |
| COD ID: 7251475 | |
| CIF file | Formula: - C20 H14 Ag Cl N4 O5 Se2 - Comments: 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 28(7) (2026) 1206-1214 Space group: P -1 Cell volume: 558.06 Cell parameters: 3.814; 10.3541; 14.2499; 92.62; 95.335; 94.139; |
| COD ID: 7251476 | |
| CIF file | Formula: - C28 H22 Ag2 F12 N10 Sb2 Se4 - Comments: 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 28(7) (2026) 1206-1214 Space group: P 1 21/c 1 Cell volume: 1990.98 Cell parameters: 12.2862; 10.8853; 15.1578; 90; 100.846; 90; |
| COD ID: 7251477 | |
| CIF file | Formula: - C44 H30 Ag2 Cl2 N10 O8 S4 - Comments: 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 28(7) (2026) 1206-1214 Space group: P -1 Cell volume: 1108.6 Cell parameters: 7.4983; 9.4191; 16.203; 91.584; 90.423; 104.261; |
| COD ID: 7251478 | |
| CIF file | Formula: - C16 H16 Ag Cl N4 O4 Se2 - Comments: 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 28(7) (2026) 1206-1214 Space group: P -1 Cell volume: 1895.7 Cell parameters: 7.4239; 13.407; 20.291; 107.42; 98.47; 93.08; |
| COD ID: 7251479 | |
| CIF file | Formula: - C6 H4 Ag2 N4 O6 Se - Comments: 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 28(7) (2026) 1206-1214 Space group: I 1 2/a 1 Cell volume: 1061.67 Cell parameters: 7.1843; 9.6347; 15.7023; 90; 102.367; 90; |
| COD ID: 7251480 | |
| CIF file | Formula: - C10 H6 Ag N3 O3 Se - Comments: 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 28(7) (2026) 1206-1214 Space group: P 1 2/n 1 Cell volume: 511.7 Cell parameters: 6.88; 12.017; 6.963; 90; 117.27; 90; |
| COD ID: 7251481 | |
| CIF file | Formula: - C14 H11 Ag B F4 N5 Se2 - Comments: 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 28(7) (2026) 1206-1214 Space group: P -1 Cell volume: 875.25 Cell parameters: 7.8775; 10.6277; 12.0636; 68.86; 88.968; 69.456; |
| COD ID: 7251482 | |
| CIF file | Formula: - C12 H10 Ag B F4 N4 O S2 - Comments: 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 28(7) (2026) 1206-1214 Space group: P 1 21 1 Cell volume: 796.17 Cell parameters: 6.9919; 11.3238; 10.4854; 90; 106.456; 90; |
| COD ID: 7251483 | |
| CIF file | Formula: - C14 H12 Ag N5 O3 Se2 - Comments: 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 28(7) (2026) 1206-1214 Space group: P -1 Cell volume: 793.87 Cell parameters: 7.3648; 9.9357; 11.3068; 96.414; 91.408; 104.754; |
| COD ID: 7251484 | |
| CIF file | Formula: - C30 H18 Ag3 N9 O9 S3 - Comments: 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 28(7) (2026) 1206-1214 Space group: P 1 21/c 1 Cell volume: 3247.5 Cell parameters: 6.7953; 35.947; 13.5656; 90; 101.474; 90; |
| COD ID: 7251485 | |
| CIF file | Formula: - C8 H10 Ag N3 O4 Se - Comments: 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 28(7) (2026) 1206-1214 Space group: P b c a Cell volume: 2238.88 Cell parameters: 13.3558; 7.1039; 23.5974; 90; 90; 90; |
| COD ID: 7251486 | |
| CIF file | Formula: - C16 H16 Ag N5 O3 Se2 - Comments: 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 28(7) (2026) 1206-1214 Space group: P 1 21/n 1 Cell volume: 1820.7 Cell parameters: 7.0765; 14.922; 17.437; 90; 98.577; 90; |
| COD ID: 7251487 | |
| CIF file | Formula: - C28 H24 Ag2 N10 O6 Se4 - Comments: 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 28(7) (2026) 1206-1214 Space group: P 1 21/c 1 Cell volume: 1649 Cell parameters: 7.456; 21.169; 11.074; 90; 109.36; 90; |
| COD ID: 7251488 | |
| CIF file | Formula: - C17 H21 N3 O S - Comments: 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 28(8) (2026) 1339-1350 Space group: P 1 21/n 1 Cell volume: 1618.33 Cell parameters: 12.7047; 8.0199; 16.4944; 90; 105.648; 90; |
| COD ID: 7251489 | |
| CIF file | Formula: - C17 H21 N3 O S - Comments: 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 28(8) (2026) 1339-1350 Space group: C 1 c 1 Cell volume: 1609.26 Cell parameters: 13.9971; 16.3389; 7.7318; 90; 114.482; 90; |
| COD ID: 7251490 | |
| CIF file | Formula: - C17 H21 N3 O S - Comments: 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 28(8) (2026) 1339-1350 Space group: P 21 21 21 Cell volume: 1602 Cell parameters: 7.325; 12.993; 16.832; 90; 90; 90; |
| COD ID: 7251491 | |
| CIF file | Formula: - C12 H11 N9 O4 Zn2 - Comments: 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 28(9) (2026) 1485-1488 Space group: I 4/m Cell volume: 4258.8 Cell parameters: 12.8268; 12.8268; 25.8853; 90; 90; 90; |
| COD ID: 7251492 | |
| CIF file | Formula: - C8 H18 O13 Pb Re2 - Comments: 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 28(5) (2026) 1000-1007 Space group: P 1 21/c 1 Cell volume: 1755.27 Cell parameters: 7.9684; 28.1002; 7.9792; 90; 100.755; 90; |
| COD ID: 7251493 | |
| CIF file | Formula: - C13 H21 N2 O6 - Comments: 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 28(6) (2026) 1135-1146 Space group: P -1 Cell volume: 758.69 Cell parameters: 7.8703; 9.391; 11.0106; 72.161; 78.64; 84.085; |
| COD ID: 7251494 | |
| CIF file | Formula: - C10 H11 F2 N O - Comments: 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 28(9) (2026) 1494-1507 Space group: P 21 21 21 Cell volume: 946.7 Cell parameters: 5.1128; 6.7751; 27.331; 90; 90; 90; |
| COD ID: 7251495 | |
| CIF file | Formula: - C10 H11 F2 N O - Comments: 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 28(9) (2026) 1494-1507 Space group: P -1 Cell volume: 492 Cell parameters: 5.1799; 9.618; 10.442; 81.822; 80.772; 74.442; |
| COD ID: 7251496 | |
| CIF file | Formula: - C10 H11 F2 N O - Comments: 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 28(9) (2026) 1494-1507 Space group: P c a 21 Cell volume: 988.18 Cell parameters: 12.0624; 9.4612; 8.6588; 90; 90; 90; |
| COD ID: 7251497 | |
| CIF file | Formula: - C20 H22 F4 N2 O2 - Comments: 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 28(9) (2026) 1494-1507 Space group: P 1 21/n 1 Cell volume: 1974 Cell parameters: 9.51; 11.0959; 19.198; 90; 102.991; 90; |
| COD ID: 7251498 | |
| CIF file | Formula: - C8 H13 N O6 S - Comments: 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 28(5) (2026) 951-961 Space group: P 21 21 21 Cell volume: 1053.38 Cell parameters: 6.8391; 11.2218; 13.7253; 90; 90; 90; |
| COD ID: 7251499 | |
| CIF file | Formula: - C22 H34 Cl2 Cu N6 O8 - Comments: 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 28(5) (2026) 951-961 Space group: P -1 Cell volume: 663.7 Cell parameters: 8.1875; 8.7569; 9.8704; 94.856; 103.393; 103.024; |
| COD ID: 7251500 | |
| CIF file | Formula: - C7.33 H11.33 Cl0.67 N2 O2.33 - Comments: 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 28(5) (2026) 951-961 Space group: C 1 2/c 1 Cell volume: 5096 Cell parameters: 51.723; 7.3982; 13.4262; 90; 97.297; 90; |
| COD ID: 7251501 | |
| CIF file | Formula: - C12 H17 N3 O6 - Comments: 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 28(5) (2026) 951-961 Space group: P -1 Cell volume: 654.65 Cell parameters: 7.0597; 8.8765; 11.2263; 89.195; 88.506; 68.574; |
| COD ID: 7251502 | |
| CIF file | Formula: - C10 H10 Br2 Cl5 I2 N2 Sb - Comments: 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 28(7) (2026) 1197-1205 Space group: P 1 21/n 1 Cell volume: 2194.66 Cell parameters: 14.9208; 7.0913; 20.9159; 90; 97.395; 90; |
| COD ID: 7251503 | |
| CIF file | Formula: - C10 H10 Cl7 I2 N2 Sb - Comments: 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 28(7) (2026) 1197-1205 Space group: P 1 21/n 1 Cell volume: 2155.86 Cell parameters: 14.5435; 7.1608; 20.82; 90; 96.131; 90; |
| COD ID: 7251504 | |
| CIF file | Formula: - C10 H10 Bi Br2 Cl5 I2 N2 - Comments: 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 28(7) (2026) 1197-1205 Space group: P 1 21/n 1 Cell volume: 2210.1 Cell parameters: 14.89; 7.1531; 20.9598; 90; 98.109; 90; |
| COD ID: 7251505 | |
| CIF file | Formula: - C10 H10 Bi Cl7 I2 N2 - Comments: 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 28(7) (2026) 1197-1205 Space group: P 1 21/n 1 Cell volume: 2174.69 Cell parameters: 14.5781; 7.2057; 20.8721; 90; 97.312; 90; |
| COD ID: 7251506 | |
| CIF file | Formula: - C19 H21 Cd2 Cl4 N5 O - Comments: 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 28(3) (2026) 748-761 Space group: P 1 21/n 1 Cell volume: 2388.7 Cell parameters: 14.665; 10.8323; 15.619; 90; 105.691; 90; |
| COD ID: 7251507 | |
| CIF file | Formula: - C30 H24 Cd3 Cl6 N8 - Comments: 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 28(3) (2026) 748-761 Space group: P 1 21/c 1 Cell volume: 1739.05 Cell parameters: 10.201; 9.3121; 18.5118; 90; 98.526; 90; |
| COD ID: 7251508 | |
| CIF file | Formula: - C19 H21 Cd N7 O7 - Comments: 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 28(3) (2026) 748-761 Space group: P 1 21/c 1 Cell volume: 4565.9 Cell parameters: 27.4056; 10.3739; 16.0893; 90; 93.455; 90; |
| COD ID: 7251509 | |
| CIF file | Formula: - C18 H19 Cd N7 O7 - Comments: 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 28(3) (2026) 748-761 Space group: P b c a Cell volume: 4472.66 Cell parameters: 10.3394; 15.8855; 27.2314; 90; 90; 90; |
| COD ID: 7251510 | |
| CIF file | Formula: - C5 H5 O6 Zn - Comments: 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 28(6) (2026) 1147-1162 Space group: P 1 21/n 1 Cell volume: 688 Cell parameters: 5.2167; 16.333; 8.1547; 90; 98.052; 90; |
| COD ID: 7251513 | |
| CIF file | Formula: - C7 H10 N4 O4 - Comments: 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 28(6) (2026) 1115-1124 Space group: P 1 21/c 1 Cell volume: 883.39 Cell parameters: 5.854; 16.7182; 9.2006; 90; 101.171; 90; |
| COD ID: 7251514 | |
| CIF file | Formula: - C7 H10 N4 O4 - Comments: 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 28(6) (2026) 1115-1124 Space group: P b c a Cell volume: 1794.94 Cell parameters: 13.6261; 7.1632; 18.3896; 90; 90; 90; |
| COD ID: 7251515 | |
| CIF file | Formula: - C10 H14 N8 O8 - Comments: 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 28(6) (2026) 1115-1124 Space group: P -1 Cell volume: 735.9 Cell parameters: 7.2682; 7.4476; 15.3478; 89.808; 77.703; 65.604; |
| COD ID: 7251516 | |
| CIF file | Formula: - C10 H10 N8 O4 - Comments: 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 28(6) (2026) 1115-1124 Space group: P -1 Cell volume: 598.83 Cell parameters: 6.2828; 7.0513; 14.9231; 85.761; 88.382; 65.266; |
| COD ID: 7251517 | |
| CIF file | Formula: - C12 H15 N5 O4 - Comments: 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 28(6) (2026) 1115-1124 Space group: P 1 21/c 1 Cell volume: 2638.76 Cell parameters: 20.1096; 6.5746; 20.4108; 90; 102.085; 90; |
| COD ID: 7251518 | |
| CIF file | Formula: - C84 H68 Cd3 N2 O16 - Comments: 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 28(4) (2026) 912-918 Space group: C 1 c 1 Cell volume: 6650.4 Cell parameters: 46.4009; 6.3419; 22.613; 90; 91.963; 90; |
| COD ID: 7251523 | |
| CIF file | Formula: - C13 H18 Cl N13 O7 Pb2 S2 - Comments: 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 28(8) (2026) 1383-1393 Space group: P -1 Cell volume: 1229.78 Cell parameters: 9.7827; 11.0949; 12.8327; 64.981; 77.088; 85.954; |
| COD ID: 7251524 | |
| CIF file | Formula: - C23 H42 N7 Ni O19 P - Comments: 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 28(7) (2026) 1286-1298 Space group: P 1 Cell volume: 866.06 Cell parameters: 6.9004; 10.0094; 13.4169; 69.587; 85.819; 89.459; |
| COD ID: 7251525 | |
| CIF file | Formula: - C22 H46 Mn N7 O20 P - Comments: 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 28(7) (2026) 1286-1298 Space group: P 1 Cell volume: 912.93 Cell parameters: 7.0184; 10.1341; 13.6387; 70.336; 88.826; 88.08; |
| COD ID: 7251526 | |
| CIF file | Formula: - C32 H52 N12 O23 P2 - Comments: 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 28(7) (2026) 1286-1298 Space group: P 1 21 1 Cell volume: 2199.9 Cell parameters: 11.4237; 7.386; 26.548; 90; 100.864; 90; |
| COD ID: 7251536 | |
| CIF file | Formula: - C22 H14 F6 N2 - Comments: Gerten, Anthony L.; Larson, Sarah N.; Ojala, William H. Examining the role of molecular and crystallographic symmetry in isomorphism: a series of centrosymmetric “bridge-flipped” trifluoromethyl-substituted bis-benzylideneanilines CrystEngComm 28(4) (2026) 849-861 Space group: P 1 21/n 1 Cell volume: 1912 Cell parameters: 8.3139; 12.128; 19.032; 90; 94.887; 90; |
| COD ID: 7251537 | |
| CIF file | Formula: - C22 H14 F6 N2 - Comments: Gerten, Anthony L.; Larson, Sarah N.; Ojala, William H. Examining the role of molecular and crystallographic symmetry in isomorphism: a series of centrosymmetric “bridge-flipped” trifluoromethyl-substituted bis-benzylideneanilines CrystEngComm 28(4) (2026) 849-861 Space group: P 1 21/n 1 Cell volume: 1868.3 Cell parameters: 14.9937; 7.5042; 16.9077; 90; 100.858; 90; |
| COD ID: 7251538 | |
| CIF file | Formula: - C22 H14 F6 N2 - Comments: Gerten, Anthony L.; Larson, Sarah N.; Ojala, William H. Examining the role of molecular and crystallographic symmetry in isomorphism: a series of centrosymmetric “bridge-flipped” trifluoromethyl-substituted bis-benzylideneanilines CrystEngComm 28(4) (2026) 849-861 Space group: P 1 21/n 1 Cell volume: 875 Cell parameters: 12.786; 4.7478; 14.494; 90; 96.023; 90; |
| COD ID: 7251539 | |
| CIF file | Formula: - C22 H14 F6 N2 - Comments: Gerten, Anthony L.; Larson, Sarah N.; Ojala, William H. Examining the role of molecular and crystallographic symmetry in isomorphism: a series of centrosymmetric “bridge-flipped” trifluoromethyl-substituted bis-benzylideneanilines CrystEngComm 28(4) (2026) 849-861 Space group: P 1 21/n 1 Cell volume: 901.4 Cell parameters: 12.5991; 4.8277; 14.9975; 90; 98.831; 90; |
| COD ID: 7251540 | |
| CIF file | Formula: - C22 H14 F6 N2 - Comments: Gerten, Anthony L.; Larson, Sarah N.; Ojala, William H. Examining the role of molecular and crystallographic symmetry in isomorphism: a series of centrosymmetric “bridge-flipped” trifluoromethyl-substituted bis-benzylideneanilines CrystEngComm 28(4) (2026) 849-861 Space group: P 1 21/n 1 Cell volume: 915.6 Cell parameters: 4.9998; 12.277; 14.928; 90; 92.252; 90; |
| COD ID: 7251544 | |
| CIF file | Formula: - C34 H32 Cl2 N2 O6 - Comments: Amarne, Hazem; Stirk, Alexander J.; O'Keefe, Christopher A.; Schurko, Robert W.; Loeb, Stephen J. A dynamic pcu MOF(Zn) containing a ditopic T-shaped [2]rotaxane linker CrystEngComm 28(3) (2026) 631-634 Space group: P -1 Cell volume: 1542.02 Cell parameters: 10.9858; 11.9858; 13.2917; 84.1988; 82.2922; 62.8753; |
| COD ID: 7251545 | |
| CIF file | Formula: - C282 H342 N12 O75 Zn6 - Comments: Amarne, Hazem; Stirk, Alexander J.; O'Keefe, Christopher A.; Schurko, Robert W.; Loeb, Stephen J. A dynamic pcu MOF(Zn) containing a ditopic T-shaped [2]rotaxane linker CrystEngComm 28(3) (2026) 631-634 Space group: R -3 :H Cell volume: 25985.3 Cell parameters: 25.8311; 25.8311; 44.9688; 90; 90; 120; |
| COD ID: 7251546 | |
| CIF file | Formula: - C51 H66 N2 O12 - Comments: Amarne, Hazem; Stirk, Alexander J.; O'Keefe, Christopher A.; Schurko, Robert W.; Loeb, Stephen J. A dynamic pcu MOF(Zn) containing a ditopic T-shaped [2]rotaxane linker CrystEngComm 28(3) (2026) 631-634 Space group: P -1 Cell volume: 2376.66 Cell parameters: 12.1185; 12.6366; 16.8865; 97.8567; 101.651; 106.452; |
| COD ID: 7251547 | |
| CIF file | Formula: - C20 H42 Cl2 N2 O6 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: P 1 2/n 1 Cell volume: 2281.56 Cell parameters: 18.7063; 6.3312; 20.0829; 90; 106.413; 90; |
| COD ID: 7251548 | |
| CIF file | Formula: - C2 H12 Cl2 N2 O1.87 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 730.15 Cell parameters: 11.1837; 5.9656; 11.0793; 90; 98.964; 90; |
| COD ID: 7251549 | |
| CIF file | Formula: - C6 H16 Cl2 N2 O2 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 961.03 Cell parameters: 9.7834; 9.3257; 10.6627; 90; 98.935; 90; |
| COD ID: 7251550 | |
| CIF file | Formula: - C4 H14 Cl2 N2 O2 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 835.35 Cell parameters: 10.7011; 6.1485; 13.6061; 90; 111.074; 90; |
| COD ID: 7251551 | |
| CIF file | Formula: - C20 H38 Cl2 N2 O2 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: P -1 Cell volume: 1054.13 Cell parameters: 6.7122; 11.2178; 14.5863; 78.253; 78.616; 87.474; |
| COD ID: 7251552 | |
| CIF file | Formula: - C4 H16 Cl2 N2 O4 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: P 1 21/c 1 Cell volume: 487.02 Cell parameters: 7.3636; 11.0879; 6.0534; 90; 99.808; 90; |
| COD ID: 7251553 | |
| CIF file | Formula: - C2 H12 Cl2 N2 O2 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 739.5 Cell parameters: 11.231; 5.985; 11.134; 90; 98.835; 90; |
| COD ID: 7251554 | |
| CIF file | Formula: - C4 H14 Cl2 N2 O1.38 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 824.31 Cell parameters: 10.479; 6.1798; 13.515; 90; 109.635; 90; |
| COD ID: 7251555 | |
| CIF file | Formula: - C4 H14 Cl2 N2 O1.73 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 831.16 Cell parameters: 10.6313; 6.1567; 13.5716; 90; 110.665; 90; |
| COD ID: 7251556 | |
| CIF file | Formula: - C4 H14 Br2 N2 O2 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 911 Cell parameters: 11.1916; 6.2618; 13.9442; 90; 111.211; 90; |
| COD ID: 7251557 | |
| CIF file | Formula: - C6 H16 Cl2 N2 O1.29 - Comments: Churakov, Andrei V.; Mel'nik, Elena A.; Egorov, Pavel A.; Mikhaylov, Alexey A.; Tripol'skaya, Tatiana A.; Lev, Ovadia; Prikhodchenko, Petr V. Anion-directed architectures in amine halide peroxosolvates: role of H2O2/H2O competition in crystal engineering CrystEngComm 28(7) (2026) 1225-1237 Space group: C 1 2/c 1 Cell volume: 946.59 Cell parameters: 9.7389; 9.5339; 10.3448; 90; 99.768; 90; |
| COD ID: 7251566 | |
| CIF file | Formula: - C24 H19 N3 O2 - Comments: Priyadharsan, R. Rameshbabu; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Dimethoxy-substituted triphenylamine-based donor–acceptor fluorophores: tunable solid-state emission and reversible thermofluorochromism CrystEngComm 28(6) (2026) 1083-1090 Space group: P -1 Cell volume: 1006.6 Cell parameters: 9.583; 10.432; 11.513; 111.09; 106.87; 94.31; |
| COD ID: 7251567 | |
| CIF file | Formula: - C24 H21 N3 O3 - Comments: Priyadharsan, R. Rameshbabu; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Dimethoxy-substituted triphenylamine-based donor–acceptor fluorophores: tunable solid-state emission and reversible thermofluorochromism CrystEngComm 28(6) (2026) 1083-1090 Space group: P -1 Cell volume: 2039.2 Cell parameters: 9.192; 10.19; 23.366; 92.24; 95.24; 110.23; |
| COD ID: 7251568 | |
| CIF file | Formula: - C25 H24 N2 O5 - Comments: Priyadharsan, R. Rameshbabu; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Dimethoxy-substituted triphenylamine-based donor–acceptor fluorophores: tunable solid-state emission and reversible thermofluorochromism CrystEngComm 28(6) (2026) 1083-1090 Space group: P 1 21/c 1 Cell volume: 2160 Cell parameters: 8.331; 15.739; 16.743; 90; 100.3; 90; |
| COD ID: 7251569 | |
| CIF file | Formula: - C26 H24 N2 O4 - Comments: Priyadharsan, R. Rameshbabu; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Dimethoxy-substituted triphenylamine-based donor–acceptor fluorophores: tunable solid-state emission and reversible thermofluorochromism CrystEngComm 28(6) (2026) 1083-1090 Space group: P 1 21/c 1 Cell volume: 2210.2 Cell parameters: 8.599; 15.82; 16.419; 90; 98.3; 90; |
| COD ID: 7251570 | |
| CIF file | Formula: - C27 H25 N3 O5 - Comments: Priyadharsan, R. Rameshbabu; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Dimethoxy-substituted triphenylamine-based donor–acceptor fluorophores: tunable solid-state emission and reversible thermofluorochromism CrystEngComm 28(6) (2026) 1083-1090 Space group: P -1 Cell volume: 2315.2 Cell parameters: 11.187; 14.173; 14.888; 81.72; 82.4; 89.71; |
| COD ID: 7251571 | |
| CIF file | Formula: - C30 H23 N O4 - Comments: Priyadharsan, R. Rameshbabu; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Dimethoxy-substituted triphenylamine-based donor–acceptor fluorophores: tunable solid-state emission and reversible thermofluorochromism CrystEngComm 28(6) (2026) 1083-1090 Space group: P 1 21/n 1 Cell volume: 2365.7 Cell parameters: 16.077; 8.455; 18.89; 90; 112.88; 90; |
| COD ID: 7251572 | |
| CIF file | Formula: - C16 H10 N2 O8 Sr2 - Comments: Singh, Atom Rajiv; Rajpurohit, Anil Singh; Sharma, Aribam Rishikanta; Jaccob, Madhavan; Laishram, Raju; Lonibala, Rajkumari Unprecedented 3D-coordination polymeric frameworks of 5-aminoisophthalate with alkaline earth metals (Sr and Ba): catalytic and luminescent properties CrystEngComm 28(8) (2026) 1431-1443 Space group: P -1 Cell volume: 797.48 Cell parameters: 7.4671; 9.5062; 12.2972; 72.879; 82.237; 73.215; |
| COD ID: 7251573 | |
| CIF file | Formula: - C32 H21 Ba4 Cl N4 O16 - Comments: Singh, Atom Rajiv; Rajpurohit, Anil Singh; Sharma, Aribam Rishikanta; Jaccob, Madhavan; Laishram, Raju; Lonibala, Rajkumari Unprecedented 3D-coordination polymeric frameworks of 5-aminoisophthalate with alkaline earth metals (Sr and Ba): catalytic and luminescent properties CrystEngComm 28(8) (2026) 1431-1443 Space group: P -1 Cell volume: 860.27 Cell parameters: 7.521; 9.8113; 12.5148; 76.429; 87.09; 73.427; |
| COD ID: 7251574 | |
| CIF file | Formula: - C8 H4 Bi F4 O7 - Comments: Huang, Tao; Peng, Rufang; Jin, Bo Three novel green bismuth-based combustion catalysts for catalyzing the high-energy oxidizer RDX CrystEngComm 28(5) (2026) 962-971 Space group: P 1 21/c 1 Cell volume: 1131.95 Cell parameters: 13.368; 11.6173; 7.3026; 90; 93.526; 90; |
| COD ID: 7251575 | |
| CIF file | Formula: - C15 H21 Bi N3 O11 - Comments: Huang, Tao; Peng, Rufang; Jin, Bo Three novel green bismuth-based combustion catalysts for catalyzing the high-energy oxidizer RDX CrystEngComm 28(5) (2026) 962-971 Space group: P 1 21/c 1 Cell volume: 2066.2 Cell parameters: 11.3625; 17.769; 10.2592; 90; 94.019; 90; |
| COD ID: 7251576 | |
| CIF file | Formula: - C33 H28 Bi N3 O7 S2 - Comments: Huang, Tao; Peng, Rufang; Jin, Bo Three novel green bismuth-based combustion catalysts for catalyzing the high-energy oxidizer RDX CrystEngComm 28(5) (2026) 962-971 Space group: P 1 21/n 1 Cell volume: 3646.38 Cell parameters: 12.9683; 16.8294; 16.713; 90; 91.479; 90; |
| COD ID: 7251686 | |
| CIF file | Formula: - C16 H18 Mn N2 O12 S - Comments: Maldonado, Igor A. V.; Fernandes, William S.; Cardozo, Thiago M.; Vaz, Maria G. F.; Cassaro, Rafael A. Allão Single molecule magnet behavior in bis-oxamate one-dimensional coordination polymers: the effect of magnetic dilution CrystEngComm 28(8) (2026) 1412-1421 Space group: C 1 2/c 1 Cell volume: 2197.1 Cell parameters: 20.2296; 5.0967; 21.5356; 90; 98.318; 90; |
| COD ID: 7251687 | |
| CIF file | Formula: - C16 H20 Co0.87 Cu0.13 N2 O13 S - Comments: Maldonado, Igor A. V.; Fernandes, William S.; Cardozo, Thiago M.; Vaz, Maria G. F.; Cassaro, Rafael A. Allão Single molecule magnet behavior in bis-oxamate one-dimensional coordination polymers: the effect of magnetic dilution CrystEngComm 28(8) (2026) 1412-1421 Space group: C 1 2/c 1 Cell volume: 2116.1 Cell parameters: 19.8167; 5.0621; 21.336; 90; 98.625; 90; |
| COD ID: 7251688 | |
| CIF file | Formula: - C77 H130.2 O38.1 - Comments: Vicatos, Alexios I.; Hoossen, Zakiena; Edmonds-Smith, Cesarina; Caira, Mino R. Dimethylated β-cyclodextrin inclusion complexes containing the guest steroid hormones progesterone and 17β-estradiol: syntheses, crystal structures, thermal analyses and steroid solubility enhancements CrystEngComm 28(5) (2026) 1019-1029 Space group: P 1 21 1 Cell volume: 4329.2 Cell parameters: 15.469; 17.297; 16.518; 90; 101.616; 90; |
| COD ID: 7251689 | |
| CIF file | Formula: - C148.4 H268 O85.6 - Comments: Vicatos, Alexios I.; Hoossen, Zakiena; Edmonds-Smith, Cesarina; Caira, Mino R. Dimethylated β-cyclodextrin inclusion complexes containing the guest steroid hormones progesterone and 17β-estradiol: syntheses, crystal structures, thermal analyses and steroid solubility enhancements CrystEngComm 28(5) (2026) 1019-1029 Space group: P 1 21 1 Cell volume: 8634 Cell parameters: 14.1388; 30.448; 21.052; 90; 107.687; 90; |
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