Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
7060635 | CIF | C5 H8 Cu N10 | P 1 21/c 1 | 15.1598; 6.2457; 10.8574 90; 102.305; 90 | 1004.4 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
7060636 | CIF | C32 H52 Cu2 N36 O14 | P -1 | 11.2105; 11.3324; 11.4691 104.328; 106.897; 91.541 | 1343.09 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
7060637 | CIF | C24 H44 Cl2 Mn N16 O10 | P -1 | 10.7162; 11.9386; 15.5566 68.044; 79.661; 77.005 | 1788.58 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
7060638 | CIF | C48 H86 Cl4 Fe2 N32 O20 | P -1 | 10.9841; 11.8637; 15.0067 112.565; 90.518; 96.245 | 1792.38 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
7060639 | CIF | C12 H20 Cu2 N20 | P -1 | 6.2935; 10.817; 16.387 75.106; 82.86; 89.884 | 1069.2 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
7060640 | CIF | C24 H36 Cl2 Fe N24 O8 | R -3 :H | 10.8393; 10.8393; 30.1945 90; 90; 120 | 3072.28 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
7060641 | CIF | C14 H10 N2 | P c a 21 | 18.604; 5.0525; 11.244 90; 90; 90 | 1056.9 | Kumar, Gujjenahalli Ramalingaiah Yogesh; Begum, Noor Shahina Mn(iii)-mediated cascade cyclization of 1-(azidomethyl)-2-isocyanoarenes with organoboronic acids: construction of quinazoline derivatives New Journal of Chemistry, 2021, 45, 9811-9817 |
7060642 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0074; 12.597; 18.2478 90; 98.381; 90 | 5004.76 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060643 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0404; 12.6512; 18.3082 90; 98.056; 90 | 5054.63 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060644 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0143; 12.6048; 18.255 90; 98.342; 90 | 5011.91 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060645 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0261; 12.619; 18.2707 90; 98.246; 90 | 5025.79 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060646 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0352; 12.6354; 18.2873 90; 98.146; 90 | 5040.24 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060647 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0784; 12.691; 18.3485 90; 97.774; 90 | 5093.94 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060648 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.059; 12.67; 18.3284 90; 97.927; 90 | 5073.61 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060649 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.1453; 12.7427; 18.3743 90; 97.298; 90 | 5143.06 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060650 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.1027; 12.7147; 18.364 90; 97.579; 90 | 5115.74 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060651 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.696; 12.8357; 18.1558 90; 94.635; 90 | 5271.8 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060652 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.6717; 12.8018; 18.1125 90; 94.823; 90 | 5238.3 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060653 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0631; 12.6447; 18.3556 90; 97.857; 90 | 5072.8 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060654 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.0819; 12.6642; 18.3777 90; 97.712; 90 | 5092.83 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060655 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.1376; 12.7162; 18.4036 90; 97.298; 90 | 5138.76 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060656 | CIF | C27 H22 Ag F3 N2 O3 S | C 1 2/c 1 | 22.1074; 12.6883; 18.3944 90; 97.532; 90 | 5115.21 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060657 | CIF | C27 H21 Ag F3 N2 O3 S | C 1 2/c 1 | 22.6955; 12.7839; 18.1157 90; 94.668; 90 | 5238.6 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060658 | CIF | C27 H21 Ag F3 N2 O3 S | C 1 2/c 1 | 22.6895; 12.8292; 18.1655 90; 94.599; 90 | 5270.7 | Juneja, Navkiran; Unruh, Daniel K.; Groeneman, Ryan H.; Hutchins, Kristin M. Positive thermal expansion facilitates the formation of argentophilic forces following an order‒disorder phase transition New Journal of Chemistry, 2021, 45, 8898-8901 |
7060659 | CIF | C41 H59 Au N2 O10 S | P 1 | 10.0155; 10.9223; 20.2357 100.436; 104.283; 99.455 | 2058.38 | Safir Filho, Mauro; Scattolin, Thomas; Dao, Pascal; Tzouras, Nikolaos V.; Benhida, Rachid; Saab, Marina; Van Hecke, Kristof; Lippmann, Petra; Martin, Anthony R.; Ott, Ingo; Nolan, Steven P. Straightforward synthetic route to gold(i)-thiolato glycoconjugate complexes bearing NHC ligands (NHC = N-heterocyclic carbene) and their promising anticancer activity New Journal of Chemistry, 2021, 45, 9995-10001 |
7060660 | CIF | C32 H34 Cl4 N2 Ni2 O4 | P b c a | 13.0105; 11.6307; 21.7397 90; 90; 90 | 3289.7 | Hu, Miao; Jiang, Yong; Sun, Nan; Hu, Baoxiang; Shen, Zhenlu; Hu, Xinquan; Jin, Liqun Nickel-catalyzed C3-alkylation of indoles with alcohols via a borrowing hydrogen strategy New Journal of Chemistry, 2021, 45, 10057-10062 |
7060661 | CIF | C32 H47 F6 N2 Ni O3 P2 Sb | P 1 21/c 1 | 16.9127; 9.2788; 23.5436 90; 91.766; 90 | 3692.9 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060662 | CIF | C48 H70 F12 N4 Ni2 O5 P2 Sb2 | P 1 21/c 1 | 18.3475; 12.6233; 24.3404 90; 98.015; 90 | 5582.3 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060663 | CIF | C30 H37 Cl2 F6 N3 Ni O2 P Sb | P 1 21/n 1 | 17.2593; 13.5102; 29.393 90; 93.58; 90 | 6840.4 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060664 | CIF | C27.69 H36.38 Cl1.38 F6 N3 Ni O2 P Sb | P 1 21/n 1 | 14.5548; 15.2342; 14.8051 90; 95.07; 90 | 3269.9 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060665 | CIF | C30 H39 F6 N2 Ni O2 P2 Sb | P 1 | 12.6698; 13.6736; 20.1046 104.063; 100.134; 90.206 | 3321.9 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060666 | CIF | C19 H30 F6 N2 Ni O2 P Sb | P 1 21/n 1 | 17.1313; 8.0007; 17.8969 90; 94.072; 90 | 2446.8 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060667 | CIF | C22 H32 F6 N2 Ni O2 P Sb | P -1 | 12.2664; 13.2418; 17.527 68.383; 85.94; 87.02 | 2638.99 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060668 | CIF | C23 H36 F6 N Ni O2 P2 Sb | P 1 21/c 1 | 8.6586; 26.4721; 14.4377 90; 107.032; 90 | 3164.14 | Rahimi, Naser; Zargarian, Davit Cationic tetra- and pentacoordinate complexes of nickel based on POCN- and POCOP-type pincer ligands: synthesis, characterization, and ligand exchange studies New Journal of Chemistry, 2021, 45, 15063-15073 |
7060669 | CIF | C43 H67 Cl2 In N3 P2 | P 1 21/c 1 | 9.7016; 18.3583; 25.5187 90; 99.669; 90 | 4480.44 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060670 | CIF | C40 H65 N3 P2 | P n a 21 | 18.1046; 8.3016; 26.1934 90; 90; 90 | 3936.79 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060671 | CIF | C34 H52 Cl2 In N3 P2 | P 1 21/c 1 | 16.3379; 23.992; 20.6103 90; 112.995; 90 | 7436.85 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060672 | CIF | C40 H59 N3 P2 | P 1 21/c 1 | 11.6933; 22.3999; 14.5398 90; 97.596; 90 | 3774.97 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060673 | CIF | C36 H58 Al N3 P2 | P -1 | 8.5179; 14.3557; 16.0481 66.419; 82.147; 77.448 | 1752.81 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060674 | CIF | C34 H52 Cl2 In N3 P2 | P 1 21/c 1 | 9.2843; 19.1068; 20.8295 90; 92.334; 90 | 3691.95 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060675 | CIF | C36 H58 Al N3 P2 | P 1 21/n 1 | 16.246; 24.0391; 20.6349 90; 112.981; 90 | 7419.15 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060676 | CIF | C43 H67 Cl2 Ga N3 P2 | P 1 21/c 1 | 9.5009; 18.3494; 25.5029 90; 99.429; 90 | 4386 | Chisholm, Desmond T.; Hayes, Paul G. Synthesis and characterization of group 13 dichloride (M = Ga, In), dimethyl (M = Al) and cationic methyl aluminum complexes supported by monoanionic NNN-pincer ligands New Journal of Chemistry, 2021, 45, 15043-15052 |
7060677 | CIF | C24 H44 N O11 S Ti2 | P -1 | 11.0196; 11.0526; 13.9779 80.698; 84.378; 75.812 | 1625.8 | Mou, Wen-Yu; Xie, Bin; Li, Xiao-Long; Lai, Chuan; Li, Tao; Chen, Luo; Feng, Jian-Shen; Bai, Xiao-Xue; Wu, Yu; Wu, Wei-Ping; Zhang, Dong-Liang; Gu, Yun-Tian Tartrate-stabilized titanium‒oxo clusters containing sulfonate chromophore ligands: synthesis, crystal structures and photochemical properties New Journal of Chemistry, 2021, 45, 10930-10939 |
7060678 | CIF | C56 H90 O26 P2 Ti6 | P b c a | 20.766; 13.94118; 24.7923 90; 90; 90 | 7177.43 | Mou, Wen-Yu; Xie, Bin; Li, Xiao-Long; Lai, Chuan; Li, Tao; Chen, Luo; Feng, Jian-Shen; Bai, Xiao-Xue; Wu, Yu; Wu, Wei-Ping; Zhang, Dong-Liang; Gu, Yun-Tian Tartrate-stabilized titanium‒oxo clusters containing sulfonate chromophore ligands: synthesis, crystal structures and photochemical properties New Journal of Chemistry, 2021, 45, 10930-10939 |
7060679 | CIF | C25 H35 Cl2 N3 O Ru | R -3 :H | 31.1547; 31.1547; 14.2193 90; 90; 120 | 11952.4 | Çiçek, Metin; Gürbüz, Nevin; Özdemir, Namık; Özdemir, İsmail; İspir, Esin Half-sandwich Ru(ii) arene complexes bearing benzimidazole ligands for the N-alkylation reaction of aniline with alcohols in a solvent-free medium New Journal of Chemistry, 2021, 45, 11075-11085 |
7060680 | CIF | C32 H34 Cl2 N2 Ru | P 1 21/c 1 | 13.5366; 13.6516; 16.3238 90; 107.046; 90 | 2884.1 | Çiçek, Metin; Gürbüz, Nevin; Özdemir, Namık; Özdemir, İsmail; İspir, Esin Half-sandwich Ru(ii) arene complexes bearing benzimidazole ligands for the N-alkylation reaction of aniline with alcohols in a solvent-free medium New Journal of Chemistry, 2021, 45, 11075-11085 |
7060681 | CIF | C21 H28 Cl2 N2 O2 Ru | R -3 :H | 30.0916; 30.0916; 13.669 90; 90; 120 | 10719.1 | Çiçek, Metin; Gürbüz, Nevin; Özdemir, Namık; Özdemir, İsmail; İspir, Esin Half-sandwich Ru(ii) arene complexes bearing benzimidazole ligands for the N-alkylation reaction of aniline with alcohols in a solvent-free medium New Journal of Chemistry, 2021, 45, 11075-11085 |
7060682 | CIF | C30 H30 Cl2 N2 Ru | P 1 21/c 1 | 13.4953; 13.5037; 15.368 90; 103.766; 90 | 2720.2 | Çiçek, Metin; Gürbüz, Nevin; Özdemir, Namık; Özdemir, İsmail; İspir, Esin Half-sandwich Ru(ii) arene complexes bearing benzimidazole ligands for the N-alkylation reaction of aniline with alcohols in a solvent-free medium New Journal of Chemistry, 2021, 45, 11075-11085 |
7060683 | CIF | C23 H32 Cl2 N2 O2 Ru | R -3 :H | 30.6323; 30.6323; 14.2515 90; 90; 120 | 11581.1 | Çiçek, Metin; Gürbüz, Nevin; Özdemir, Namık; Özdemir, İsmail; İspir, Esin Half-sandwich Ru(ii) arene complexes bearing benzimidazole ligands for the N-alkylation reaction of aniline with alcohols in a solvent-free medium New Journal of Chemistry, 2021, 45, 11075-11085 |
7060684 | CIF | C38 H27 N3 | P 1 21/c 1 | 19.2398; 8.8918; 18.0426 90; 116.868; 90 | 2753.5 | Ge, Yuxi; Huang, Bin Light-emitting analogues based on triphenylamine modified quinoxaline and pyridine[2,3-b]pyrazine exhibiting different mechanochromic luminescence New Journal of Chemistry, 2021, 45, 11304-11312 |
7060685 | CIF | C37 H26 N4 | P 1 21/c 1 | 18.92; 8.897; 17.812 90; 116.82; 90 | 2676 | Ge, Yuxi; Huang, Bin Light-emitting analogues based on triphenylamine modified quinoxaline and pyridine[2,3-b]pyrazine exhibiting different mechanochromic luminescence New Journal of Chemistry, 2021, 45, 11304-11312 |
7060686 | CIF | C38 H27 N3 | P 1 21/c 1 | 19.2475; 8.936; 18.0898 90; 117.001; 90 | 2772.2 | Ge, Yuxi; Huang, Bin Light-emitting analogues based on triphenylamine modified quinoxaline and pyridine[2,3-b]pyrazine exhibiting different mechanochromic luminescence New Journal of Chemistry, 2021, 45, 11304-11312 |
7060687 | CIF | C37 H26 N4 | P 1 21/c 1 | 19.065; 8.994; 17.864 90; 116.751; 90 | 2735 | Ge, Yuxi; Huang, Bin Light-emitting analogues based on triphenylamine modified quinoxaline and pyridine[2,3-b]pyrazine exhibiting different mechanochromic luminescence New Journal of Chemistry, 2021, 45, 11304-11312 |
7060688 | CIF | C6 H12 N6 O10 Sr | C 1 2/c 1 | 9.7194; 8.3786; 17.7045 90; 95.021; 90 | 1436.2 | Huang, Yao; Peng, Rufang; Jin, Bo An efficient strontium-based combustion inhibitor of ammonium perchlorate with a 2D-MOF structure New Journal of Chemistry, 2021, 45, 11068-11074 |
7060689 | CIF | C29 H18 F N3 O2 | P 1 c 1 | 9.177; 12.753; 11.653 90; 123.03; 90 | 1143.4 | Yadav, Rahul; Parvin, Tasneem Multicomponent synthesis of styryl linked benzo[h]pyrazolo[3,4-b]quinoline-5,6(10H)-diones by liquid assisted grinding New Journal of Chemistry, 2021, 45, 10388-10395 |
7060690 | CIF | C29 H18 Br N3 O2 | P -1 | 10.6575; 10.8837; 11.685 110.376; 102.926; 108.235 | 1119.38 | Yadav, Rahul; Parvin, Tasneem Multicomponent synthesis of styryl linked benzo[h]pyrazolo[3,4-b]quinoline-5,6(10H)-diones by liquid assisted grinding New Journal of Chemistry, 2021, 45, 10388-10395 |
7060691 | CIF | C29.5 H30.5 Cl N P Pd | C 1 2/c 1 | 25.378; 10.2854; 21.374 90; 110.16; 90 | 5237.3 | Saha, Debajyoti; Sepay, Nayim Fluxional chloro-pyrrole‒Pd(ii) complex to cationic η2-pyrrole‒Pd(ii) complex: subtlety in structure-directed bonding mode New Journal of Chemistry, 2021, 45, 10594-10598 |
7060692 | CIF | C27 H27 F6.18 N P Pd Sb | P -1 | 8.9132; 11.1285; 14.9029 89.114; 75.267; 81.91 | 1415.1 | Saha, Debajyoti; Sepay, Nayim Fluxional chloro-pyrrole‒Pd(ii) complex to cationic η2-pyrrole‒Pd(ii) complex: subtlety in structure-directed bonding mode New Journal of Chemistry, 2021, 45, 10594-10598 |
7060693 | CIF | C28 H27 N O3 S | P -1 | 9.9944; 16.6828; 16.8624 117.285; 92.754; 90.642 | 2494.1 | Ding, Ran; Fu, Jian-Ming; Tian, Hai-Yu; Chen, Nian-Shou; Liu, Lei; Guo, Yu; Wang, Pei-Long Sulfonyl radical-induced regioselective cyclization of 3-aza-1,5-enynes with sulfonyl chlorides to produce 1,2-dihydropyridines by copper catalysis New Journal of Chemistry, 2021, 45, 11030-11034 |
7060694 | CIF | C5 H6 N10 O4 | P -1 | 8.2548; 10.453; 13.508 93.199; 99.554; 106.901 | 1093.1 | Yang, Rui; Liu, Yifei; Dong, Zhen; Li, Haiyan; Ye, Zhiwen 3-R-4-(5-Methyleneazide-1,2,4-oxadiazol-3-yl)furazan and its ionic salts as low-sensitivity and high-detonation energetic materials New Journal of Chemistry, 2021, 45, 11380-11389 |
7060695 | CIF | C5 H4 N8 O2 | P c a 21 | 19.831; 5.3577; 7.8562 90; 90; 90 | 834.71 | Yang, Rui; Liu, Yifei; Dong, Zhen; Li, Haiyan; Ye, Zhiwen 3-R-4-(5-Methyleneazide-1,2,4-oxadiazol-3-yl)furazan and its ionic salts as low-sensitivity and high-detonation energetic materials New Journal of Chemistry, 2021, 45, 11380-11389 |
7060696 | CIF | C30 H35 Cl2 F3 N3 O4 P Ru | P 1 21/n 1 | 15.3065; 13.8547; 15.6247 90; 94.198; 90 | 3304.6 | Hkiri, Shaima; Gourlaouen, Christophe; Touil, Soufiane; Samarat, Ali; Sémeril, David 1,3,4-Oxadiazole-functionalized α-amino-phosphonates as ligands for the ruthenium-catalyzed reduction of ketones New Journal of Chemistry, 2021, 45, 11327-11335 |
7060697 | CIF | C20 H24 N3 O5 P | P -1 | 8.8977; 12.5369; 19.514 90.816; 94.235; 103.384 | 2110.8 | Hkiri, Shaima; Gourlaouen, Christophe; Touil, Soufiane; Samarat, Ali; Sémeril, David 1,3,4-Oxadiazole-functionalized α-amino-phosphonates as ligands for the ruthenium-catalyzed reduction of ketones New Journal of Chemistry, 2021, 45, 11327-11335 |
7060698 | CIF | C30 H38 Cl2 N3 O5 P Ru | P 1 21/n 1 | 11.2342; 17.0441; 16.4074 90; 92.713; 90 | 3138.1 | Hkiri, Shaima; Gourlaouen, Christophe; Touil, Soufiane; Samarat, Ali; Sémeril, David 1,3,4-Oxadiazole-functionalized α-amino-phosphonates as ligands for the ruthenium-catalyzed reduction of ketones New Journal of Chemistry, 2021, 45, 11327-11335 |
7060699 | CIF | C26 H20 Br N3 O3 | P 1 21/c 1 | 8.6861; 21.538; 13.065 90; 109.378; 90 | 2305.8 | Yue, Guizhou; Jiang, Dan; Dou, Zhengjie; Li, Sicheng; Feng, Juhua; Zhang, Li; Chen, Huabao; Yang, Chunping; Yin, Zhongqiong; Song, Xu; Liang, Xiaoxia; Wang, Xianxiang; Lu, Cuifen Rapid umpolung Michael addition of isatin N,N′-cyclic azomethine imine 1,3-dipoles with chalcones New Journal of Chemistry, 2021, 45, 11712-11718 |
7060700 | CIF | C27 H21 Br N2 O3 | P n a 21 | 8.1785; 25.516; 12.111 90; 90; 90 | 2527.4 | Yue, Guizhou; Jiang, Dan; Dou, Zhengjie; Li, Sicheng; Feng, Juhua; Zhang, Li; Chen, Huabao; Yang, Chunping; Yin, Zhongqiong; Song, Xu; Liang, Xiaoxia; Wang, Xianxiang; Lu, Cuifen Rapid umpolung Michael addition of isatin N,N′-cyclic azomethine imine 1,3-dipoles with chalcones New Journal of Chemistry, 2021, 45, 11712-11718 |
7060701 | CIF | C4 H13 N11 O2 | P 1 21 1 | 3.668; 12.731; 10.435 90; 90.672; 90 | 487.3 | Yin, Zhaoyang; Dong, Yaqun; Zeng, Zhiwei; Huang, Wei; Tang, Yongxing Crystal Structures and Properties of High-nitrogen Energetic Salts Based on (Z)-1,1-diamino-2-nitro-2-(1H-tetrazol-5-yl)ethene New Journal of Chemistry, 2021 |
7060702 | CIF | C4 H13 N13 O2 | P 1 21/c 1 | 6.8842; 11.841; 13.831 90; 98.291; 90 | 1115.7 | Yin, Zhaoyang; Dong, Yaqun; Zeng, Zhiwei; Huang, Wei; Tang, Yongxing Crystal Structures and Properties of High-nitrogen Energetic Salts Based on (Z)-1,1-diamino-2-nitro-2-(1H-tetrazol-5-yl)ethene New Journal of Chemistry, 2021 |
7060703 | CIF | C4 H10 N10 O2 | P -1 | 8.413; 9.8706; 11.1959 85.603; 86.325; 83.788 | 920.08 | Yin, Zhaoyang; Dong, Yaqun; Zeng, Zhiwei; Huang, Wei; Tang, Yongxing Crystal Structures and Properties of High-nitrogen Energetic Salts Based on (Z)-1,1-diamino-2-nitro-2-(1H-tetrazol-5-yl)ethene New Journal of Chemistry, 2021 |
7060704 | CIF | C13 H15 N5 S | P 1 21/c 1 | 9.8884; 10.9455; 12.6252 90; 91.519; 90 | 1365.99 | Grytsai, Oleksandr; Gonçalves, Leticia Christina Pires; Bardovskyi, Rostyslav; Hamouda-Tekaya, Nedra; Rocchi, Stéphane; Ronco, Cyril; Benhida, Rachid Arylbiamidines: synthesis and structural studies en route to anticancer applications New Journal of Chemistry, 2021, 45, 11893-11897 |
7060705 | CIF | C18 H21 Cl3 N6 Ni O4 | P 1 21/n 1 | 12.5147; 14.4871; 13.4749 90; 107.825; 90 | 2325.7 | Pal, Pampi; Das, Kinsuk; Hossain, Anowar; Gomila, Rosa M.; Frontera, Antonio; Mukhopadhyay, Subrata Synthesis and crystal structure of the simultaneous binding of Ni(ii) cation and chloride by the protonated 2,4,6 tris-(2-pyridyl)-1,3,5 triazine ligand: theoretical investigations of anion⋯π, π⋯π and hydrogen bonding interactions New Journal of Chemistry, 2021, 45, 11689-11696 |
7060706 | CIF | C15 H20 Cl N3 Ni O2 | P b c a | 16.793; 9.9261; 19.198 90; 90; 90 | 3200.1 | Jagtap, Rahul A.; Ankade, Shidheshwar B.; Gonnade, Rajesh G.; Punji, Benudhar Achiral and chiral NNN-pincer nickel complexes with oxazolinyl backbones: application in transfer hydrogenation of ketones New Journal of Chemistry, 2021, 45, 11927-11936 |
7060707 | CIF | C22 H26 Cl N3 Ni O2 | P 21 21 21 | 9.9695; 10.0137; 21.4431 90; 90; 90 | 2140.7 | Jagtap, Rahul A.; Ankade, Shidheshwar B.; Gonnade, Rajesh G.; Punji, Benudhar Achiral and chiral NNN-pincer nickel complexes with oxazolinyl backbones: application in transfer hydrogenation of ketones New Journal of Chemistry, 2021, 45, 11927-11936 |
7060708 | CIF | C19 H28 Cl N3 Ni O2 | P 21 21 21 | 9.7315; 9.8437; 21.184 90; 90; 90 | 2029.3 | Jagtap, Rahul A.; Ankade, Shidheshwar B.; Gonnade, Rajesh G.; Punji, Benudhar Achiral and chiral NNN-pincer nickel complexes with oxazolinyl backbones: application in transfer hydrogenation of ketones New Journal of Chemistry, 2021, 45, 11927-11936 |
7060709 | CIF | C68.71 H75.43 Br2 Cu4 N4 O14 | P 1 21 1 | 10.2904; 21.3262; 15.8441 90; 93.987; 90 | 3468.7 | Liu, Meiying; Liang, Jingjing; Liu, Zhiliang Modulating the ferroelectric performance by altering halogen anions in the crystals of tetranuclear copper-clusters New Journal of Chemistry, 2021, 45, 12091-12096 |
7060710 | CIF | C70 H76 Cl2 Cu4 N4 O14 | P 1 21 1 | 10.4998; 25.108; 15.766 90; 109.173; 90 | 3925.8 | Liu, Meiying; Liang, Jingjing; Liu, Zhiliang Modulating the ferroelectric performance by altering halogen anions in the crystals of tetranuclear copper-clusters New Journal of Chemistry, 2021, 45, 12091-12096 |
7060711 | CIF | C44 H54 N10 O9 Zn3 | C 1 2/c 1 | 15.6822; 15.7587; 19.2295 90; 100.549; 90 | 4671.9 | Ghosh, Mrinmoy; Biswas, Samik; Roy, Moumita; Biswas, Saptarshi; Ghosh, Pameli; Koner, Subratanath; Mandal, Supratim; Saha, Sandip A trinuclear Zn(ii) Schiff base azido compound: synthesis, structure and exploration of antimicrobial activity New Journal of Chemistry, 2021, 45, 12296-12304 |
7060712 | CIF | C17 H9 F9 N2 O | P -3 | 19.5053; 19.5053; 7.9076 90; 90; 120 | 2605.44 | Accorsi, Gianluca; Capodilupo, Agostina-Lina; Claramunt, Rosa María; Clarkson, Guy J.; Farrán, A.; Gatti, Francesco G.; León, Salvador; Venturi, Silvia Studies of novel trifluoroacetylated diaryl hydrazone molecular photoswitches in solution and in the solid state New Journal of Chemistry, 2021, 45, 12471-12478 |
7060713 | CIF | C17 H15 F3 N2 O | P 1 21/c 1 | 12.5454; 8.1267; 15.8452 90; 108.614; 90 | 1530.96 | Accorsi, Gianluca; Capodilupo, Agostina-Lina; Claramunt, Rosa María; Clarkson, Guy J.; Farrán, A.; Gatti, Francesco G.; León, Salvador; Venturi, Silvia Studies of novel trifluoroacetylated diaryl hydrazone molecular photoswitches in solution and in the solid state New Journal of Chemistry, 2021, 45, 12471-12478 |
7060714 | CIF | C17 H15 F3 N2 O | P 21 21 21 | 8.14933; 10.51816; 36.3202 90; 90; 90 | 3113.22 | Accorsi, Gianluca; Capodilupo, Agostina-Lina; Claramunt, Rosa María; Clarkson, Guy J.; Farrán, A.; Gatti, Francesco G.; León, Salvador; Venturi, Silvia Studies of novel trifluoroacetylated diaryl hydrazone molecular photoswitches in solution and in the solid state New Journal of Chemistry, 2021, 45, 12471-12478 |
7060715 | CIF | C16 H28 Cl2 F N6 O P3 | P -1 | 10.1879; 10.2669; 13.3549 103.929; 110.726; 100.441 | 1212.24 | Mutlu, Ömer Faruk; Binici, Arzu; Okumuş, Aytuğ; Elmas, Gamze; Çoşut, Bünyemin; Kılıç, Zeynel; Hökelek, Tuncer Phosphorus‒nitrogen compounds. Part 54. syntheses of chiral amino-4-fluorobenzyl-spiro(N/O)cyclotriphosphazenes: structural and stereogenic properties New Journal of Chemistry, 2021, 45, 12178-12192 |
7060716 | CIF | C36 H42 I2 N4 Zn | P n n a | 14.8749; 22.8089; 10.34 90; 90; 90 | 3508.16 | Caruso, Manfredi; Cametti, Massimo; Rissanen, Kari; Martí-Rujas, Javier Selective guest inclusion of linear C6 hydrocarbons in a Zn(ii) 1D coordination polymer New Journal of Chemistry, 2021, 45, 12448-12452 |
7060717 | CIF | C44 H55 N3 O2 | P -1 | 9.3185; 11.3873; 20.1187 86.468; 80.778; 66.09 | 1926.4 | Zhang, Yujian; Wen, Li; Sun, Jingwei; Li, Chengjian; Zhu, chenfei; Zhang, Xi; Wang, Zhenbo; Lv, Chunyan; Song, Qingbao Rich-Colour Mechanochromism of a Cyanostilbene Derivative with Chiral Self-Assembly New Journal of Chemistry, 2021 |
7060718 | CIF | C25 H26 B Fe N O2 | P 1 21/n 1 | 6.6968; 28.3884; 11.8736 90; 93.97; 90 | 2251.89 | Viswanathan, Thamodharan; Palanisami, Nallasamy Ferrocene-appended boronated ester: effect of cyanovinylene group on the nonlinear optical properties and colorimetric detection of fluoride ion New Journal of Chemistry, 2021, 45, 12509-12518 |
7060719 | CIF | C40 H66 S2 Si4 | P -1 | 7.5572; 13.6372; 22.295 72.523; 89.93; 81.09 | 2162.7 | Obayashi, Kotaro; Higashino, Taiki; Imato, Keiichi; Ooyama, Yousuke Synthesis, photophysical and electrochemical properties of 1,1′,3,3′-tetrasubstituted-4,4′-bibenzo[c]thiophene derivatives with different substituents on the thiophene rings New Journal of Chemistry, 2021, 45, 13258-13261 |
7060720 | CIF | C30 H38 O2 S2 Si2 | C 1 2/c 1 | 22.03; 7.548; 20.8392 90; 121.727; 90 | 2947.4 | Obayashi, Kotaro; Higashino, Taiki; Imato, Keiichi; Ooyama, Yousuke Synthesis, photophysical and electrochemical properties of 1,1′,3,3′-tetrasubstituted-4,4′-bibenzo[c]thiophene derivatives with different substituents on the thiophene rings New Journal of Chemistry, 2021, 45, 13258-13261 |
7060721 | CIF | C10 H17 Br2 Cu N5 O2 | P 1 21/n 1 | 8.532; 15.288; 12.596 90; 107.57; 90 | 1566.3 | Tupolova, Yulia P.; Levchenkov, Sergey I.; Popov, Leonid D.; Lebedev, Vladimir E.; Minin, Vadim V.; Efimov, Nikolay N.; Lazarenko, Vladimir A.; Zubavichus, Yan V.; Zubenko, Alexander A.; Shcherbakov, Igor N. Unprecedented interplay of antiferro- and ferromagnetic exchange interactions through intermolecular hydrogen bonds in mononuclear Cu(ii) complexes New Journal of Chemistry, 2021, 45, 12236-12246 |
7060722 | CIF | C10 H15 Cl2 Cu N5 O | P 1 21/c 1 | 6.8717; 23.169; 9.1083 90; 93.73; 90 | 1447.1 | Tupolova, Yulia P.; Levchenkov, Sergey I.; Popov, Leonid D.; Lebedev, Vladimir E.; Minin, Vadim V.; Efimov, Nikolay N.; Lazarenko, Vladimir A.; Zubavichus, Yan V.; Zubenko, Alexander A.; Shcherbakov, Igor N. Unprecedented interplay of antiferro- and ferromagnetic exchange interactions through intermolecular hydrogen bonds in mononuclear Cu(ii) complexes New Journal of Chemistry, 2021, 45, 12236-12246 |
7060723 | CIF | C36 H31 N O9 | P 1 21/c 1 | 18.9979; 13.7617; 25.5949 90; 104.624; 90 | 6474.8 | Zhou, Wei; Li, Zheng; Tian, You-Ping; Han, Xiao-Xue; Liu, Xiong-Li Chromone‒indanedione reactant: a bifunctional 3C synthon for diastereoselective construction of skeleton-diversified bispiro-[chromanocyclopentane-oxindole-indanedione] New Journal of Chemistry, 2021, 45, 12356-12361 |
7060724 | CIF | C35 H28 Cl N O8 | I 1 2/a 1 | 24.279; 13.6963; 19.1934 90; 97.378; 90 | 6329.6 | Zhou, Wei; Li, Zheng; Tian, You-Ping; Han, Xiao-Xue; Liu, Xiong-Li Chromone‒indanedione reactant: a bifunctional 3C synthon for diastereoselective construction of skeleton-diversified bispiro-[chromanocyclopentane-oxindole-indanedione] New Journal of Chemistry, 2021, 45, 12356-12361 |
7060725 | CIF | C24 H35 Ge N O | P 1 21 1 | 10.4557; 15.3711; 13.4947 90; 92.266; 90 | 2167.11 | Arsenyeva, Kseniya Vital'evna; Pashanova, Kira Igorevna; Trofimova, Olesya Yur'evna; Ershova, Irina V.; Chegerev, Maxim G.; Starikova, Alyona A.; Cherkasov, Anton Vladimirovich; Syroeshkin, Mikhail A.; Kozmenkova, Anna Ya.; Piskunov, Alexandr Vladimirovich O,N-HETEROCYCLIC GERMYLENES AS EFFICIENT CATALYSTS FOR HYDROBORATION AND CYANOSILYLATION OF BENZALDEHYDE New Journal of Chemistry, 2021 |
7060726 | CIF | C33 H34 O5 S | P 1 21 1 | 13.5003; 4.557; 23.5269 90; 102.166; 90 | 1414.89 | Iwakura, Izumi; Hashimoto, Sena; Okamura, Kotaro; Komori-Orisaku, Keiko; Akai, Shoji; Yabushita, Atsushi Crystallization of highly soluble thioglucopyranoside ejected by coherent molecular vibrational excitation using a visible 10 fs pulsed laser New Journal of Chemistry, 2021, 45, 12346-12350 |
7060727 | CIF | C13 H14 O S4 | P 1 21/c 1 | 20.4907; 5.32821; 13.26611 90; 100.586; 90 | 1423.73 | Afzali, Azadeh; Abdollahi, Maryam F.; Zhang, Baiyu; Zhao, Yuming Donor/acceptor substituted dithiafulvenes and tetrathiafulvalene vinylogues: electronic absorption, crystallographic, and computational analyses New Journal of Chemistry, 2021, 45, 11918-11926 |
7060728 | CIF | C26 H26 O2 S8 | P -1 | 10.1138; 13.0705; 21.6545 98.305; 93.353; 94.955 | 2814.64 | Afzali, Azadeh; Abdollahi, Maryam F.; Zhang, Baiyu; Zhao, Yuming Donor/acceptor substituted dithiafulvenes and tetrathiafulvalene vinylogues: electronic absorption, crystallographic, and computational analyses New Journal of Chemistry, 2021, 45, 11918-11926 |
7060729 | CIF | C24 H20 N2 O4 S8 | P -1 | 10.0328; 11.4799; 12.7909 81.281; 88.789; 72.88 | 1391.22 | Afzali, Azadeh; Abdollahi, Maryam F.; Zhang, Baiyu; Zhao, Yuming Donor/acceptor substituted dithiafulvenes and tetrathiafulvalene vinylogues: electronic absorption, crystallographic, and computational analyses New Journal of Chemistry, 2021, 45, 11918-11926 |
7060730 | CIF | C24.75 H23.5 Cl1.5 N2 O4 S9 | P 1 21/c 1 | 8.54193; 14.0748; 27.4895 90; 97.1341; 90 | 3279.37 | Afzali, Azadeh; Abdollahi, Maryam F.; Zhang, Baiyu; Zhao, Yuming Donor/acceptor substituted dithiafulvenes and tetrathiafulvalene vinylogues: electronic absorption, crystallographic, and computational analyses New Journal of Chemistry, 2021, 45, 11918-11926 |
7060731 | CIF | C12 H11 N O2 S4 | P -1 | 7.3968; 8.334; 11.6041 82.169; 89.492; 73.337 | 678.56 | Afzali, Azadeh; Abdollahi, Maryam F.; Zhang, Baiyu; Zhao, Yuming Donor/acceptor substituted dithiafulvenes and tetrathiafulvalene vinylogues: electronic absorption, crystallographic, and computational analyses New Journal of Chemistry, 2021, 45, 11918-11926 |
7060732 | CIF | C3 H10 I3 N O3 Pb | C 1 2 1 | 22.6435; 6.4529; 9.0191 90; 92.107; 90 | 1316.95 | Sirenko, Valerii Y.; Kucheriv, Olesia I.; Naumova, Dina D.; Fesych, Igor V.; Linnik, Rostyslav P.; Dascălu, Ioan-Andrei; Shova, Sergiu; Fritsky, Igor O.; Gural'skiy, Il'ya A. Chiral organic‒inorganic lead halide perovskites based on α-alanine New Journal of Chemistry, 2021, 45, 12606-12612 |
7060733 | CIF | C3 H10 Br3 N O3 Pb | C 1 2 1 | 21.836; 6.0904; 8.79 90; 92.41; 90 | 1167.9 | Sirenko, Valerii Y.; Kucheriv, Olesia I.; Naumova, Dina D.; Fesych, Igor V.; Linnik, Rostyslav P.; Dascălu, Ioan-Andrei; Shova, Sergiu; Fritsky, Igor O.; Gural'skiy, Il'ya A. Chiral organic‒inorganic lead halide perovskites based on α-alanine New Journal of Chemistry, 2021, 45, 12606-12612 |
7060734 | CIF | C3 H10 I3 N O3 Pb | C 1 2 1 | 22.56; 6.443; 8.9978 90; 92.204; 90 | 1306.9 | Sirenko, Valerii Y.; Kucheriv, Olesia I.; Naumova, Dina D.; Fesych, Igor V.; Linnik, Rostyslav P.; Dascălu, Ioan-Andrei; Shova, Sergiu; Fritsky, Igor O.; Gural'skiy, Il'ya A. Chiral organic‒inorganic lead halide perovskites based on α-alanine New Journal of Chemistry, 2021, 45, 12606-12612 |
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