Crystallography Open Database
Search results
Result: there are 13413 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'New Journal of Chemistry'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7052928 | CIF | C4 H8 N6 | P 1 21/c 1 | 7.533; 7.408; 12.029 90; 96.629; 90 | 666.8 | Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao 1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound New Journal of Chemistry, 2012, 36, 1953 |
| 7052929 | CIF | C10 H12 N2 O3 | P -1 | 8.779; 24.3199; 30.6605 71.677; 84.871; 83.43 | 6163.5 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7052930 | CIF | C16 H22 N2 O5 | P 1 21/c 1 | 16.1822; 4.8068; 21.7053 90; 102.36; 90 | 1649.21 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7052931 | CIF | C16 H22 N2 O5 | P -1 | 10.505; 12.843; 13.081 101.339; 90.243; 101.687 | 1692.7 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7052932 | CIF | C12 H16 N2 O3 | P -1 | 6.9305; 8.9843; 10.836 113.556; 95.236; 97.39 | 605.75 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7052933 | CIF | C13 H18 N2 O3 | P -1 | 6.991; 8.981; 11.398 67.479; 81.065; 83.458 | 651.877 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7052934 | CIF | C13 H18 N2 O3 | P -1 | 6.9587; 9.0375; 12.3302 68.763; 76.211; 82.636 | 701.2 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7052935 | CIF | Cu H4.8 N6.8 O1.2 | P n m a | 6.3808; 7.4452; 12.7044 90; 90; 90 | 603.54 | Tommasino, Jean-Bernard; Chastanet, Guillaume; Guennic, Boris Le; Robert, Vincent; Pilet, Guillaume A 1D coordination polymer built on asymmetric μ1,1,3-azide bridge: from unusual topology to magnetic properties and Cu(ii)/Cu(i) redox reversibility New Journal of Chemistry, 2012, 36, 2228 |
| 7052936 | CIF | C65 H106.08 Cl6 O39.04 S | P 21 21 2 | 26.907; 29.784; 20.352 90; 90; 90 | 16310 | Cruickshank, Dyanne L.; Bourne, Susan A.; Caira, Mino R. A solid-state study of the inclusion of endosulfan in native and derivatised cyclodextrins using X-ray diffraction and thermoanalytical methods New Journal of Chemistry, 2012, 36, 2007 |
| 7052937 | CIF | C20 H19 B F2 N2 O2 | P 1 21/c 1 | 11.408; 8.848; 18.193 90; 97.562; 90 | 1820.4 | Tsay, Olga G.; Lee, Kang Mun; Churchill, David G. Selective and competitive cysteine chemosensing: resettable fluorescent “turn on” aqueous detection via Cu2+ displacement and salicylaldimine hydrolysis New Journal of Chemistry, 2012, 36, 1949 |
| 7052938 | CIF | C23 H25 B F2 N2 O2 | P 1 21/n 1 | 13.996; 11.0508; 14.095 90; 100.373; 90 | 2144.4 | Tsay, Olga G.; Lee, Kang Mun; Churchill, David G. Selective and competitive cysteine chemosensing: resettable fluorescent “turn on” aqueous detection via Cu2+ displacement and salicylaldimine hydrolysis New Journal of Chemistry, 2012, 36, 1949 |
| 7052939 | CIF | C32 H60 Ni S8 | P -1 | 5.3358; 13.3538; 13.894 101.26; 90.396; 101.111 | 951.72 | Bui, Thanh-Tuan; Vuong, Minh Ha; Bonneval, Bénédicte Garreau-de; Alary, Fabienne; Kane, Jacob; Duhayon, Carine; Sournia-Saquet, Alix; Moineau-Chane-Ching, Kathleen I. Synthesis, X-ray crystal structures, optical properties and modelling data of neutral bis(1,2-dithiolene) nickel complexes of the “non-cyclic SR” family New Journal of Chemistry, 2012, 36, 2033 |
| 7052940 | CIF | C24 H44 Ni S8 | C 1 2/c 1 | 26.182; 6.4642; 19.9353 90; 107.729; 90 | 3213.7 | Bui, Thanh-Tuan; Vuong, Minh Ha; Bonneval, Bénédicte Garreau-de; Alary, Fabienne; Kane, Jacob; Duhayon, Carine; Sournia-Saquet, Alix; Moineau-Chane-Ching, Kathleen I. Synthesis, X-ray crystal structures, optical properties and modelling data of neutral bis(1,2-dithiolene) nickel complexes of the “non-cyclic SR” family New Journal of Chemistry, 2012, 36, 2033 |
| 7052941 | CIF | C14 H12 N4 | P 1 21/m 1 | 6.8273; 12.263; 7.4173 90; 97.954; 90 | 615.03 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052942 | CIF | C14 H15 Ag N5 O4.5 | P 1 21/n 1 | 9.1806; 16.9307; 11.4029 90; 112.485; 90 | 1637.7 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052943 | CIF | C15 H15 Ag Cl N4 O5 | P 1 21/c 1 | 9.3461; 16.2898; 12.2215 90; 108.782; 90 | 1761.6 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052944 | CIF | C15 H16 Ag B F4 N4 O | P 1 21/c 1 | 9.3243; 16.2532; 12.1352 90; 109.483; 90 | 1733.8 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052945 | CIF | C14 H12 N4 | P 1 21/n 1 | 5.8153; 12.6387; 16.3614 90; 92.692; 90 | 1201.2 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052946 | CIF | C28 H24 Ag2 N10 O6 | P -1 | 8.4131; 12.2429; 15.7364 90.055; 98.513; 107.133 | 1530.2 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052947 | CIF | C28 H24.5 Ag N8 O2 S0.5 | P -1 | 8.909; 11.0665; 14.3207 99.183; 101.952; 91.228 | 1361.4 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7052948 | CIF | C27 H27 N6 O9 | P -1 | 8.3257; 11.2037; 15.5132 70.668; 75.604; 84.442 | 1322.42 | Jung, Sung Ho; Lee, Hyejin; Park, Sunhong; Jung, Jong Hwa A cyanurate gel derived from two different hydrogen-bonding interactions in a binary system: evidence for the driving forces in gel formation New Journal of Chemistry, 2012, 36, 1957 |
| 7052949 | CIF | C20 H42 Co2 N4 O14 | P 21 21 21 | 11.9596; 12.1855; 19.6639 90; 90; 90 | 2865.69 | Prikhod'ko, Alexander; Pointillart, Fabrice; Golhen, Stéphane; Gavrilenko, Konstantin S.; Ouahab, Lahcène; Kolotilov, Sergey V. Synthesis, structure, circular dichroism of a Δ(−)546-di-μ-hydroxo-tetrakis(S-prolinato)dicobalt(iii) complex and NMR study of its interaction with chiral and non-chiral probes in solutions New Journal of Chemistry, 2012, 36, 2070 |
| 7052950 | CIF | C13 H12 N4 O | P 1 21/c 1 | 22.602; 5.5689; 20.209 90; 109.72; 90 | 2394.5 | Lin, Lirong; Fan, Weizhen; Chen, Shui; Ma, Jie; Hu, Wangxia; Lin, Yiji; Zhang, Hui; Huang, Rongbin Photochromism of (E)-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide New Journal of Chemistry, 2012, 36, 2562 |
| 7052951 | CIF | C29 H30 N8 O3 | P b c n | 17.889; 8.6684; 18.288 90; 90; 90 | 2835.9 | Lin, Lirong; Fan, Weizhen; Chen, Shui; Ma, Jie; Hu, Wangxia; Lin, Yiji; Zhang, Hui; Huang, Rongbin Photochromism of (E)-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide New Journal of Chemistry, 2012, 36, 2562 |
| 7052952 | CIF | C13 H12 N4 O | P 21 21 21 | 5.1873; 9.245; 25.3594 90; 90; 90 | 1216.15 | Lin, Lirong; Fan, Weizhen; Chen, Shui; Ma, Jie; Hu, Wangxia; Lin, Yiji; Zhang, Hui; Huang, Rongbin Photochromism of (E)-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide New Journal of Chemistry, 2012, 36, 2562 |
| 7052953 | CIF | C67 H90 In N5 O6 | P 1 21 1 | 12.3212; 40.491; 12.8009 90; 97.002; 90 | 6338.7 | Ilyakina, Ekaterina V.; Poddel'sky, Andrey I.; Piskunov, Alexandr V.; Fukin, Georgii K.; Bogomyakov, Artem S.; Cherkasov, Vladimir K.; Abakumov, Gleb A. The interaction of N,N′-bis(2,6-dimethylphenyl)imidazol-2-ylidene with o-benzosemiquinonato zinc(ii) and indium(iii) complexes New Journal of Chemistry, 2012, 36, 1944 |
| 7052954 | CIF | C20 H30 O2 | P 1 21 1 | 12.0425; 6.0319; 12.6615 90; 106.214; 90 | 883.14 | Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design New Journal of Chemistry, 2012, 36, 2292 |
| 7052955 | CIF | C19 H27 Cl O2 | P 1 21/n 1 | 12.5731; 5.9925; 23.9975 90; 104.709; 90 | 1748.82 | Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design New Journal of Chemistry, 2012, 36, 2292 |
| 7052956 | CIF | C19 H27 Br O2 | P 1 21/c 1 | 12.5505; 6.0048; 24.4004 90; 104.889; 90 | 1777.2 | Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design New Journal of Chemistry, 2012, 36, 2292 |
| 7052957 | CIF | C21 H32 O2 | P 1 21/c 1 | 12.665; 5.829; 25.713 90; 100.94; 90 | 1864 | Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design New Journal of Chemistry, 2012, 36, 2292 |
| 7052958 | CIF | C19 H24 Cl2 O | P -1 | 8.0433; 9.0769; 12.4273 103.78; 92.678; 92.933 | 878.4 | Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design New Journal of Chemistry, 2012, 36, 2292 |
| 7052959 | CIF | C220 H238 Fe4 N4 O P8 Zn | I 41/a :2 | 36.9262; 36.9262; 14.7933 90; 90; 90 | 20171.3 | Drouet, Samuel; Merhi, Areej; Grelaud, Guillaume; Cifuentes, Marie P.; Humphrey, Mark G.; Matczyszyn, Katarzyna; Samoc, Marek; Toupet, Loïc; Paul-Roth, Christine O.; Paul, Frédéric Enhanced two-photon absorption cross-sections of zinc(II) tetraphenylporphyrins peripherally substituted with d6-metal alkynyl complexes New Journal of Chemistry, 2012, 36, 2192 |
| 7052960 | CIF | C69 H81 N9 O9 | P 1 21/c 1 | 29.7377; 9.6031; 22.5784 90; 104.967; 90 | 6229.1 | Jin, Cheng-Cheng; Kinoshita, Takashi; Cong, Hang; Ni, Xin-Long; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko Synthesis and inclusion properties of C3-symmetric triazole derivatives based on hexahomotrioxacalix[3]arene New Journal of Chemistry, 2012, 36, 2580 |
| 7052961 | CIF | C20 H20 N P S | P 41 | 11.8572; 11.8572; 12.3816 90; 90; 90 | 1740.77 | Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K. N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere New Journal of Chemistry, 2012, 36, 2280 |
| 7052962 | CIF | C20 H20 N O P | P 21 21 21 | 9.068; 19.055; 20.228 90; 90; 90 | 3495 | Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K. N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere New Journal of Chemistry, 2012, 36, 2280 |
| 7052963 | CIF | C176 H180 Cl4 N4 P4 Zr4 | P n m a | 14.2392; 14.631; 18.0321 90; 90; 90 | 3756.7 | Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K. N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere New Journal of Chemistry, 2012, 36, 2280 |
| 7052964 | CIF | C20 H20 N P Se | P 43 | 11.8869; 11.8869; 12.6006 90; 90; 90 | 1780.44 | Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K. N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere New Journal of Chemistry, 2012, 36, 2280 |
| 7052965 | CIF | C40 H44 Cl2 Cu4 N14 O18 S4 | C 1 2/c 1 | 13.9583; 25.467; 15.4276 90; 103.572; 90 | 5331 | Li, Xin; Li, Xue-Jie; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei Syntheses and structures of tetracopper(ii) complexes with an N-benzoate-N′-[3-(2-hydroxylethylammino)propyl]oxamide ligand: reactivity towards DNA, cytotoxic and antimicrobial activities New Journal of Chemistry, 2012, 36, 2472 |
| 7052966 | CIF | C22 H26 Cl Cu2 N5 O10 S2 | P -1 | 11.8016; 11.884; 12.652 103.236; 101.213; 117.145 | 1442.6 | Li, Xin; Li, Xue-Jie; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei Syntheses and structures of tetracopper(ii) complexes with an N-benzoate-N′-[3-(2-hydroxylethylammino)propyl]oxamide ligand: reactivity towards DNA, cytotoxic and antimicrobial activities New Journal of Chemistry, 2012, 36, 2472 |
| 7052967 | CIF | C4 H6 N10 | P 21 21 21 | 7.0325; 9.919; 12.475 90; 90; 90 | 870.2 | Tang, Yongxing; Yang, Hongwei; Shen, Jianhua; Wu, Bo; Ju, Xuehai; Lu, Chunxu; Cheng, Guangbin Synthesis and characterization of 1,1′-azobis(5-methyltetrazole) New Journal of Chemistry, 2012, 36, 2447 |
| 7052968 | CIF | C16 H24 N2 O5 | P 1 21/c 1 | 11.336; 10.813; 16.926 90; 129.643; 90 | 1597.6 | Sleem, Hisham Fathy; Dawe, Louise Nicole; Georghiou, Paris Elias A tetraamido isophthaloyl-based macrocyclic calcium chloride and strontium chloride tritopic receptor New Journal of Chemistry, 2012, 36, 2451 |
| 7052969 | CIF | C32 H44 N4 O8 | P -1 | 5.0083; 9.048; 17.725 85.179; 82.023; 75.645 | 769.6 | Sleem, Hisham Fathy; Dawe, Louise Nicole; Georghiou, Paris Elias A tetraamido isophthaloyl-based macrocyclic calcium chloride and strontium chloride tritopic receptor New Journal of Chemistry, 2012, 36, 2451 |
| 7052970 | CIF | C8 H20 N2 O12 | P 1 21/c 1 | 4.8685; 17.2207; 17.2062 90; 91.668; 90 | 1441.94 | Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid New Journal of Chemistry, 2013, 37, 97 |
| 7052971 | CIF | C5 N O7 | P 1 21 1 | 14.3723; 6.2614; 9.1815 90; 92.112; 90 | 825.69 | Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid New Journal of Chemistry, 2013, 37, 97 |
| 7052972 | CIF | C8 H20 N2 O12 | P 1 21 1 | 4.8832; 11.9276; 12.4798 90; 92.018; 90 | 726.43 | Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid New Journal of Chemistry, 2013, 37, 97 |
| 7052973 | CIF | C8 N2 O12 | P 1 21 1 | 12.5711; 11.2144; 5.2079 90; 100.529; 90 | 721.83 | Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid New Journal of Chemistry, 2013, 37, 97 |
| 7052974 | CIF | C21 H30 F12 N6 P2 Ru S3 | P -1 | 11.7238; 11.7563; 13.1508 109.956; 94.499; 110.922 | 1549.4 | Todd, Adam M.; Swinburne, Adam N.; Goeta, Andrés E.; Steed, Jonathan W. Anion receptor coordination tripods capped by [9]ane-S3 New Journal of Chemistry, 2013, 37, 89 |
| 7052975 | CIF | C22 H32 N2 O10 Si2 | P 1 21/n 1 | 7.7341; 8.1924; 20.4587 90; 98.448; 90 | 1282.22 | Pfeifer, Stefan; Schwarzer, Anke; Schmidt, Dana; Brendler, Erica; Veith, Michael; Kroke, Edwin Precursors for pyromellit-bridged silica sol‒gel hybrid materials New Journal of Chemistry, 2013, 37, 169 |
| 7052976 | CIF | C24 H36 N2 O10 Si2 | P 1 21/c 1 | 14.2971; 7.7793; 25.6231 90; 99.546; 90 | 2810.38 | Pfeifer, Stefan; Schwarzer, Anke; Schmidt, Dana; Brendler, Erica; Veith, Michael; Kroke, Edwin Precursors for pyromellit-bridged silica sol‒gel hybrid materials New Journal of Chemistry, 2013, 37, 169 |
| 7052977 | CIF | C31 H26 O | P -1 | 7.8416; 10.779; 13.485 95.885; 98.485; 103.936 | 1082.8 | Moorthy, Jarugu Narasimha; Mandal, Susovan; Kumar, Amrit Photochromism of novel chromenes constrained to be part of [2.2]paracyclophane: remarkable ‘phane’ effects on the colored o-quinonoid intermediates New Journal of Chemistry, 2013, 37, 82 |
| 7052978 | CIF | C121 H151 La2 N21 O33 | P -1 | 18.2537; 18.39; 20.7899 74.209; 89.492; 87.577 | 6709.5 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052979 | CIF | C126 H159 Er N18 O23 | P -1 | 21.31; 21.575; 25.924 82.036; 86.57; 84.975 | 11744.8 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052980 | CIF | C120 H145 N21 O32 Yb2 | P -1 | 17.6026; 17.8227; 20.5821 81.527; 81.654; 88.492 | 6318.9 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052981 | CIF | C133 H169 N18 O22.5 Yb | P 21 3 | 23.7722; 23.7722; 23.7722 90; 90; 90 | 13434.1 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052982 | CIF | C139 H175 F9 N15 O18 S3 Yb | P -1 | 14.8807; 20.2373; 24.8721 95.009; 101.027; 107.138 | 6942.5 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052983 | CIF | C95 H105 F9 N15 O13 S3 Yb | C 1 c 1 | 24.8539; 13.987; 28.8206 90; 104.791; 90 | 9687 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052984 | CIF | C111 H83 F9 N21 O13 S3 Yb | P -1 | 13.6476; 16.3938; 23.0054 88.036; 89.204; 82.558 | 5100.5 | Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J. 1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems New Journal of Chemistry, 2013, 37, 119 |
| 7052985 | CIF | C46 H52 Cl4 Co2 N8 O2 | C 1 2/m 1 | 17.232; 15.471; 9.473 90; 114.15; 90 | 2304.4 | Jacobs, Tia; Barbour, Leonard J. Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion New Journal of Chemistry, 2013, 37, 71 |
| 7052986 | CIF | C44 H44 Cl4 Co2 N8 | C 1 2/c 1 | 20.02; 14.595; 17.102 90; 118.62; 90 | 4386.5 | Jacobs, Tia; Barbour, Leonard J. Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion New Journal of Chemistry, 2013, 37, 71 |
| 7052987 | CIF | C46 H52 Cl4 N8 O2 Zn2 | C 1 2/m 1 | 17.36; 15.483; 9.44 90; 113.97; 90 | 2319 | Jacobs, Tia; Barbour, Leonard J. Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion New Journal of Chemistry, 2013, 37, 71 |
| 7052988 | CIF | C44 H44 Cl4 N8 Zn2 | C 1 2/c 1 | 20.01; 14.658; 17.146 90; 118.325; 90 | 4426.9 | Jacobs, Tia; Barbour, Leonard J. Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion New Journal of Chemistry, 2013, 37, 71 |
| 7052989 | CIF | C68 H116 Ce2 O3 S | P 1 21/c 1 | 20.6275; 10.5366; 30.6641 90; 99.59; 90 | 6571.5 | Werkema, Evan L.; Castro, Ludovic; Maron, Laurent; Eisenstein, Odile; Andersen, Richard A. Cleaving bonds in CH3OSO2CF3 with [1,2,4-(Me3C)3C5H2]2CeH; an experimental and computational study New Journal of Chemistry, 2013, 37, 132 |
| 7052990 | CIF | C35 H58 Ce F3 O3 S | P 1 21/n 1 | 10.5673; 21.532; 16.3041 90; 98.267; 90 | 3671.2 | Werkema, Evan L.; Castro, Ludovic; Maron, Laurent; Eisenstein, Odile; Andersen, Richard A. Cleaving bonds in CH3OSO2CF3 with [1,2,4-(Me3C)3C5H2]2CeH; an experimental and computational study New Journal of Chemistry, 2013, 37, 132 |
| 7052991 | CIF | C16 H18 N8 O7 Zn2 | C 1 2/c 1 | 17.083; 11.2862; 11.2092 90; 106.755; 90 | 2069.4 | Lou, Benyong; He, Fengdan Coordination polymers as potential solid forms of drugs: three zinc(ii) coordination polymers of theophylline with biocompatible organic acids New Journal of Chemistry, 2013, 37, 309 |
| 7052992 | CIF | C21 H20 N8 O7 Zn2 | C 1 2/c 1 | 16.023; 13.4229; 11.4932 90; 103.331; 90 | 2405.3 | Lou, Benyong; He, Fengdan Coordination polymers as potential solid forms of drugs: three zinc(ii) coordination polymers of theophylline with biocompatible organic acids New Journal of Chemistry, 2013, 37, 309 |
| 7052993 | CIF | C13 H11 N5 O4 Zn | P b c a | 11.8565; 11.048; 20.2252 90; 90; 90 | 2649.3 | Lou, Benyong; He, Fengdan Coordination polymers as potential solid forms of drugs: three zinc(ii) coordination polymers of theophylline with biocompatible organic acids New Journal of Chemistry, 2013, 37, 309 |
| 7052994 | CIF | C138.5 H131 Cl N14 O23 Zn2 | P -1 | 13.5277; 15.3111; 17.7296 86.083; 67.796; 77.863 | 3323.7 | Lang, Thomas; Graf, Ernest; Kyritsakas, Nathalie; Hosseini, Mir Wais Zinc‒ and palladium‒porphyrin based turnstiles New Journal of Chemistry, 2013, 37, 112 |
| 7052995 | CIF | C148 H156 N14 O23 Pd2 | P -1 | 14.8196; 17.1292; 17.1532 63.953; 84.648; 64.883 | 3518.9 | Lang, Thomas; Graf, Ernest; Kyritsakas, Nathalie; Hosseini, Mir Wais Zinc‒ and palladium‒porphyrin based turnstiles New Journal of Chemistry, 2013, 37, 112 |
| 7052996 | CIF | C19 H26 B N O5 | P 1 21/n 1 | 13.1083; 9.45522; 15.1358 90; 99.016; 90 | 1852.78 | Adamczyk-Woźniak, Agnieszka; Borys, Krzysztof M.; Madura, Izabela D.; Pawełko, Alicja; Tomecka, Ewelina; Żukowski, Kamil Lewis acidity and sugar receptor activity of 3-amino-substituted benzoxaboroles and their ortho-aminomethylphenylboronic acid analogues New Journal of Chemistry, 2013, 37, 188 |
| 7052997 | CIF | C25 H8 Cl2 F10 N4 S | C 1 2/c 1 | 35.577; 6.4458; 12.9791 90; 109.18; 90 | 2811.2 | Moussallem, Chady; Allain, Magali; Gohier, Frédéric; Frère, Pierre Synthesis, electronic properties and packing modes of conjugated systems based on 2,5-di(cyanovinyl)furan or thiophene and imino-perfluorophenyl moieties New Journal of Chemistry, 2013, 37, 409 |
| 7052998 | CIF | C24 H6 F10 N4 O | C 1 2/c 1 | 36.916; 6.298; 9.662 90; 101.03; 90 | 2204.9 | Moussallem, Chady; Allain, Magali; Gohier, Frédéric; Frère, Pierre Synthesis, electronic properties and packing modes of conjugated systems based on 2,5-di(cyanovinyl)furan or thiophene and imino-perfluorophenyl moieties New Journal of Chemistry, 2013, 37, 409 |
| 7052999 | CIF | C18 H22 Mg O13 Zn | P n m a | 22.017; 16.2879; 13.7909 90; 90; 90 | 4945.6 | Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands New Journal of Chemistry, 2013, 37, 380 |
| 7053000 | CIF | C18 H14 O9 Zn2 | P 1 21/c 1 | 12.0711; 12.2504; 13.3746 90; 101.194; 90 | 1940.15 | Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands New Journal of Chemistry, 2013, 37, 380 |
| 7053001 | CIF | C24 H26 O10 Zn3 | P -1 | 8.0667; 12.2547; 12.591 95.846; 93.184; 95.283 | 1230.3 | Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands New Journal of Chemistry, 2013, 37, 380 |
| 7053002 | CIF | C30 H36 Ba O14 Zn2 | C 1 m 1 | 18.14; 31.2496; 6.8627 90; 106.35; 90 | 3732.9 | Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands New Journal of Chemistry, 2013, 37, 380 |
| 7053003 | CIF | C21 H17 N3 O3 | R -3 :H | 34.465; 34.465; 7.825 90; 90; 120 | 8050 | Xu, Huajie; Liu, Zhaodi; Sheng, Liangquan; Chen, Mingming; Huang, Deqian; Zhang, Hong; Song, Chongfu; Chen, Shuisheng A novel “turn-on” fluorescent probe for Fe3+ in aqueous media based on CN isomerization New Journal of Chemistry, 2013, 37, 274 |
| 7053004 | CIF | C38 H34 F2 N4 O8 Zn | P -1 | 9.1543; 9.4031; 20.9383 77.882; 79.291; 83.454 | 1726.21 | Tarushi, Alketa; Kljun, Jakob; Turel, Iztok; Pantazaki, Anastasia A.; Psomas, George; Kessissoglou, Dimitris P. Zinc(II) complexes with the quinolone antibacterial drug flumequine: structure, DNA- and albumin-binding New Journal of Chemistry, 2013, 37, 342 |
| 7053005 | CIF | C24 H19 Cl F N3 O3 Zn | P -1 | 7.8443; 9.2261; 15.1286 100.316; 100.686; 96.171 | 1047.24 | Tarushi, Alketa; Kljun, Jakob; Turel, Iztok; Pantazaki, Anastasia A.; Psomas, George; Kessissoglou, Dimitris P. Zinc(ii) complexes with the quinolone antibacterial drug flumequine: structure, DNA- and albumin-binding New Journal of Chemistry, 2013, 37, 342 |
| 7053006 | CIF | C93.64 H13.16 F54 | P -1 | 12.448; 13.931; 22.376 86.52; 80.65; 69.71 | 3591.1 | Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I. Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20 New Journal of Chemistry, 2013, 37, 299 |
| 7053007 | CIF | C93 H7 F60 | P 1 21/n 1 | 14.524; 21.689; 23.545 90; 99.168; 90 | 7322.2 | Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I. Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20 New Journal of Chemistry, 2013, 37, 299 |
| 7053008 | CIF | C100.5 H12 F60 | P -1 | 14.7468; 15.55; 18.135 78.495; 82.54; 71.023 | 3844.1 | Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I. Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20 New Journal of Chemistry, 2013, 37, 299 |
| 7053009 | CIF | C20 H10 O2 S | P 1 21/c 1 | 11.7261; 6.3804; 19.3742 90; 90.906; 90 | 1449.34 | Seidel, Nadine; Hahn, Torsten; Liebing, Simon; Seichter, Wilhelm; Kortus, Jens; Weber, Edwin Synthesis and properties of new 9,10-anthraquinone derived compounds for molecular electronics New Journal of Chemistry, 2013, 37, 601 |
| 7053010 | CIF | C16 H13 Br O2 | C 1 c 1 | 18.3586; 8.6988; 8.3214 90; 98.203; 90 | 1315.31 | Seidel, Nadine; Hahn, Torsten; Liebing, Simon; Seichter, Wilhelm; Kortus, Jens; Weber, Edwin Synthesis and properties of new 9,10-anthraquinone derived compounds for molecular electronics New Journal of Chemistry, 2013, 37, 601 |
| 7053011 | CIF | C36 H29 N O5 V | P 1 21/a 1 | 10.8327; 20.919; 13.3107 90; 104.117; 90 | 2925.2 | Stilinović, Vladimir; Bučar, Dejan-Krešimir; Halasz, Ivan; Meštrović, Ernest VO⋯C interactions in crystal structures of oxovanadium-coordination compounds New Journal of Chemistry, 2013, 37, 619 |
| 7053012 | CIF | C42 H36 N2 O6 S V | P -1 | 10.333; 14.007; 14.251 77.356; 70.407; 77.535 | 1873.2 | Stilinović, Vladimir; Bučar, Dejan-Krešimir; Halasz, Ivan; Meštrović, Ernest VO⋯C interactions in crystal structures of oxovanadium-coordination compounds New Journal of Chemistry, 2013, 37, 619 |
| 7053013 | CIF | C16 H20 N2 O | P 1 21/c 1 | 11.7951; 9.4577; 12.8525 90; 91.093; 90 | 1433.49 | Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols New Journal of Chemistry, 2013, 37, 563 |
| 7053014 | CIF | C13 H13 N O2 | P 1 21/c 1 | 8.489; 17.2434; 8.1339 90; 110.61; 90 | 1114.43 | Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols New Journal of Chemistry, 2013, 37, 563 |
| 7053015 | CIF | C14 H12 N2 O | P c a 21 | 10.6147; 11.5927; 9.2553 90; 90; 90 | 1138.89 | Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols New Journal of Chemistry, 2013, 37, 563 |
| 7053016 | CIF | C21 H20 O2 | P 21 21 21 | 5.9087; 12.77; 21.8373 90; 90; 90 | 1647.71 | Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols New Journal of Chemistry, 2013, 37, 563 |
| 7053017 | CIF | C21 H26 N4 O4 | R -3 :H | 32.989; 32.989; 7.098 90; 90; 120 | 6690 | Olivari, Martina; Caltagirone, Claudia; Garau, Alessandra; Isaia, Francesco; Light, Mark E.; Lippolis, Vito; Montis, Riccardo; Scorciapino, Mariano Andrea Non-symmetric substituted ureas locked in an (E,Z) conformation: an unusual anion binding via supramolecular assembly New Journal of Chemistry, 2013, 37, 663 |
| 7053018 | CIF | C18 H14 N4 O | P n a 21 | 22.003; 7.1308; 18.677 90; 90; 90 | 2930.4 | Olivari, Martina; Caltagirone, Claudia; Garau, Alessandra; Isaia, Francesco; Light, Mark E.; Lippolis, Vito; Montis, Riccardo; Scorciapino, Mariano Andrea Non-symmetric substituted ureas locked in an (E,Z) conformation: an unusual anion binding via supramolecular assembly New Journal of Chemistry, 2013, 37, 663 |
| 7053019 | CIF | C19 H14 N4 O | P 1 21/c 1 | 8.041; 19.459; 18.998 90; 94.696; 90 | 2962.6 | Olivari, Martina; Caltagirone, Claudia; Garau, Alessandra; Isaia, Francesco; Light, Mark E.; Lippolis, Vito; Montis, Riccardo; Scorciapino, Mariano Andrea Non-symmetric substituted ureas locked in an (E,Z) conformation: an unusual anion binding via supramolecular assembly New Journal of Chemistry, 2013, 37, 663 |
| 7053020 | CIF | C2 H8 Cu N8 | C 1 2/c 1 | 17.665; 6.3279; 26.063 90; 100.725; 90 | 2862.5 | Wu, Bi-Dong; Zhou, Zun-Ning; Li, Fu-Gang; Yang, Li; Zhang, Tong-Lai; Zhang, Jian-Guo Preparation, crystal structures, thermal decompositions and explosive properties of two new high-nitrogen azide ethylenediamine energetic compounds New Journal of Chemistry, 2013, 37, 646 |
| 7053021 | CIF | C4 H16 Co N11 O3 | C 1 2/c 1 | 13.671; 9.447; 9.343 90; 100.349; 90 | 1187 | Wu, Bi-Dong; Zhou, Zun-Ning; Li, Fu-Gang; Yang, Li; Zhang, Tong-Lai; Zhang, Jian-Guo Preparation, crystal structures, thermal decompositions and explosive properties of two new high-nitrogen azide ethylenediamine energetic compounds New Journal of Chemistry, 2013, 37, 646 |
| 7053022 | CIF | C82 H104 N4 O8 Zn | P -1 | 15.9841; 20.584; 24.9501 111.656; 106.005; 94.5871 | 7180.5 | Raymont, Victoria; Wilson, Hannah; Pfrunder, Michael; McMurtrie, John C.; Mullen, Kathleen M. New approaches to the synthesis of strapped porphyrin containing bipyridinium [2]rotaxanes New Journal of Chemistry, 2013, 37, 893 |
| 7053023 | CIF | C102 H92 Cr3 Mn3 N18 O16 | P 1 21/c 1 | 16.039; 20.336; 16.729 90; 91.988; 90 | 5453 | Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks New Journal of Chemistry, 2013, 37, 941 |
| 7053024 | CIF | C105 H98 Cr3 Mn3 N18 O16 | P 1 21/c 1 | 15.946; 20.452; 16.9 90; 92.377; 90 | 5506.8 | Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks New Journal of Chemistry, 2013, 37, 941 |
| 7053025 | CIF | C30 H22 Cr Mn N8 O2 | P 1 21/c 1 | 9.5129; 21.587; 13.479 90; 91.71; 90 | 2766.7 | Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks New Journal of Chemistry, 2013, 37, 941 |
| 7053026 | CIF | C31 H24 Cr Mn N8 O2 | P 1 21/c 1 | 9.2635; 21.4; 14.823 90; 97.68; 90 | 2912.1 | Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks New Journal of Chemistry, 2013, 37, 941 |
| 7053027 | CIF | C28 H22 N2 O10 Zn | C 1 2/c 1 | 17.912; 7.1061; 20.966 90; 107.44; 90 | 2546 | Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid New Journal of Chemistry, 2013, 37, 933 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!