Crystallography Open Database
Search results
Result: there are 2115 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 | archive of CIF files (ZIP)
Searching journal of publication like 'CrystEngComm' volume of publication is 14
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7206894 | CIF | C102 H84 Cu3 N2 O21 | P 42/n m c :2 | 40.284; 40.284; 17.66 90; 90; 90 | 28659 | Yu, Jin-Tao; Sun, Junliang; Huang, Zhi-Tang; Zheng, Qi-Yu A novel 1D independent metal‒organic nanotube based on cyclotriveratrylene ligand CrystEngComm, 2012, 14, 112 |
| 7206895 | CIF | C25 H28 Co N4 O6 | F d d d :2 | 12.9833; 25.7855; 30.5266 90; 90; 90 | 10219.7 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206896 | CIF | C25 H28 N4 O6 Zn | F d d d :2 | 12.96; 25.619; 30.85 90; 90; 90 | 10242.9 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206897 | CIF | C25 H24 Cd N4 O5 | P 1 21/n 1 | 9.6988; 15.9616; 15.1735 90; 98.865; 90 | 2320.9 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206898 | CIF | C25 H24 Co N4 O5 | P 61 2 2 | 9.6221; 9.6221; 48.4414 90; 90; 120 | 3884.07 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206899 | CIF | C54 H67 Cu2 N9 O15 | P -1 | 12.8829; 14.1565; 18.6819 104.822; 98.409; 113.367 | 2903.5 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206900 | CIF | C29.88 H37.38 N5.63 Ni O7.63 | C 1 2/c 1 | 14.7437; 24.709; 20.6058 90; 105.314; 90 | 7240.2 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206901 | CIF | C25 H24 N4 O5 Zn | P 61 2 2 | 9.6491; 9.6491; 48.258 90; 90; 120 | 3891.1 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206902 | CIF | C25 H24 Cu N4 O4 | C 1 2/c 1 | 24.573; 9.3013; 21.788 90; 110.754; 90 | 4656.7 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206903 | CIF | C50 H50 N8 Ni O8 | A b a 2 | 19.562; 15.8621; 15.3525 90; 90; 90 | 4763.8 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7206904 | CIF | C8 H5 Br4 O2 Ru | P 1 21/n 1 | 7.5104; 11.904; 29.32 90; 96.942; 90 | 2602.1 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Supramolecular interactions between hexabromoethane and cyclopentadienyl ruthenium bromides: Halogen bonding or electrostatic organisation? CrystEngComm, 2012, 14, 804 |
| 7206905 | CIF | C8 H5 Br4 O2 Ru | P -1 | 6.767; 7.475; 13.172 85.299; 89.063; 72.03 | 631.6 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Supramolecular interactions between hexabromoethane and cyclopentadienyl ruthenium bromides: Halogen bonding or electrostatic organisation? CrystEngComm, 2012, 14, 804 |
| 7206906 | CIF | C7 H5 Cl O2 Ru | P 1 21/c 1 | 6.6793; 10.676; 12.15 90; 99.859; 90 | 853.6 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206907 | CIF | C7 H5 Cl O2 Os | P 1 21/c 1 | 6.5729; 10.455; 12.066 90; 98.71; 90 | 819.6 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206908 | CIF | C12 H15 Cl O2 Ru | P -1 | 6.7919; 7.8225; 12.819 84.5; 87.327; 72.547 | 646.61 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206909 | CIF | C12 H15 Cl O2 Ru | P 1 21/n 1 | 12.0242; 7.9991; 14.1805 90; 106.583; 90 | 1307.19 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206910 | CIF | C8 H7 Cl O2 Ru | P 1 21/n 1 | 8.4488; 9.9193; 11.619 90; 107.559; 90 | 928.4 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206911 | CIF | C8 H7 Br O2 Ru | P -1 | 6.1076; 6.8545; 11.658 80.201; 82.342; 79.028 | 469.57 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206912 | CIF | C8 H7 I O2 Ru | P -1 | 6.9642; 7.4745; 10.068 92.968; 95.936; 108.783 | 491.49 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 7206913 | CIF | C13 H9 Br F N O | P 1 21/n 1 | 11.2187; 4.7411; 21.685 90; 93.91; 90 | 1150.7 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206914 | CIF | C13 H9 Br F N O | C 1 2/c 1 | 26.081; 5.2349; 17.549 90; 103.716; 90 | 2327.7 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206915 | CIF | C13 H9 Br F N O | P -1 | 5.0904; 10.696; 12.054 113.637; 97.827; 93.133 | 591.3 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206916 | CIF | C13 H9 Br F N O | P 21 21 21 | 4.3711; 5.1917; 50.481 90; 90; 90 | 1145.59 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206917 | CIF | C13 H9 Cl F N O | P 1 21/n 1 | 11.0184; 4.7429; 21.677 90; 94.101; 90 | 1129.9 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206918 | CIF | C13 H9 Cl F N O | C 1 2/c 1 | 25.6859; 5.2425; 17.3988 90; 104.252; 90 | 2270.78 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206919 | CIF | C13 H9 Cl F N O | P 1 21/n 1 | 13.6468; 12.3384; 13.7313 90; 90.686; 90 | 2311.91 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206920 | CIF | C13 H9 F I N O | P -1 | 5.1012; 11.0188; 12.441 64.411; 79.243; 87.18 | 619.23 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206921 | CIF | C13 H9 F I N O | P 1 21/n 1 | 11.5468; 4.7669; 21.94 90; 92.302; 90 | 1206.7 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206922 | CIF | C13 H9 F I N O | P n a 21 | 9.0447; 14.1185; 9.9862 90; 90; 90 | 1275.21 | Nayak, Susanta K.; Reddy, M. Kishore; Chopra, Deepak; Guru Row, Tayur N. Evaluation of the role of disordered organic fluorine in crystal packing: insights from halogen substituted benzanilides CrystEngComm, 2012, 14, 200 |
| 7206923 | CIF | C52 H50 Cl8 N2 O8 | C 1 2 1 | 25.444; 8.0222; 13.4912 90; 106.518; 90 | 2640.1 | Mahieux, Julien; Gonella, Silvia; Sanselme, Morgane; Coquerel, Gérard Crystal structure of a hybrid salt‒cocrystal and its resolution by preferential crystallization: ((±)trans-N,N′-dibenzyldiaminocyclohexane)(2,3-dichlorophenylacetic acid)4 CrystEngComm, 2012, 14, 103 |
| 7206924 | CIF | C8 H6 Cl2 O2 | P 1 21/c 1 | 4.8955; 12.3245; 14.503 90; 94.27; 90 | 872.6 | Mahieux, Julien; Gonella, Silvia; Sanselme, Morgane; Coquerel, Gérard Crystal structure of a hybrid salt‒cocrystal and its resolution by preferential crystallization: ((±)trans-N,N′-dibenzyldiaminocyclohexane)(2,3-dichlorophenylacetic acid)4 CrystEngComm, 2012, 14, 103 |
| 7206925 | CIF | C30 H24 Cl N4 O2 | P 1 21/c 1 | 19.03; 5.555; 25.191 90; 110.33; 90 | 2497.1 | Bruni, Giovanna; Maietta, Mariarosa; Berbenni, Vittorio; Bini, Marcella; Ferrari, Stefania; Capsoni, Doretta; Boiocchi, Massimo; Milanese, Chiara; Marini, Amedeo Preparation and characterization of carprofen co-crystals CrystEngComm, 2012, 14, 435 |
| 7206926 | CIF | C40 H32 Cl2 N4 O4 | P -1 | 9.2681; 12.4755; 16.074 73.308; 82.774; 75.228 | 1718.6 | Bruni, Giovanna; Maietta, Mariarosa; Berbenni, Vittorio; Bini, Marcella; Ferrari, Stefania; Capsoni, Doretta; Boiocchi, Massimo; Milanese, Chiara; Marini, Amedeo Preparation and characterization of carprofen co-crystals CrystEngComm, 2012, 14, 435 |
| 7206927 | CIF | C30 H24 Cl N4 O2 | P 1 21/c 1 | 19.0685; 5.5501; 25.148 90; 110.116; 90 | 2499.1 | Bruni, Giovanna; Maietta, Mariarosa; Berbenni, Vittorio; Bini, Marcella; Ferrari, Stefania; Capsoni, Doretta; Boiocchi, Massimo; Milanese, Chiara; Marini, Amedeo Preparation and characterization of carprofen co-crystals CrystEngComm, 2012, 14, 435 |
| 7206928 | CIF | C16 H23 I N6 O8 Zn | P 1 21/c 1 | 7.855; 17.546; 18.586 90; 111.626; 90 | 2381.3 | Zhang, Kou-Lin; Hou, Chuan-Tao; Song, Jing-Jing; Deng, Ye; Li, Liang; Ng, Seik Weng; Diao, Guo-Wang Temperature and auxiliary ligand-controlled supramolecular assembly in a series of Zn(ii)-organic frameworks: syntheses, structures and properties CrystEngComm, 2012, 14, 590 |
| 7206929 | CIF | C16 H15 I N6 O4 Zn | P 1 21/c 1 | 8.5844; 22.107; 10.2952 90; 102.313; 90 | 1908.8 | Zhang, Kou-Lin; Hou, Chuan-Tao; Song, Jing-Jing; Deng, Ye; Li, Liang; Ng, Seik Weng; Diao, Guo-Wang Temperature and auxiliary ligand-controlled supramolecular assembly in a series of Zn(ii)-organic frameworks: syntheses, structures and properties CrystEngComm, 2012, 14, 590 |
| 7206930 | CIF | C15 H17 I N6 O6 Zn | P 1 21/c 1 | 10.1291; 16.9901; 12.3894 90; 107.66; 90 | 2031.7 | Zhang, Kou-Lin; Hou, Chuan-Tao; Song, Jing-Jing; Deng, Ye; Li, Liang; Ng, Seik Weng; Diao, Guo-Wang Temperature and auxiliary ligand-controlled supramolecular assembly in a series of Zn(ii)-organic frameworks: syntheses, structures and properties CrystEngComm, 2012, 14, 590 |
| 7206931 | CIF | C14 H46 N8 O36 V10 | P -1 | 9.4462; 10.6899; 10.917 103.25; 98.612; 102.932 | 1022.07 | Lv, Yao-Kang; Jiang, Zhan-Guo; Gan, Li-Hua; Liu, Ming-Xian; Feng, Yun-Long Three novel organic-inorganic hybrid materials based on decaoxovanadates obtained from a new liquid phase reaction CrystEngComm, 2012, 14, 314 |
| 7206932 | CIF | C12 H62 Co2 N8 O46 V10 | C 1 2/c 1 | 22.0808; 9.7061; 24.3647 90; 109.045; 90 | 4936 | Lv, Yao-Kang; Jiang, Zhan-Guo; Gan, Li-Hua; Liu, Ming-Xian; Feng, Yun-Long Three novel organic-inorganic hybrid materials based on decaoxovanadates obtained from a new liquid phase reaction CrystEngComm, 2012, 14, 314 |
| 7206933 | CIF | C14 H42 N8 O34 V10 | P 1 21/c 1 | 12.0418; 15.7976; 11.0989 90; 107.98; 90 | 2008.25 | Lv, Yao-Kang; Jiang, Zhan-Guo; Gan, Li-Hua; Liu, Ming-Xian; Feng, Yun-Long Three novel organic-inorganic hybrid materials based on decaoxovanadates obtained from a new liquid phase reaction CrystEngComm, 2012, 14, 314 |
| 7206934 | CIF | C7 H5 Cl N2 | P 1 21/n 1 | 5.2586; 8.916; 13.8165 90; 90.5; 90 | 647.77 | Hazra, Dipak K.; Mukherjee, Alok K.; Helliwell, Madeleine; Mukherjee, Monika Topological features and electronic structure of 4-chloro-1H-pyrrolo[2,3-b]pyridine: experimental charge density analysis and DFT studies CrystEngComm, 2012, 14, 993 |
| 7206935 | CIF | C12 H11 N O2 | P -1 | 7.5975; 12.2026; 12.8137 61.607; 77.247; 78.353 | 1012.74 | Spingler, Bernhard; Schnidrig, Stephan; Todorova, Tonya; Wild, Ferdinand Some thoughts about the single crystal growth of small molecules CrystEngComm, 2012, 14, 751 |
| 7206936 | CIF | C24 H22 N4 O4 | P 1 21/c 1 | 9.3329; 12.7049; 9.1195 90; 98.085; 90 | 1070.58 | Spingler, Bernhard; Schnidrig, Stephan; Todorova, Tonya; Wild, Ferdinand Some thoughts about the single crystal growth of small molecules CrystEngComm, 2012, 14, 751 |
| 7206937 | CIF | C100 H80 Cu6 N20 O39 P W11 | P n a 21 | 27.84; 21.605; 20.145 90; 90; 90 | 12117 | Wang, Yan; Peng, Yu; Xiao, Li-Na; Hu, Yang-Yang; Wang, La-Mei; Gao, Zhong-Min; Wang, Tie-Gang; Wu, Feng-Qing; Cui, Xiao-Bing; Xu, Ji-Qing New compounds constructed from polyoxometalates and transition metal coordination complexes with lower positive charge CrystEngComm, 2012, 14, 1049 |
| 7206938 | CIF | C100 H80 B Cu5 N20 O40 W12 | P n a 21 | 28.117; 21.4312; 19.6445 90; 90; 90 | 11837.4 | Wang, Yan; Peng, Yu; Xiao, Li-Na; Hu, Yang-Yang; Wang, La-Mei; Gao, Zhong-Min; Wang, Tie-Gang; Wu, Feng-Qing; Cui, Xiao-Bing; Xu, Ji-Qing New compounds constructed from polyoxometalates and transition metal coordination complexes with lower positive charge CrystEngComm, 2012, 14, 1049 |
| 7206939 | CIF | C96 H72 B Cu5 N16 O44 W12 | P -1 | 12.506; 14.025; 31.972 78.45; 82.58; 87.87 | 5448 | Wang, Yan; Peng, Yu; Xiao, Li-Na; Hu, Yang-Yang; Wang, La-Mei; Gao, Zhong-Min; Wang, Tie-Gang; Wu, Feng-Qing; Cui, Xiao-Bing; Xu, Ji-Qing New compounds constructed from polyoxometalates and transition metal coordination complexes with lower positive charge CrystEngComm, 2012, 14, 1049 |
| 7206940 | CIF | C80 H64 Cu4 N16 O40 Si W12 | P -1 | 13.4495; 13.716; 28.536 82.489; 79.829; 79.841 | 5073.2 | Wang, Yan; Peng, Yu; Xiao, Li-Na; Hu, Yang-Yang; Wang, La-Mei; Gao, Zhong-Min; Wang, Tie-Gang; Wu, Feng-Qing; Cui, Xiao-Bing; Xu, Ji-Qing New compounds constructed from polyoxometalates and transition metal coordination complexes with lower positive charge CrystEngComm, 2012, 14, 1049 |
| 7206941 | CIF | C80 H64 Cu4 N16 O40 P W12 | P -1 | 13.297; 13.673; 28.4 82.43; 80.66; 79.91 | 4988 | Wang, Yan; Peng, Yu; Xiao, Li-Na; Hu, Yang-Yang; Wang, La-Mei; Gao, Zhong-Min; Wang, Tie-Gang; Wu, Feng-Qing; Cui, Xiao-Bing; Xu, Ji-Qing New compounds constructed from polyoxometalates and transition metal coordination complexes with lower positive charge CrystEngComm, 2012, 14, 1049 |
| 7206942 | CIF | C10 H14 O3 | P 1 21 1 | 13.0132; 4.8558; 16.371 90; 109.235; 90 | 976.73 | Bredikhin, Alexander A.; Zakharychev, Dmitry V.; Bredikhina, Zemfira A.; Gubaidullin, Aidar T.; Fayzullin, Robert R. Crystal structure and phase behavior of the tolyl glycerol ethers. From the conglomerate former to the chirality-driven nanogelator CrystEngComm, 2012, 14, 211 |
| 7206943 | CIF | C10 H14 O3 | P 1 c 1 | 17.264; 4.7225; 11.9008 90; 90.091; 90 | 970.3 | Bredikhin, Alexander A.; Zakharychev, Dmitry V.; Bredikhina, Zemfira A.; Gubaidullin, Aidar T.; Fayzullin, Robert R. Crystal structure and phase behavior of the tolyl glycerol ethers. From the conglomerate former to the chirality-driven nanogelator CrystEngComm, 2012, 14, 211 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!