Crystallography Open Database
Search results
Result: there are 1796 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 'Chem.Commun.' volume of publication is 51
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7117480 | CIF | C16 H24 Ti | P 1 21/n 1 | 9.5686; 10.0906; 15.5541 90; 97.1528; 90 | 1490.11 | Robert T. Cooper; F. Mark Chadwick; Andrew E. Ashley; Dermot O'Hare Double CO2 activation by 14-electron eta^8^-permethylpentalene titanium dialkyl complexes Chem.Commun., 2015, 51, 11856 |
| 7117481 | CIF | C28 H32 Ti | P -1 | 9.4641; 10.4852; 13.112 72.5421; 79.0295; 64.7729 | 1119.89 | Robert T. Cooper; F. Mark Chadwick; Andrew E. Ashley; Dermot O'Hare Double CO2 activation by 14-electron eta^8^-permethylpentalene titanium dialkyl complexes Chem.Commun., 2015, 51, 11856 |
| 7117482 | CIF | C18 H24 O4 Ti | P -1 | 8.0338; 9.4658; 11.9668 78.479; 88.7238; 75.3323 | 862.25 | Robert T. Cooper; F. Mark Chadwick; Andrew E. Ashley; Dermot O'Hare Double CO2 activation by 14-electron eta^8^-permethylpentalene titanium dialkyl complexes Chem.Commun., 2015, 51, 11856 |
| 7117483 | CIF | C30 H32 O4 Ti | C 1 2/c 1 | 34.424; 8.8424; 19.0704 90; 119.263; 90 | 5064.08 | Robert T. Cooper; F. Mark Chadwick; Andrew E. Ashley; Dermot O'Hare Double CO2 activation by 14-electron eta^8^-permethylpentalene titanium dialkyl complexes Chem.Commun., 2015, 51, 11856 |
| 7117484 | CIF | C34 H30 N5 Nb O13 | P -1 | 8.934; 11.3774; 17.883 78.587; 78.363; 70.115 | 1657.6 | Willian X. C. Oliveira; Cynthia L. M. Pereira; Carlos B. Pinheiro; Joan Cano; Francesc Lloret; Miguel Julve Relatively strong intramolecular antiferromagnetic coupling in a neutral CrIII2NbV2 heterobimetallic molecular square Chem.Commun., 2015, 51, 11806 |
| 7117485 | CIF | C28 H60 Cr2 Nb2 O30 S10 | P -1 | 11.4285; 12.1741; 12.185 98.122; 116.838; 94.962 | 1475.7 | Willian X. C. Oliveira; Cynthia L. M. Pereira; Carlos B. Pinheiro; Joan Cano; Francesc Lloret; Miguel Julve Relatively strong intramolecular antiferromagnetic coupling in a neutral CrIII2NbV2 heterobimetallic molecular square Chem.Commun., 2015, 51, 11806 |
| 7117508 | CIF | C20 H17 N3 O0 | P 1 21/c 1 | 17.0546; 5.5978; 16.1901 90; 105.328; 90 | 1490.66 | R. N. Prasad Tulichala; K. C. Kumara Swamy Palladium-catalysed decarboxylative nitrile insertion via C-H activation or self-coupling of indole-2-carboxylic acids: a new route to indolocarbolines and triindoles Chem.Commun., 2015, 51, 12008 |
| 7117509 | CIF | C26 H21 N3 | P 1 21/c 1 | 13.1017; 20.7038; 7.3429 90; 105.921; 90 | 1915.4 | R. N. Prasad Tulichala; K. C. Kumara Swamy Palladium-catalysed decarboxylative nitrile insertion via C-H activation or self-coupling of indole-2-carboxylic acids: a new route to indolocarbolines and triindoles Chem.Commun., 2015, 51, 12008 |
| 7117510 | CIF | C30 H27 N3 O3 | P c a 21 | 21.214; 8.2654; 27.017 90; 90; 90 | 4737.2 | R. N. Prasad Tulichala; K. C. Kumara Swamy Palladium-catalysed decarboxylative nitrile insertion via C-H activation or self-coupling of indole-2-carboxylic acids: a new route to indolocarbolines and triindoles Chem.Commun., 2015, 51, 12008 |
| 7117511 | CIF | C48 H39 N3 O3 S0 | C 1 2/c 1 | 14.8372; 26.503; 18.224 90; 96.42; 90 | 7121.3 | R. N. Prasad Tulichala; K. C. Kumara Swamy Palladium-catalysed decarboxylative nitrile insertion via C-H activation or self-coupling of indole-2-carboxylic acids: a new route to indolocarbolines and triindoles Chem.Commun., 2015, 51, 12008 |
| 7117512 | CIF | C12 H10 N2 | P 1 21/c 1 | 9.0822; 14.3844; 7.6234 90; 92.165; 90 | 995.2 | R. N. Prasad Tulichala; K. C. Kumara Swamy Palladium-catalysed decarboxylative nitrile insertion via C-H activation or self-coupling of indole-2-carboxylic acids: a new route to indolocarbolines and triindoles Chem.Commun., 2015, 51, 12008 |
| 7117513 | CIF | C32 H38 B20 | P -1 | 11.066; 13.248; 14.418 114.692; 103.244; 94.149 | 1835.3 | Jixi Guo; Danqing Liu; Jiahui Zhang; Jiji Zhang; Qian Miao; Zuowei Xie o-Carborane functionalized pentacenes: synthesis, molecular packing and ambipolar organic thin-film transistors Chem.Commun., 2015, 51, 12004 |
| 7117514 | CIF | C34 H42 B20 | C 1 2/c 1 | 20.184; 14.426; 14.526 90; 118.624; 90 | 3712.7 | Jixi Guo; Danqing Liu; Jiahui Zhang; Jiji Zhang; Qian Miao; Zuowei Xie o-Carborane functionalized pentacenes: synthesis, molecular packing and ambipolar organic thin-film transistors Chem.Commun., 2015, 51, 12004 |
| 7117515 | CIF | C38 H50 B20 | P 1 21/n 1 | 6.7399; 9.6832; 30.293 90; 93.691; 90 | 1972.9 | Jixi Guo; Danqing Liu; Jiahui Zhang; Jiji Zhang; Qian Miao; Zuowei Xie o-Carborane functionalized pentacenes: synthesis, molecular packing and ambipolar organic thin-film transistors Chem.Commun., 2015, 51, 12004 |
| 7117516 | CIF | C42 H21 O3 P S | P 1 21 1 | 10.913; 16.97; 17.246 90; 100.936; 90 | 3135.8 | Masaki Yamamura; Kimiya Sukegawa; Tatsuya Nabeshima Tuning the depth of bowl-shaped phosphine hosts: capsule and pseudo-cage architectures in host-guest complexes with C60 fullerene Chem.Commun., 2015, 51, 12080 |
| 7117517 | CIF | C42 H21 O3 P | P 21 21 2 | 30.262; 51.48; 4.0818 90; 90; 90 | 6359 | Masaki Yamamura; Kimiya Sukegawa; Tatsuya Nabeshima Tuning the depth of bowl-shaped phosphine hosts: capsule and pseudo-cage architectures in host-guest complexes with C60 fullerene Chem.Commun., 2015, 51, 12080 |
| 7117518 | CIF | C43 H22 Cl3 O3 P S | P 1 21/n 1 | 14.036; 16.26; 16.551 90; 109.896; 90 | 3552 | Masaki Yamamura; Kimiya Sukegawa; Tatsuya Nabeshima Tuning the depth of bowl-shaped phosphine hosts: capsule and pseudo-cage architectures in host-guest complexes with C60 fullerene Chem.Commun., 2015, 51, 12080 |
| 7117519 | CIF | C42 H23 O4 P | P -3 | 20.785; 20.785; 4.1189 90; 90; 120 | 1541 | Masaki Yamamura; Kimiya Sukegawa; Tatsuya Nabeshima Tuning the depth of bowl-shaped phosphine hosts: capsule and pseudo-cage architectures in host-guest complexes with C60 fullerene Chem.Commun., 2015, 51, 12080 |
| 7117520 | CIF | C144 H42 O6 P2 | R -3 :H | 19.058; 19.058; 20.787 90; 90; 120 | 6538 | Masaki Yamamura; Kimiya Sukegawa; Tatsuya Nabeshima Tuning the depth of bowl-shaped phosphine hosts: capsule and pseudo-cage architectures in host-guest complexes with C60 fullerene Chem.Commun., 2015, 51, 12080 |
| 7117521 | CIF | C231 H87 Cl9 O12 P4 S4 | P 41 | 31.8128; 31.8128; 16.4343 90; 90; 90 | 16632.4 | Masaki Yamamura; Kimiya Sukegawa; Tatsuya Nabeshima Tuning the depth of bowl-shaped phosphine hosts: capsule and pseudo-cage architectures in host-guest complexes with C60 fullerene Chem.Commun., 2015, 51, 12080 |
| 7117522 | CIF | C54 H56 N26 O16 | P -1 | 12.0755; 12.3189; 12.3197 106.538; 97.085; 107.693 | 1628.94 | Lei Mei; Lin Wang; Li-yong Yuan; Shu-wen An; Yu-liang Zhao; Zhi-fang Chai; Peter C. Burns; Wei-qun Shi Supramolecular inclusion-based molecular integral rigidity: a feasible strategy for controlling the structural connectivity of uranyl polyrotaxane networks Chem.Commun., 2015, 51, 11990 |
| 7117523 | CIF | C54 H52 N28 O22 | P -1 | 12.5869; 16.1378; 17.8631 87.78; 89.749; 67.888 | 3358.8 | Lei Mei; Lin Wang; Li-yong Yuan; Shu-wen An; Yu-liang Zhao; Zhi-fang Chai; Peter C. Burns; Wei-qun Shi Supramolecular inclusion-based molecular integral rigidity: a feasible strategy for controlling the structural connectivity of uranyl polyrotaxane networks Chem.Commun., 2015, 51, 11990 |
| 7117524 | CIF | C54 H56 N26 O22 S U | P -1 | 15.4905; 15.7934; 16.7184 68.423; 89.602; 83.048 | 3772.4 | Lei Mei; Lin Wang; Li-yong Yuan; Shu-wen An; Yu-liang Zhao; Zhi-fang Chai; Peter C. Burns; Wei-qun Shi Supramolecular inclusion-based molecular integral rigidity: a feasible strategy for controlling the structural connectivity of uranyl polyrotaxane networks Chem.Commun., 2015, 51, 11990 |
| 7117525 | CIF | C108 H112 Br2 N52 O34 U | P -1 | 12.6611; 15.3936; 17.0052 90.039; 97.817; 91.364 | 3282.6 | Lei Mei; Lin Wang; Li-yong Yuan; Shu-wen An; Yu-liang Zhao; Zhi-fang Chai; Peter C. Burns; Wei-qun Shi Supramolecular inclusion-based molecular integral rigidity: a feasible strategy for controlling the structural connectivity of uranyl polyrotaxane networks Chem.Commun., 2015, 51, 11990 |
| 7117526 | CIF | C108 H112 Br2 N52 O34 U | P -1 | 12.6458; 15.6109; 17.1344 89.597; 82.238; 84.826 | 3337.85 | Lei Mei; Lin Wang; Li-yong Yuan; Shu-wen An; Yu-liang Zhao; Zhi-fang Chai; Peter C. Burns; Wei-qun Shi Supramolecular inclusion-based molecular integral rigidity: a feasible strategy for controlling the structural connectivity of uranyl polyrotaxane networks Chem.Commun., 2015, 51, 11990 |
| 7117527 | CIF | C120 H136 Br2 N60 O46 U2 | P -1 | 13.333; 26.409; 26.515 81.73; 84.73; 84.24 | 9164 | Lei Mei; Lin Wang; Li-yong Yuan; Shu-wen An; Yu-liang Zhao; Zhi-fang Chai; Peter C. Burns; Wei-qun Shi Supramolecular inclusion-based molecular integral rigidity: a feasible strategy for controlling the structural connectivity of uranyl polyrotaxane networks Chem.Commun., 2015, 51, 11990 |
| 7117528 | CIF | C56 H32 N6 | P -1 | 9; 19.58; 23.93 77.99; 83.67; 89.86 | 4098.6 | Shipan Wang; Yuewei Zhang; Weiping Chen; Jinbei Wei; Yu Liu; Yue Wang Achieving high power efficiency and low roll-off OLEDs based on energy transfer from thermally activated delayed excitons to fluorescent dopants Chem.Commun., 2015, 51, 11972 |
| 7117529 | CIF | C26 H24 Br N O4 S | P 1 21 1 | 17.678; 9.856; 20.882 90; 103.673; 90 | 3535.3 | Zhong-Hua Gao; Xiang-Yu Chen; Han-Ming Zhang; Song Ye N-Heterocyclic carbene-catalyzed [3+3] cyclocondensation of bromoenals with aldimines: highly enantioselective synthesis of dihydropyridinones Chem.Commun., 2015, 51, 12040 |
| 7117530 | CIF | C23 H26 Cl N O5 Pt S | P -1 | 9.583; 9.8654; 14.2517 104.643; 95.718; 114.866 | 1149.74 | Oliver J. Stacey; Angelo J. Amoroso; James A. Platts; Peter N. Horton; Simon J. Coles; David Lloyd; Catrin F. Williams; Anthony J. Hayes; Jay J. Dunsford; Simon J. A. Pope Water soluble, cyclometalated Pt(II)-Ln(III) conjugates towards novel bimodal imaging agents Chem.Commun., 2015, 51, 12305 |
| 7117531 | CIF | C6 H6 Cl N O2 | P 1 21/c 1 | 12.132; 6.7332; 8.752 90; 91.331; 90 | 714.7 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117532 | CIF | C7 H5 Cl N2 O2 | P -1 | 6.037; 8.101; 9.222 70.622; 74.48; 85.612 | 409.9 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117533 | CIF | C12 H10 Cl2 N2 O4 | P 1 21/n 1 | 4.4859; 20.457; 14.7 90; 97.6; 90 | 1337.1 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117534 | CIF | C24 H18 Cl4 N4 O4 | P 1 21/c 1 | 3.9469; 27.0301; 10.9065 90; 98.544; 90 | 1150.65 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117535 | CIF | C24 H18 Cl4 N4 O4 | P 1 21/c 1 | 4.1263; 23.8718; 11.9867 90; 98.803; 90 | 1166.81 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117536 | CIF | C29 H21 Cl4 N5 O4 Zn | P 1 21/c 1 | 14.0391; 14.1663; 15.99 90; 113.95; 90 | 2906.3 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117537 | CIF | C29 H21 Cl4 N5 O4 Zn | P 1 21/c 1 | 10.7037; 17.9473; 15.8353 90; 106.927; 90 | 2910.2 | Anup Rana; Pradeepta K. Panda Beta-Tetrachlorotetramethoxyporphycenes: positional effect of substituents on structure and photophysical properties Chem.Commun., 2015, 51, 12239 |
| 7117538 | CIF | C26 H18 Ba2 F8 N2 O11 | P 1 21/n 1 | 7.0904; 32.27; 7.2698 90; 117.997; 90 | 1468.72 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117539 | CIF | C16 H2 Ba2 F8 O9 | C 1 2/c 1 | 12.5647; 7.1406; 19.823 90; 101.663; 90 | 1741.8 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117540 | CIF | C13 H6 Ca F4 N2 O7 | P 1 21/n 1 | 4.4398; 23.038; 14.3878 90; 96.661; 90 | 1461.71 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117541 | CIF | C13 H8 Ca F4 N2 O8 | P n a 21 | 14.2384; 16.3862; 6.845 90; 90; 90 | 1597.03 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117542 | CIF | C8 Cs F4 O4 | I 1 2/a 1 | 9.3605; 9.6918; 11.0752 90; 108.566; 90 | 952.45 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117543 | CIF | C8 F4 O4 Rb | I 1 2/a 1 | 9.2821; 9.7189; 10.9837 90; 110.34; 90 | 929.08 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117544 | CIF | C11 H10 F4 N O6 Sr | P -1 | 6.1469; 7.0452; 16.1438 94.495; 96.741; 101.639 | 676.26 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117545 | CIF | C42 H20 F16 N2 O20 Sr3 | C 1 2 1 | 32.076; 6.1638; 11.5618 90; 97.569; 90 | 2266 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117546 | CIF | C13 H8 F4 N2 O8 Sr | P n a 21 | 14.2686; 16.7326; 7.0181 90; 90; 90 | 1675.6 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117547 | CIF | C11 H15 F4 N O9 Sr | P -1 | 8.8263; 8.9293; 10.863 92.612; 93.939; 100.991 | 836.95 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117548 | CIF | C13 H8 F4 N2 O8 Sr | P -1 | 7.3008; 9.1264; 13.1904 101.118; 93.83; 110.526 | 798.95 | L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials Chem.Commun., 2015, 51, 12185 |
| 7117549 | CIF | C40 H20 O4 S8 | P 1 21/c 1 | 3.9761; 20.6573; 9.8948 90; 96.5712; 90 | 807.38 | Jie Liu; Jieshun Cui; Filipe Vilela; Jun He; Matthias Zeller; Allen D. Hunter; Zhengtao Xu In situ production of silver nanoparticles on an aldehyde-equipped conjugated porous polymer and subsequent heterogeneous reduction of aromatic nitro groups at room temperature Chem.Commun., 2015, 51, 12197 |
| 7117551 | CIF | C40 H132 Al18 Ga2 O110.5 S8 | P -1 | 10.0721; 16.7628; 17.7945 90.852; 99.861; 101.175 | 2900.3 | Fairley, M.; Corum, K. W.; Johns, A.; Unruh, D. K.; Basile, M.; de Groot, J.; Mason, S. E.; Forbes, T. Z. Isolation and characterization of the [Ga2Al18O8(OH)36(H2O)12](8+) cluster: cationic variations on the Wells-Dawson topology. Chemical communications (Cambridge, England), 2015, 51, 12467-12469 |
| 7117555 | CIF | C64 H68 Cl2 N4 O P4 | P 1 21/c 1 | 6.515; 27.407; 16.8094 90; 97.149; 90 | 2978.1 | Iglesias, Manuel; Iturmendi, Amaia; Sanz Miguel, Pablo J.; Polo, Victor; Pérez-Torrente, Jesús J; Oro, Luis A. Tuning PCP-Ir complexes: the impact of an N-heterocyclic olefin. Chemical communications (Cambridge, England), 2015, 51, 12431-12434 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!