Crystallography Open Database
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| 7228234 | CIF | C27 H18 Ag Cl3 N2 O4 | P 21 21 2 | 16.426; 12.656; 11.482 90; 90; 90 | 2387 | Fukushima, Misaki; Kikkawa, Shoko; hikawa, hidemasa; Azumaya, Isao Synthesis and Solvent Vapor Induced Transformations of Crystals of 1D Coordination Polymer Assembled with Continuous Void Space CrystEngComm, 2017 |
| 7228245 | CIF | C24 H16 Co N6 O5 | P 21 21 2 | 16.979; 24.792; 6.1089 90; 90; 90 | 2571.5 | Zhou, Sheng-Bin; Wang, Xin-Fang; Du, Ceng-Ceng; Wang, Duo-Zhi; Jia, Dianzeng A series of new mixed-ligand complexes based on 3,6-bis(imidazol-1-yl)pyridazine: syntheses, structures, and catalytic activities CrystEngComm, 2017 |
| 7228852 | CIF | C21 H28 N2 O3 S | P 21 21 2 | 8.6256; 22.3286; 10.6389 90; 90; 90 | 2049.03 | Yang, Shiwei; Bian, Guangling; Chen, Zhongxiang; Xia, Xiaohan; Zhou, Mi; Cui, Caiyan; Song, Ling Highly efficient synthesis of chiral quaternary 3-aminooxindoles promoted by zinc(ii) chloride via Et2Zn-catalysed addition of Grignard reagents to isaltin-derived N-tert-butanesulfinyl ketimines RSC Adv., 2017, 7, 38216 |
| 7229381 | CIF | C26 H34 N4 O5 | P 21 21 2 | 29.942; 12.1964; 6.85035 90; 90; 90 | 2501.64 | Chen, Ran; Cheng, Zhongbin; Huang, Jian; Liu, Dong; Wu, Chongming; Guo, Peng; Lin, Wenhan Versicotides D–F, new cyclopeptides with lipid-lowering activities RSC Adv., 2017, 7, 49235 |
| 7229568 | CIF | C39 H52 N8 O2 Pd | P 21 21 2 | 27.8757; 15.985; 8.737 90; 90; 90 | 3893.1 | McMorran, David; McKay, Aidan P.; Gordon, Keith; Shillito, Georgina E. Cyclometallated Platinum(II) and Palladium(II) Complexes Containing 1,5-Diarylbiguanides: Synthesis, Characterisation and Hydrogen Bond-directed Assembly CrystEngComm, 2017 |
| 7229627 | CIF | C62 H62 Cd4 N6 O22 | P 21 21 2 | 14.0179; 27.727; 14.0053 90; 90; 90 | 5443.5 | Wu, Wei-Ping; Wu, Jian; Liu, Jian-Qiang; Trivedi, Manoj; Kumar, Abhinav Fabrication of a new metal‒organic framework for sensitive sensing of nitroaromatics and efficient dye adsorption RSC Advances, 2017, 7, 54522 |
| 7229942 | CIF | C34 H52 N2 O12 | P 21 21 2 | 17.9674; 10.3025; 9.3723 90; 90; 90 | 1734.9 | Nisar, Madiha; Sung, Herman H.-Y.; Puschmann, Horst; Lakerveld, Richard; Haynes, Richard K.; Williams, Ian D. 11-Azaartemisinin cocrystals with preserved lactam : acid heterosynthons CrystEngComm, 2018, 20, 1205 |
| 7229944 | CIF | C34 H52 N2 O13 | P 21 21 2 | 17.7811; 10.3174; 9.49693 90; 90; 90 | 1742.26 | Nisar, Madiha; Sung, Herman H.-Y.; Puschmann, Horst; Lakerveld, Richard; Haynes, Richard K.; Williams, Ian D. 11-Azaartemisinin cocrystals with preserved lactam : acid heterosynthons CrystEngComm, 2018, 20, 1205 |
| 7229945 | CIF | C37 H58 N2 O12 | P 21 21 2 | 17.5836; 10.3594; 9.9524 90; 90; 90 | 1812.88 | Nisar, Madiha; Sung, Herman H.-Y.; Puschmann, Horst; Lakerveld, Richard; Haynes, Richard K.; Williams, Ian D. 11-Azaartemisinin cocrystals with preserved lactam : acid heterosynthons CrystEngComm, 2018, 20, 1205 |
| 7230053 | CIF | C64 H64 Cl Cu2 N7 O13 | P 21 21 2 | 13.4231; 30.1689; 14.2158 90; 90; 90 | 5756.8 | Sampani, Stavroula I.; Loukopoulos, Edward; Azam, Mohammad; Griffiths, Kieran; Abdul-Sada, Alaa; Tizzard, Graham; Coles, Simon; Escuer, Albert; Tsipis, Athanassios; Kostakis, George E. Polynuclear ampyrone based 3d coordination clusters CrystEngComm, 2018, 20, 1411 |
| 7230973 | CIF | C26 H28 N4 O5 S | P 21 21 2 | 17.559; 17.5588; 8.3081 90; 90; 90 | 2561.5 | Sun, Jing; Zhang, Yu; Yan, Chao-Guo Tandem four-component reaction for efficient synthesis of dihydrothiophene with substituted amino acid ethyl esters RSC Advances, 2018, 8, 22498 |
| 7231261 | CIF | C12 H14 Li N O4 | P 21 21 2 | 10.1119; 10.5584; 11.746 90; 90; 90 | 1254.1 | Lestari, Monica; Lusi, Matteo; O'Leary, Aoife; O'Nolan, Daniel; Zaworotko, Michael J. Hygroscopicity of lithium coordination polymers and their solid solutions CrystEngComm, 2018, 20, 5940 |
| 7231262 | CIF | C8.05 H9.44 Li0.67 N0.67 O2.72 | P 21 21 2 | 10.0666; 10.5869; 11.7836 90; 90; 90 | 1255.83 | Lestari, Monica; Lusi, Matteo; O'Leary, Aoife; O'Nolan, Daniel; Zaworotko, Michael J. Hygroscopicity of lithium coordination polymers and their solid solutions CrystEngComm, 2018, 20, 5940 |
| 7231264 | CIF | C12 H14 Li N O4 | P 21 21 2 | 10.0679; 10.5702; 11.7537 90; 90; 90 | 1250.83 | Lestari, Monica; Lusi, Matteo; O'Leary, Aoife; O'Nolan, Daniel; Zaworotko, Michael J. Hygroscopicity of lithium coordination polymers and their solid solutions CrystEngComm, 2018, 20, 5940 |
| 7231897 | CIF | C22 H30 O3 | P 21 21 2 | 12.3071; 19.3724; 8.0124 90; 90; 90 | 1910.3 | Anees, M.; Nayak, S.; Afarinkia, K.; Vinader, V. Control of the stereochemistry of C14 hydroxyl during the total synthesis of withanolide E and physachenolide C RSC Advances, 2018, 8, 39691 |
| 7231986 | CIF | C34 H30 Co N4 O8 | P 21 21 2 | 15.397; 15.921; 6.253 90; 90; 90 | 1532.8 | Kong, Jiao-Jiao; Shao, Dong; Zhang, Jia-Chen; Jiang, Yu-Xuan; Ji, Cheng-Long; Huang, Xing-Cai From mononuclear to two-dimensional cobalt(ii) complexes based on a mixed benzimidazole–dicarboxylate strategy: syntheses, structures, and magnetic properties CrystEngComm, 2019, 21, 749 |
| 7232194 | CIF | C16.62 H18 Cu4 N10.38 | P 21 21 2 | 13.0156; 14.3792; 12.3581 90; 90; 90 | 2312.87 | Xu, Hui; Zhou, Bo-Yu; Yu, Kai; Su, Zhan-Hua; Zhou, Bai-Bin; Su, Zhong-Min Copper cyanide polymers with controllable dimensions modulated by rigid and flexible bis-(imidazole) ligands: synthesis, crystal structure and fluorescence properties CrystEngComm, 2019, 21, 1242 |
| 7232428 | CIF | C23 H32 N4 O2 | P 21 21 2 | 25.636; 16.5436; 5.05085 90; 90; 90 | 2142.12 | Gorla, Lingaraju; Martí-Centelles, Vicente; Altava, Belén; Burguete, M. Isabel; Luis, Santiago V. The role of the side chain in the conformational and self-assembly patterns of C2-symmetric Val and Phe pseudopeptidic derivatives CrystEngComm, 2019, 21, 2398 |
| 7232651 | CIF | C32 H30 N2 O10 | P 21 21 2 | 20.0542; 11.4435; 12.2782 90; 90; 90 | 2817.73 | Itoh, Kennosuke; Odate, Fumiya; Karikomi, Takuma; Obe, Keishi; Miyamori, Tsutomu; Kamiya, Hideaki; Yoza, Kenji; Nagai, Kenichiro; Fujii, Hideaki; Suga, Hiroyuki; Tokunaga, Ken Novel asymmetric photodimerization reaction of coumarin derivatives bearing a chiral 2-oxazolidinone auxiliary RSC Advances, 2019, 9, 12365 |
| 7232690 | CIF | C25 H23 N O3 | P 21 21 2 | 14.3139; 15.9294; 9.1186 90; 90; 90 | 2079.15 | Bendzińska-Berus, Wioletta; Jelecki, Maciej; Kwit, Marcin; Rychlewska, Urszula Transfer of chirality in N-triphenylacetylamino acids and chiral derivatives of N-triphenylacetyl Gly–Gly dipeptide and control of their assembly with steric constraints CrystEngComm, 2019, 21, 3420 |
| 7232728 | CIF | C13.5 H11 N4 O3 Zn | P 21 21 2 | 17.578; 8.18; 10.632 90; 90; 90 | 1528.8 | Wang, Ke; Su, Hao; Wang, Pengfei; Wang, Wenjie; Li, Hui The enhancement of the D‒A effect of an asymmetric Schiff base by introducing acetyl groups into diaminomaleonitrile: synthesis, red fluorescence and crystal structure RSC Advances, 2019, 9, 14268 |
| 7233239 | CIF | C26 H32 Cd N2 O7 | P 21 21 2 | 14.5475; 28.4089; 6.1616 90; 90; 90 | 2546.46 | Forquin, Benjamin; Berthaud, Julien; Jouaiti, Abdelaziz; Kyritskas, Nathalie; Ferlay, Sylvie; Hosseini, Mir Wais Molecular tectonics: enantiomerically pure chiral crystals based on trans-1,2-cyclohexanediol CrystEngComm, 2019, 21, 5129 |
| 7233242 | CIF | C26 H32 Cd N2 O7 | P 21 21 2 | 14.5483; 28.4278; 6.166 90; 90; 90 | 2550.11 | Forquin, Benjamin; Berthaud, Julien; Jouaiti, Abdelaziz; Kyritskas, Nathalie; Ferlay, Sylvie; Hosseini, Mir Wais Molecular tectonics: enantiomerically pure chiral crystals based on trans-1,2-cyclohexanediol CrystEngComm, 2019, 21, 5129 |
| 7233826 | CIF | C20 H11 N O3 | P 21 21 2 | 13.1356; 10.4952; 10.6469 90; 90; 90 | 1467.8 | Sunil Kumar; Punita Singh; Ritu Srivastava; Rik Rani Koner; Avijit Pramanik; Jomon Mathew; Sougata Sinha; Madhu Rawat; R. S. Anand; Subrata Ghosh Engineering fused coumarin dyes: a molecular level understanding of aggregation quenching and tuning electroluminescence via alkyl chain substitution Journal of Materials Chemistry C, 2014, 2, 6637-6647 |
| 7234596 | CIF | C34 H34 O6 S2 | P 21 21 2 | 20.427; 28.01; 5.26 90; 90; 90 | 3010 | Xiaoqin Shen; Yonghao Zheng; Fred Wudl Thermally induced reversible solid-state transformation of novel s-indacene 1,3,5,7-tetraone derivatives Journal of Materials Chemistry C, 2016, 4, 2427-2431 |
| 7234648 | CIF | C18 H30 Cl4 N4 O | P 21 21 2 | 15.872; 7.3428; 9.2728 90; 90; 90 | 1080.7 | Guo, Fang; Li, Hai Tao; Famulari, Antonino; Xin, Lianxin; Zhou, Hongjian; Zhang, Peng Stoichiometry mechanosynthesis and interconversion of metal salts containing [CuCl3(H2O)]- and [Cu2Cl8]4- CrystEngComm, 2019 |
| 7234919 | CIF | C18 H28 Cl6 Cu N4 | P 21 21 2 | 13.7107; 23.0021; 7.9717 90; 90; 90 | 2514.1 | Li, Haitao; Yang, Yuxia; Famulari, Antonino; Xin, Lianxin; Martí-Rujas, Javier; Guo, Fang Reactivity among first and second coordination spheres using a multiprotonated ligand and Cu(ii) in the solid-state CrystEngComm, 2019, 21, 4354 |
| 7235915 | CIF | C56 H62 N2 O9 S2 | P 21 21 2 | 15.2948; 18.2388; 9.5627 90; 90; 90 | 2667.6 | Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Xie, Xin-Yu; Zhu, Zhi-Biao; Gao, Shan Nature of reactant and influence of water on the supramolecular patterns and luminescent properties of organic salts comprising (1,1′-biphenyl)-4,4′-disulfonate and triphenylmethanaminium RSC Advances, 2015, 5, 41692 |
| 7235916 | CIF | C58 H66 N2 O9 S2 | P 21 21 2 | 18.878; 15.3625; 9.4488 90; 90; 90 | 2740.3 | Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Xie, Xin-Yu; Zhu, Zhi-Biao; Gao, Shan Nature of reactant and influence of water on the supramolecular patterns and luminescent properties of organic salts comprising (1,1′-biphenyl)-4,4′-disulfonate and triphenylmethanaminium RSC Advances, 2015, 5, 41692 |
| 7235917 | CIF | C60 H70 N2 O9 S2 | P 21 21 2 | 19.8998; 15.4214; 9.2206 90; 90; 90 | 2829.64 | Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Xie, Xin-Yu; Zhu, Zhi-Biao; Gao, Shan Nature of reactant and influence of water on the supramolecular patterns and luminescent properties of organic salts comprising (1,1′-biphenyl)-4,4′-disulfonate and triphenylmethanaminium RSC Advances, 2015, 5, 41692 |
| 7237244 | CIF | C60 H64 Al2 Mg O11 | P 21 21 2 | 14.1081; 21.3826; 8.9782 90; 90; 90 | 2708.43 | Keyzer, Evan N.; Lee, Jeongjae; Liu, Zigeng; Bond, Andrew D.; Wright, Dominic S.; Grey, Clare P. A general synthetic methodology to access magnesium aluminate electrolyte systems for Mg batteries Journal of Materials Chemistry A, 2019, 7, 2677 |
| 7238341 | CIF | C22 H16 N4 O4 | P 21 21 2 | 5.0497; 28.8108; 6.3242 90; 90; 90 | 920.08 | Bailey, Andrew James; Horton, Peter Neil; Grossel, Martin Christopher Self-assembly into infinite tapes by 2,7-disubstituted-1,8-naphthyridines in the solid state CrystEngComm, 2010, 12, 4074 |
| 7238553 | CIF | C8 H16 I3 N4 S2 | P 21 21 2 | 12.2118; 25.3633; 5.6918 90; 90; 90 | 1762.93 | Owczarzak, Anita M.; Kubicki, Maciej; Kourkoumelis, Nikolaos; Hadjikakou, Sotiris K. Stabilization of poly-iodides: structural influences of the cationic disulfides of 2-mercapto-3,4,5,6-tetrahydro-pyrimidine and 2-mercatpo-pyrimidine RSC Advances, 2012, 2, 2856 |
| 7238827 | CIF | C61 H63 F6 N12 Ni2 O12.5 | P 21 21 2 | 24.1322; 8.2047; 15.471 90; 90; 90 | 3063.22 | Lin, Jian-Wen; Thanasekaran, Pounraj; Chang, Jing-Shang; Wu, Jing-Yun; Lai, Long-Li; Lu, Kuang-Lieh Host‒guest key‒lock hydrogen-bonding interactions: a rare case in the design of a V-shaped polycarboxylate Ni(ii)-based chiral coordination polymer CrystEngComm, 2013, 15, 9798 |
| 7238907 | CIF | C20 H33 Br8 Cl2 Co2 N8 O12.5 | P 21 21 2 | 15.5601; 28.2409; 8.9927 90; 90; 90 | 3951.7 | Panja, Anangamohan A series of tetrabromocatecholate chelated cobalt(iii) complexes with various N-donor ancillary ligands: syntheses, crystal structures, co-crystallization, thermally induced valence tautomerism and electrochemical studies RSC Advances, 2013, 3, 4954 |
| 7238955 | CIF | Mo O6 Te Zn | P 21 21 2 | 5.0442; 5.2642; 8.9187 90; 90; 90 | 236.82 | Zhao, Sangen; Luo, Junhua; Zhou, Pan; Zhang, Shu-Quan; Sun, Zhihua; Hong, Maochun ZnTeMoO6: a strong second-harmonic generation material originating from three types of asymmetric building units RSC Advances, 2013, 3, 14000 |
| 7238984 | CIF | C14 H24 F3 N O6 S | P 21 21 2 | 25.049; 8.4762; 8.8991 90; 90; 90 | 1889.5 | Shevchuk, Michael V.; Kukhar, Valery P.; Röschenthaler, Gerd-Volker; Bassil, Bassem S.; Kawada, Kosuke; Soloshonok, Vadim A.; Sorochinsky, Alexander E. New asymmetric approach to β-trifluoromethyl isoserines RSC Advances, 2013, 3, 6479 |
| 7239006 | CIF | C11 H13 N O S | P 21 21 2 | 19.5407; 8.005; 6.7851 90; 90; 90 | 1061.35 | Awheda, Ismail; Saygili, Nezire; Garner, A. Christopher; Wallis, John D. Activation and regioselectivity of five-membered cyclic thionocarbamates to nucleophilic attack RSC Advances, 2013, 3, 24997 |
| 7239194 | CIF | C15 H15 Br2 Cd N4 S2 | P 21 21 2 | 10.9674; 18.1011; 4.9514 90; 90; 90 | 982.96 | Jia, Hong-Li; Li, Guang-Hua; Ding, Hong; Gao, Zhong-Min; Zeng, Guang; Yu, Jie-Hui; Xu, Ji-Qing New halo(pseudohalo)cadmates templated by protonatated N-heterocyclic/diamine molecules RSC Advances, 2013, 3, 16416 |
| 7239704 | CIF | C15 H23 N O5 | P 21 21 2 | 30.706; 9.6913; 11.0426 90; 90; 90 | 3286.1 | Khandavilli, U. B. Rao; Yousuf, Mustafa; Schaller, Barbara E.; Steendam, René R. E.; Keshavarz, Leila; McArdle, Patrick; Frawley, Patrick J. Plastically bendable pregabalin multi-component systems with improved tabletability and compressibility CrystEngComm, 2020, 22, 412-415 |
| 7239707 | CIF | C15 H23 N O5 | P 21 21 2 | 9.5719; 30.798; 10.9331 90; 90; 90 | 3223 | Khandavilli, U. B. Rao; Yousuf, Mustafa; Schaller, Barbara E.; Steendam, René R. E.; Keshavarz, Leila; McArdle, Patrick; Frawley, Patrick J. Plastically bendable pregabalin multi-component systems with improved tabletability and compressibility CrystEngComm, 2020, 22, 412-415 |
| 7239783 | CIF | C18 H18 Cl2 Hg N2 O4 | P 21 21 2 | 18.3123; 18.3932; 5.8857 90; 90; 90 | 1982.43 | Jouaiti, Abdelaziz; Grosshans, Philippe; Kyritsakas, Nathalie; Ferlay, Sylvie; Henry, Marc; Hosseini, Mir Wais Crystal formation of 1D coordination polymers based on chiral, achiral and racemic 1,2-cyclohexane scaffolds CrystEngComm, 2020, 22, 1746-1753 |
| 7240057 | CIF | C28 H31 N3 O4 | P 21 21 2 | 25.731; 8.2594; 12.118 90; 90; 90 | 2575.3 | Odounga Odounga, Jean-Eudes; Báthori, Nikoletta B. Systematic comparison of racemic and enantiopure multicomponent crystals of phenylsuccinic acid—the role of chirality CrystEngComm, 2020 |
| 7240247 | CIF | C28 H32 Cu N4 O7 | P 21 21 2 | 9.461; 26.3464; 11.1125 90; 90; 90 | 2769.9 | Ma, Yu-Lu; Meng, Qin; Xu, Zhong-Xuan Semi-conductive helical homochiral metal−organic frameworks based on enantiomeric proline derivatives CrystEngComm, 2020 |
| 7240248 | CIF | C28 H32 Cu N4 O7 | P 21 21 2 | 9.4529; 26.3871; 11.1375 90; 90; 90 | 2778.1 | Ma, Yu-Lu; Meng, Qin; Xu, Zhong-Xuan Semi-conductive helical homochiral metal−organic frameworks based on enantiomeric proline derivatives CrystEngComm, 2020 |
| 7240701 | CIF | C15 H21 N4 O1.5 | P 21 21 2 | 12.0576; 11.3774; 11.1889 90; 90; 90 | 1534.94 | Al-Taie, Zahraa S.; Anetts, Simon R.; Christensen, Jeppe; Coles, Simon J.; Horton, Peter N.; Evans, Daniel M.; Jones, Leigh F.; de Kleijne, Frank F. J.; Ledbetter, Shaun M.; Mehdar, Yassin T. H.; Murphy, Patrick J.; Wilson, Jack A. Proline derived guanidine catalysts forge extensive H-bonded architectures: a solution and solid state study RSC Advances, 2020, 10, 22397-22416 |
| 7241001 | CIF | C50 H28 F8 I4 N2 O2 | P 21 21 2 | 14.147; 16.6061; 18.9558 90; 90; 90 | 4453.2 | Wu, Wen Xin; Wang, Hui; Jin, Wei Jun Locked guest PAHs by soft–cavity–type host assembled via halogen bond to form luminescent cocrystals CrystEngComm, 2020 |
| 7241732 | CIF | C56 H47 Ca2 N24 O34 S4 | P 21 21 2 | 25.565; 31.743; 10.3985 90; 90; 90 | 8438.5 | Chen, Kai; Hua, Zi-Yi; Li, Ran; Peng, Yu-Ying; Zhu, Qiang Zhao; Zhao, Jiang-Lin; Redshaw, Carl Assemblies of cucurbit[6]uril-based coordination complexes with disulfonate ligands: from discrete complexes to one- and two-dimensional polymers CrystEngComm, 2021, 23, 465-481 |
| 7242170 | CIF | C30 H44 Co N6 O4 P2 S4 | P 21 21 2 | 12.6723; 19.8452; 7.445 90; 90; 90 | 1872.3 | Kataeva, Olga; Metlushka, Kirill; Ivshin, Kamil; Yamaleeva, Zilya; Zinnatullin, Ruzal; Nikitina, Kristina; Badeeva, Elena; Khrizanforova, Vera; Budnikova, Yulia; Naumann, Marco; Wellm, Christoph; Alfonsov, Alexey; Kataev, Vladislav; Büchner, Bernd; Knupfer, Martin Supramolecular chirality in the crystals of mononuclear and polymeric cobalt(ii) complexes with enantiopure and racemic N-thiophosphorylated thioureas CrystEngComm, 2021, 23, 2081-2090 |
| 7242802 | CIF | C44 H66 Mn N14 O22 P2 | P 21 21 2 | 13.9445; 19.9094; 10.1085 90; 90; 90 | 2806.4 | Iqbal, Muhammad Javed; Li, Zhongkui; Khan, Maroof Ahmad; Zhu, Yanhong; Hussain, Wajid; Su, Hao; Qiu, Qi-Ming; Shoukat, Rizwan; Li, Hui Studies on the structure and chirality of A-motif in adenosine monophosphate nucleotide metal coordination complexes CrystEngComm, 2021, 23, 4175-4180 |
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