Crystallography Open Database
Search results
Result: there are 398 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 space group like 'P 41'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1001556 | CIF | Ca2 O7 P2 | P 41 | 6.6858; 6.6858; 24.147 90; 90; 90 | 1079.4 | Boudin, S.; Grandin, A.; Borel, M. M.; Leclaire, A.; Raveau, B. Redetermination of the β-Ca~2~P~2~O~7~ structure Acta Crystallographica, Section C: Crystal Structure Communications, 1993, 49, 2062-2064 |
| 1007166 | CIF | Cs4 H8 O16 P4 | P 41 | 9.466; 9.466; 21.933 90; 90; 90 | 1965.3 | Averbuch-Pouchot, M T; Durif, A Structure of tetracaesium tetrametaphosphate tetrahydrate. Acta Crystallographica C (39,1983-), 1986, 42, 131-133 |
| 1007174 | CIF | H4 K2 Na2 O14 P4 | P 41 | 7.928; 7.928; 21.66 90; 90; 90 | 1361.4 | Averbuch-Pouchot, M T; Durif, A Contribution to the crystal chemistry of tetrametaphosphates (I). Journal of Solid State Chemistry, 1985, 58, 119-132 |
| 1503273 | CIF | C16 H14 O7 S | P 41 | 7.1258; 7.1258; 59.557 90; 90; 90 | 3024.1 | Wang, Yinchao; Niu, Shubin; Liu, Shuchun; Guo, Liangdong; Che, Yongsheng The first naturally occurring thiepinols and thienol from an endolichenic fungus Coniochaeta sp. Organic letters, 2010, 12, 5081-5083 |
| 1504673 | CIF | C24 H38 O5 | P 41 | 11.9202; 11.9202; 16.0328 90; 90; 90 | 2278.12 | Palomo, Claudio; Oiarbide, Mikel; García, Jesús M; Bañuelos, Patricia; Odriozola, José M; Razkin, Jesús; Linden, Anthony Catalytic Michael reactions of ketoesters with a camphor-derived acrylate equivalent: stereoselective access to all-carbon quaternary centers. Organic letters, 2008, 10, 2637-2640 |
| 1507249 | CIF | C84 H106 Cl4 N4 Pd2 | P 41 | 21.5844; 21.5844; 17.3692 90; 90; 90 | 8092.1 | Jensen, David R.; Sigman, Matthew S. Palladium catalysts for aerobic oxidative kinetic resolution of secondary alcohols based on mechanistic insight. Organic letters, 2003, 5, 63-65 |
| 1507310 | CIF | C17 H16 I N O3 | P 41 | 9.0611; 9.0611; 20.066 90; 90; 90 | 1647.5 | Zhdankin, Viktor V.; Koposov, Alexey Y.; Su, Liansheng; Boyarskikh, Vyacheslav V.; Netzel, Brian C.; Young, Jr, Victor G Synthesis and structure of amino acid-derived benziodazoles: new hypervalent iodine heterocycles. Organic letters, 2003, 5, 1583-1586 |
| 1507450 | CIF | C21 H27 F3 N2 O5 | P 41 | 12.229; 12.229; 15.675 90; 90; 90 | 2344 | Okano, Takashi; Fumoto, Masataka; Kusukawa, Takahiro; Fujita, Makoto Synthesis of Optically Active Trifluoromethylated Indolizidine Derivatives via Stereoselective Radical Cyclization Organic Letters, 2002, 4, 1571 |
| 1507802 | CIF | C25 H37 N O5 | P 41 | 14.3257; 14.3257; 11.4299 90; 90; 90 | 2345.71 | Cao, Mingming; Zhang, Yu; He, Hongping; Li, Shifei; Huang, Shengdian; Chen, Duozhi; Tang, Guihua; Li, Shunlin; Di, Yingtong; Hao, Xiaojiang Daphmacromines A-J, Alkaloids from Daphniphyllum macropodum. Journal of natural products, 2012, 75, 1076-1082 |
| 1508560 | CIF | C18 H22 Cl N O5 | P 41 | 10.0493; 10.0493; 17.167 90; 90; 90 | 1733.7 | Luo, Zengwei; Wang, Fuqian; Zhang, Jinwen; Li, Xingyao; Zhang, Mengke; Hao, Xincai; Xue, Yongbo; Li, Yan; Horgen, F. David; Yao, Guangmin; Zhang, Yonghui Cytotoxic alkaloids from the whole plants of zephyranthes Candida. Journal of natural products, 2012, 75, 2113-2120 |
| 1511272 | CIF | B O2 Tl | P 41 | 7.38; 7.38; 9.35 90; 90; 90 | 509.242 | Amoussou, D.; Touboul, M. Structure cristalline de Tl B O2 Revue de Chimie Minerale, 1978, 15, 223-231 |
| 1511438 | CIF | B | P 41 | 10.14; 10.14; 14.17 90; 90; 90 | 1456.95 | Ploog, K.; Kasper, J.S.; Vlasse, M.; Naslain, R. The crystal structure of tetragonal boron Journal of the Less-Common Metals, 1979, 67, 1-6 |
| 1513399 | CIF | C16 H15 Br O2 | P 41 | 7.3072; 7.3072; 25.958 90; 90; 90 | 1386 | Han, Fu-Zhong; Zhu, Fu-Lin; Wang, Ya-Hui; Zou, Yuan; Hu, Xin-Hu; Chen, Song; Hu, Xiang-Ping Highly enantioselective copper-catalyzed propargylic substitution of propargylic acetates with 1,3-dicarbonyl compounds. Organic letters, 2014, 16, 588-591 |
| 1514427 | CIF | C36.25 H47.5 Au Cl F3 N3 O4 S | P 41 | 27.6; 27.6; 21.2131 90; 90; 90 | 16159.3 | Hansmann, Max M.; Rominger, Frank; Hashmi, A. Stephen K. Gold‒allenylidenes ‒ an experimental and theoretical study Chemical Science, 2013, 4, 1552 |
| 1518420 | CIF | C15 H15 N O | P 41 | 9.0756; 9.0756; 15.824 90; 90; 90 | 1303.4 | Ran, Rui-Qiao; Xiu, Shi-Dong; Li, Chuan-Ying Synthesis of N-acylamidines via rhodium-catalyzed reaction of nitrosobenzene derivatives with N-sulfonyl-1,2,3-triazoles. Organic letters, 2014, 16, 6394-6396 |
| 1519264 | CIF | C14 H14 N4 O2 S2 | P 41 | 8.6514; 8.6514; 20.538 90; 90; 90 | 1537.2 | Coles, Simon J.; Hursthouse, Michael B.; Mayer, Thomas A.; Threlfall, Terry L. 2-(4-Amino-benzenesulfonylamino)-3H-thiazol-1-ylium and pyridine solvate Crystal Structure Report Archive, 2000, 184 |
| 1519829 | CIF | C18 H24 N5 O2 P3 S2 | P 41 | 11.4892; 11.4892; 16.7646 90; 90; 90 | 2212.96 | Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Hursthouse, Michael B. C18H24N5O2P3S2 Crystal Structure Report Archive, 2007, 312 |
| 1519867 | CIF | C18 H24 N5 O2 P3 S2 | P 41 | 11.4912; 11.4912; 16.789 90; 90; 90 | 2216.95 | Shaw, R. A.; Davies, David B.; Kilic, A.; Yesilot, S.; Coles, Simon J.; Hursthouse, Michael B. C18H24N5O2P3S2 Crystal Structure Report Archive, 2007, 263 |
| 1520074 | CIF | C19 H41 Fe N O3 P2 | P 41 | 11.736; 11.736; 16.678 90; 90; 90 | 2297.1 | Zhang, Yuanyuan; MacIntosh, Alex D.; Wong, Janice L.; Bielinski, Elizabeth A.; Williard, Paul G.; Mercado, Brandon Q.; Hazari, Nilay; Bernskoetter, Wesley H. Iron catalyzed CO2hydrogenation to formate enhanced by Lewis acid co-catalysts Chem. Sci., 2015, 6, 4291 |
| 1520586 | CIF | C32 H48 Hf N2 O4 | P 41 | 10.39461; 10.39461; 28.7569 90; 90; 90 | 3107.12 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
| 1521678 | CIF | B5 H9 | P 41 | 10.201; 10.201; 9.996 90; 90; 90 | 1040.19 | Nordman, C.E. The crystal structure of B5 H9 below the 136.7 K phase transition Journal of Molecular Structure, 1999, 485, 299-303 |
| 1524010 | CIF | O7 Sr2 V2 | P 41 | 7.055; 7.055; 25.64 90; 90; 90 | 1276.18 | Baglio, J.A.; Dann, J.N. The crystal structure of beta strontium pyrovanadate Journal of Solid State Chemistry, 1972, 4, 87-93 |
| 1526078 | CIF | La2 O7 Si2 | P 41 | 6.8383; 6.8383; 24.736 90; 90; 90 | 1156.71 | Mueller-Bunz, H.; Schleid, T. Ueber den H- und A-Typ von La2 (Si2 O7) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 2549-2556 |
| 1527622 | CIF | Cl5 Pb Tl3 | P 41 | 8.448; 8.448; 14.912 90; 90; 90 | 1064.25 | Keller, H.L. Zur Kristallstruktur von Tl3 Pb Cl5 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1977, 432, 141-146 |
| 1528083 | CIF | O7 Si2 Sm2 | P 41 | 6.695; 6.695; 24.4 90; 90; 90 | 1093.68 | Smolin, Yu.I.; Shepelev, Yu.F.; Butikova, I.K. The crystal structure of the low-temperature form of samarium pyrosilicate, Sm2 Si2 O7 Kristallografiya, 1970, 15, 256-261 |
| 1530141 | CIF | Br5 Pb Tl3 | P 41 | 8.903; 8.903; 15.486 90; 90; 90 | 1227.47 | Keller, H.L. Darstellung und Kristallstruktur von hoch-Tl3 Pb Br5 Journal of the Less-Common Metals, 1981, 78, 281-286 |
| 1533732 | CIF | H3 K4 Li O16 S4 | P 41 | 7.397; 7.397; 28.691 90; 90; 90 | 1569.85 | Haznar, A.; Pietraszko, A. Temperature behaviour of the protonic conductor K4 Li H3 (S O4)4 Journal of Solid State Chemistry, 2004, 177, 2150-2157 |
| 1533809 | CIF | Ca0.01 Ce0.87 Dy0.01 Gd0.06 La0.41 Nd0.35 O7 Pr0.09 Si2 Sm0.07 Y0.12 | P 41 | 6.7805; 6.7805; 24.689 90; 90; 90 | 1135.08 | Holtstam, D.; Norrestam, R.; Andersson, U.B. Percleveite-(Ce) - a new lanthanide disilicate mineral from Bastnas, Skinnskatterberg, Sweden European Journal of Mineralogy (1,1989-), 2003, 15, 725-731 |
| 1535601 | CIF | H3 Li O16 Rb4 Se4 | P 41 | 7.818; 7.818; 30.174 90; 90; 90 | 1844.27 | Troyanov, S.I.; Ling, C.D.; Snigireva, E.M. X-ray and neutron diffraction studies of Rb4 Li H3 (X O4)4 (X = S, Se) single crystals Kristallografiya, 2004, 49, 1066-1072 |
| 1535604 | CIF | H3 Li O16 Rb4 S4 | P 41 | 7.6316; 7.6316; 29.5 90; 90; 90 | 1718.12 | Troyanov, S.I.; Snigireva, E.M.; Ling, C.D. X-ray and neutron diffraction studies of Rb4 Li H3 (X O4)4 (X = S, Se) single crystals Kristallografiya, 2004, 49, 1066-1072 |
| 1535786 | CIF | Ca0.42 O7 Sr1.58 V2 | P 41 | 7.007; 7.007; 25.503 90; 90; 90 | 1252.15 | Murashova, E.V.; Velikodnyi, Yu.A.; Ilyukhin, A.B.; Zhuravlev, V.D. Crystal structures of Sr1.58Ca0.42V2O7 and Sr1.5Cd0.5V2O7 and the features of their isomorphism Zhurnal Neorganicheskoi Khimii, 1993, 38, 428-431 |
| 1536922 | CIF | H11 O9 P V | P 41 | 11.431; 11.431; 6.354 90; 90; 90 | 830.263 | Zakharova, B.S.; Chudinova, N.N.; Ilyukhin, A.B. Synthesis and crystal structure of vanadyl phosphite (V O (H P O3) (H2 O)2)n .3n(H2 O) Zhurnal Neorganicheskoi Khimii, 1994, 39, 1443-1445 |
| 1541242 | CIF | Cl Co F2 H12 N4 O4 | P 41 | 7.2645; 7.2645; 16.26 90; 90; 90 | 858.088 | Mitsutsuka, Yoshihiro; Aoyama, Tomonori; Ohba, Shigeru; Saito, Yoshihiko; Kaneuchi, Fumiko; Tsuboi, Masamichi Structure and polarized spectra of cis-difluorotetraamminecobalt(III) perchlorate, cis-[CoF~2~(NH~3~)~4~]ClO~4~ Bulletin of the Chemical Society of Japan, 1991, 64, 1743-1749 |
| 1543111 | CIF | C19 H22 N2 O | P 41 | 10.1845; 10.1845; 14.613 90; 90; 90 | 1515.7 | Nge, Choy-Eng; Chong, Kam-Weng; Thomas, Noel F.; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok Ibogan, Aspidosperman, Vincamine, and Bisindole Alkaloids from a Malayan Tabernaemontana corymbosa: Iboga Alkaloids with C-20α Substitution. Journal of natural products, 2016, 79, 1388-1399 |
| 1543577 | CIF | C33 H35 Fe N P2 | P 41 | 10.0629; 10.0629; 28.901 90; 90; 90 | 2926.6 | Chen, Caiyou; Wang, Heng; Zhang, Zhefan; Jin, Shicheng; Wen, Songwei; Ji, Jianjian; Chung, Lung Wa; Dong, Xiu-Qin; Zhang, Xumu Ferrocenyl chiral bisphosphorus ligands for highly enantioselective asymmetric hydrogenation via noncovalent ion pair interaction Chem. Sci., 2016, 7, 6669 |
| 1544489 | CIF | C19 H32 O10 | P 41 | 10.2307; 10.2307; 20.5352 90; 90; 90 | 2149.36 | Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum. Journal of natural products, 2016, 79, 2479-2486 |
| 1545687 | CIF | C23 H20 Br2 N2 Ni O2 | P 41 | 9.4823; 9.4823; 24.418 90; 90; 90 | 2195.5 | Suzuki, Naoyuki; Hofstra, Julie L.; Poremba, Kelsey E.; Reisman, Sarah E. Nickel-Catalyzed Enantioselective Cross-Coupling of N-Hydroxyphthalimide Esters with Vinyl Bromides. Organic letters, 2017, 19, 2150-2153 |
| 1547385 | CIF | C32 H25 Au Cl Fe P | P 41 | 13.2861; 13.2861; 14.7974 90; 90; 90 | 2612 | Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena Modular chiral gold(i) phosphite complexes Catalysis Science & Technology, 2013, 3, 3007-3012 |
| 1547995 | CIF | C48 H91 Cl12 N12 O4 | P 41 | 20.2276; 20.2276; 32.016 90; 90; 90 | 13099.5 | Ming Liu; Linjiang Chen; Scott Lewis; Samantha Y. Chong; Marc A. Little; Tom Hasell; Iain M. Aldous; Craig M. Brown; Martin W. Smith; Carole A. Morrison; Laurence J. Hardwick; Andrew I. Cooper Three-dimensional protonic conductivity in porous organic cage solids Nature Communications, 2016, 7, 12750 |
| 1548196 | CIF | C41.5 H31 F12 N7 P2 Ru | P 41 | 25.5619; 25.5619; 12.5769 90; 90; 90 | 8217.88 | Kai Wu; Kang Li; Ya-Jun Hou; Mei Pan; Lu-Yin Zhang; Ling Chen; Cheng-Yong Su Homochiral D4-symmetric metal-organic cages from stereogenic Ru(II) metalloligands for effective enantioseparation of atropisomeric molecules Nature Communications, 2016, 7, 10487 |
| 1548474 | CIF | C21 H25 N O3 | P 41 | 9.5905; 9.5905; 19.7424 90; 90; 90 | 1815.86 | Milan Bergeron-Brlek; Michael Meanwell; Robert Britton Direct synthesis of imino-C-nucleoside analogues and other biologically active iminosugars Nature Communications, 2015, 6, 6903 |
| 1550339 | CIF | C34 H28 F12 Fe N8 P2 | P 41 | 12.3462; 12.3462; 48.9067 90; 90; 90 | 7454.8 | Carey, Monica C.; Adelman, Sara L.; McCusker, James K. Insights into the excited state dynamics of Fe(ii) polypyridyl complexes from variable-temperature ultrafast spectroscopy Chemical Science, 2019 |
| 1552702 | CIF | C15 H16 O3 | P 41 | 17.155; 17.155; 35.3313 90; 90; 90 | 10397.8 | Shi, Xiao-Shan; Meng, Ling-Hong; Li, Xiao-Ming; Li, Xin; Wang, Dun-Jia; Li, Hong-Lei; Zhou, Xing-Wang; Wang, Bin-Gui Trichocadinins B-G: Antimicrobial Cadinane Sesquiterpenes from <i>Trichoderma virens</i> QA-8, an Endophytic Fungus Obtained from the Medicinal Plant <i>Artemisia argyi</i>. Journal of natural products, 2019, 82, 2470-2476 |
| 1553135 | CIF | C11 H12 N2 O7 S | P 41 | 15.41418; 15.41418; 5.95145 90; 90; 90 | 1414.05 | Kang, Jian; Zhu, Baofu; Liu, Jiewei; Wang, Bo; Zhang, Li; Su, Cheng-Yong Chiral dirhodium catalysts derived from l-serine, l-threonine and l-cysteine: design, synthesis and application Organic Chemistry Frontiers, 2015, 2, 890 |
| 1553570 | CIF | C25 H23 N O3 | P 41 | 8.4091; 8.4091; 29.3175 90; 90; 90 | 2073.13 | Xu, Meng-Meng; Wang, Hai-Qing; Wan, Ying; He, Guofeng; Yan, Jingjing; Zhang, Shu; Wang, Shu-Liang; Shi, Feng Catalytic asymmetric substitution of ortho-hydroxybenzyl alcohols with tetronic acid-derived enamines: enantioselective synthesis of tetronic acid-derived diarylmethanes Organic Chemistry Frontiers, 2017, 4, 358 |
| 1555228 | CIF | C6 H13 N O3 | P 41 | 8.8749; 8.8749; 20.4808 90; 90; 90 | 1613.1 | Chung, Ryan; Hein, Jason E. Automated solubility and crystallization analysis of non-UV active compounds: integration of evaporative light scattering detection (ELSD) and robotic sampling Reaction Chemistry & Engineering, 2019, 4, 1674 |
| 1557183 | CIF | C26 H28 N4 O5 | P 41 | 11.7728; 11.7728; 17.1159 90; 90; 90 | 2372.2 | Yang, Yaxi; Zhang, Rukang; Li, Zhaojun; Mei, Lianghe; Wan, Shili; Ding, Hong; Chen, Zhifeng; Xing, Jing; Feng, Huijin; Han, Jie; Jiang, Hualiang; Zheng, Mingyue; Luo, Cheng; Zhou, Bing Discovery of Highly Potent, Selective, and Orally Efficacious p300/CBP Histone Acetyltransferases Inhibitors. Journal of medicinal chemistry, 2020 |
| 1557305 | CIF HKL Paper | C21 H20 Br N O4 S | P 41 | 11.076; 11.076; 16.478 90; 90; 90 | 2021.5 | Soundararajan, Krishnan; Sethuraman, Velusamy; Thanigaimani, Kaliyaperumal (3<i>S</i>,5<i>R</i>,6<i>S</i>)-Diphenylmethyl 1-oxo-6-bromopenicillanate IUCrData, 2020, 5, x200143 |
| 1557312 | CIF | C12 H14 Cl6 O5 | P 41 | 8.98338; 8.98338; 20.8299 90; 90; 90 | 1681 | Steinbiss, Michael; Maczka, Michael; Langewald, Juergen; London, Brecht; Vallinayagam, Ramakrishnan; Jones, Peter G.; Bastiaans, Harold; Schulz, Stefan Sigillins from Springtails Are Potent Natural Insecticides. Journal of natural products, 2020, 83, 468-472 |
| 1557705 | CIF | C37 H46 O13 | P 41 | 9.3231; 9.3231; 42.7604 90; 90; 90 | 3716.74 | Yuan, Shengheng; Hua, Pei; Zhao, Chao; Zhou, Huihao; Xu, Jiake; Xu, Jun; Gu, Qiong Jatrophane Diterpenoids from <i>Euphorbia esula</i> as Inhibitors of RANKL-Induced Osteoclastogenesis. Journal of natural products, 2020, 83, 1005-1017 |
| 1558052 | CIF | C15 H12 N4 | P 41 | 18.2293; 18.2293; 15.6088 90; 90; 90 | 5186.9 | Horiuchi, Sachio; Ishibashi, Shoji; Haruki, Rie; Kumai, Reiji; Inada, Satoshi; Aoyagi, Shigenobu Metaelectric multiphase transitions in a highly polarizable molecular crystal. Chemical science, 2020, 11, 6183-6192 |
| 1560413 | CIF | C24 H16 Gd N3 O9 Zn | P 41 | 12.2428; 12.2428; 15.1663 90; 90; 90 | 2273.2 | Zhang, Xiaolei; Chen, Chen; Liu, Xiaoli; Gao, Peng; Hu, Ming Series of chiral interpenetrating 3d‒4f heterometallic MOFs: Luminescent sensors and magnetic properties Journal of Solid State Chemistry, 2017, 253, 360-366 |
| 1560414 | CIF | C24 H16 Dy N3 O9 Zn | P 41 | 12.2203; 12.2203; 15.0611 90; 90; 90 | 2249.2 | Zhang, Xiaolei; Chen, Chen; Liu, Xiaoli; Gao, Peng; Hu, Ming Series of chiral interpenetrating 3d‒4f heterometallic MOFs: Luminescent sensors and magnetic properties Journal of Solid State Chemistry, 2017, 253, 360-366 |
| 1560418 | CIF | C24 H16 N3 O9 Yb Zn | P 41 | 12.1961; 12.1961; 14.9534 90; 90; 90 | 2224.2 | Zhang, Xiaolei; Chen, Chen; Liu, Xiaoli; Gao, Peng; Hu, Ming Series of chiral interpenetrating 3d‒4f heterometallic MOFs: Luminescent sensors and magnetic properties Journal of Solid State Chemistry, 2017, 253, 360-366 |
| 1560419 | CIF | C22 H14 Lu N5 O9 Zn | P 41 | 12.207; 12.207; 15.0352 90; 90; 90 | 2240.4 | Zhang, Xiaolei; Chen, Chen; Liu, Xiaoli; Gao, Peng; Hu, Ming Series of chiral interpenetrating 3d‒4f heterometallic MOFs: Luminescent sensors and magnetic properties Journal of Solid State Chemistry, 2017, 253, 360-366 |
| 1564044 | CIF | C13 H19 N2 Na O4 | P 41 | 10.7327; 10.7327; 12.6277 90; 90; 90 | 1454.6 | Caballero, Pedro; Colodrero, Rosario M.P.; Conejo, María del Mar; Pastor, Antonio; Álvarez, Eleuterio; Montilla, Francisco; Carrasco, Carlos J.; Nicasio, Antonio I.; Galindo, Agustín Homochiral imidazolium-based dicarboxylate compounds: Structure and solution behaviour Inorganica Chimica Acta, 2020, 513, 119923 |
| 1564045 | CIF | C13 H23 N3 O4 | P 41 | 11.1542; 11.1542; 12.5224 90; 90; 90 | 1557.99 | Caballero, Pedro; Colodrero, Rosario M.P.; Conejo, María del Mar; Pastor, Antonio; Álvarez, Eleuterio; Montilla, Francisco; Carrasco, Carlos J.; Nicasio, Antonio I.; Galindo, Agustín Homochiral imidazolium-based dicarboxylate compounds: Structure and solution behaviour Inorganica Chimica Acta, 2020, 513, 119923 |
| 1566579 | CIF | C14 H22 O | P 41 | 10.0087; 10.0087; 12.7456 90; 90; 90 | 1276.78 | Pan, Aaron; Chojnacka, Maja; Crowley, Robert; Göttemann, Lucas; Haines, Brandon E.; Kou, Kevin G. M. Synergistic Brønsted/Lewis acid catalyzed aromatic alkylation with unactivated tertiary alcohols or di-tert-butylperoxide to synthesize quaternary carbon centers Chemical Science, 2022 |
| 1566692 | CIF | C15 H19 B F2 N4 | P 41 | 10.5675; 10.5675; 13.404 90; 90; 90 | 1496.9 | Zeng, Lintao; Chen, Tianhong; Zhu, Beitong; Koo, Seyoung; Tang, Yonghe; Lin, Weiying; James, Tony D.; Kim, Jong Seung A molecular recognition platform for the simultaneous sensing of diverse chemical weapons Chemical Science, 2022 |
| 1568585 | CIF | C69 H61 Cl9 Cu N3 O3 P2 | P 41 | 13.2253; 13.2253; 40.325 90; 90; 90 | 7053.2 | Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386 |
| 2000623 | CIF Paper | C3 H5 N3 O5 | P 41 | 10.646; 10.646; 5.752 90; 90; 90 | 651.9 | Gilardi, R.; George, C.; Flippen-Anderson, J. L. Structure of 3-nitrato-1-nitroazetidine Acta Crystallographica Section C, 1992, 48, 1679-1680 |
| 2001132 | CIF Paper | Ca2 O7 P2 | P 41 | 6.6858; 6.6858; 24.147 90; 90; 90 | 1079.4 | Boudin, S.; Grandin, A.; Borel, M. M.; Leclaire, A.; Raveau, B. Redetermination of the β-Ca~2~P~2~O~7~ structure Acta Crystallographica Section C, 1993, 49, 2062-2064 |
| 2001279 | CIF Paper | C15 H23 N2 O2 | P 41 | 8.4561; 8.4561; 20.82 90; 90; 90 | 1488.7 | Olszak, T. A.; Grabowski, M. J.; Gwoździński, K. Piperidine nitroxide radicals with heterocyclic ring substituents. I. Structure of 4-hydroxy-2,2,6,6-tetramethyl-4-(2-pyridylmethyl)piperidine 1-oxide Acta Crystallographica Section C, 1993, 49, 1722-1723 |
| 2003718 | CIF Paper | C24 H35 N O7 S | P 41 | 10.136; 10.136; 25.026 90; 90; 90 | 2571 | Chiaroni, A.; Riche, C.; Adonias, M.; Anaya, J.; Géro, S. D.; Tachdjian, C. Two Methyl-Substituted Carbapenem Antibiotic Precursors Acta Crystallographica Section C, 1995, 51, 1306-1310 |
| 2004154 | CIF Paper | C14 H18 O4 | P 41 | 8.535; 8.535; 17.339 90; 90; 90 | 1263.1 | Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C. 1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose Acta Crystallographica Section C, 1995, 51, 2418-2421 |
| 2005181 | CIF Paper | C16 H26 O7 | P 41 | 10.903; 10.903; 14.813 90; 90; 90 | 1760.9 | Linden, A.; Lee, C. K.; Siew, K. F. 3-Deoxy-3-<i>C</i>-ethoxycarbonylmethyl-1,2:5,6-di-<i>O</i>-isopropylidene-α-<small>D</small>-allofuranose at 173K Acta Crystallographica Section C, 1996, 52, 1797-1799 |
| 2005974 | CIF Paper | C10 H14 O3 | P 41 | 7.908; 7.908; 15.15 90; 90; 90 | 947.4 | Lalancette, R. A.; Coté, M. L.; Thompson, H. W. Hydrogen-Bonding Pattern of a Bicyclic γ-Keto Acid: ({-})-<i>anti</i>-Isoketopinic Acid Acta Crystallographica Section C, 1997, 53, 370-372 |
| 2006665 | CIF Paper | C48 H44 B F4 P2 Rh | P 41 | 10.158; 10.158; 39.7543 90; 90; 90 | 4102.05 | Fu, Tai Y.; Liu, Zhaoqing; Rettig, Steven J.; Scheffer, John R.; Trotter, James [(1,2,5,6-η)-1,5-Cyclooctadiene][(11<i>R</i>,12<i>R</i>)-9,10-dihydro-9,10-ethanoanthracene-11,12-bis(diphenylphosphino-<i>P</i>)]rhodium(I) Tetrafluoroborate Acta Crystallographica Section C, 1997, 53, 1577-1579 |
| 2007070 | CIF Paper | C22 H27 N O3 | P 41 | 13.154; 13.154; 11.869 90; 90; 90 | 2054 | Chiaroni, Angèle; Riche, Claude; Dumas Franc̨oise; Mauduit, Marc; Miet, Christine 6-Allyl-8,8-dimethyl-3-oxo-2-(1-phenylethyl)-2-azabicyclo[4.3.0]non-1(9)-ene-5-carboxylic Acid, a Key Compound in the Asymmetric Synthesis of Quadrone Acta Crystallographica Section C, 1998, 54, 401-403 |
| 2008103 | CIF Paper | C34 H28 F12 N8 P2 Ru | P 41 | 12.3698; 12.3698; 49.306 90; 90; 90 | 7544.4 | Kianosh Lashgari; Mikael Kritikos; Rolf Norrestam; Thomas Norrby Bis(terpyridine)ruthenium(II) bis(hexafluorophosphate) diacetonitrile solvate Acta Crystallographica Section C, 1999, 55, 64-67 |
| 2008346 | CIF HKL Paper | C9 H10 F2 N2 O5 | P 41 | 9.975; 9.975; 10.418 90; 90; 90 | 1036.6 | Hempel, Andrew; Camerman, Norman; Grierson, John; Mastropaolo, Donald; Camerman, Arthur FF-β-<small>D</small>-Arabinofuranosyluracil Acta Crystallographica Section C, 1999, 55, 632-633 |
| 2011262 | CIF HKL Paper | C15 H21 Br Cl N O | P 41 | 8.8863; 8.8863; 21.299 90; 90; 90 | 1681.9 | Chan, Bun; Wong Leh See, Elicia; Simpson, Jim; Tan, Eng Wui (+)-(2<i>R</i>,3<i>S</i>)-3-Bromo-2-chloro-<i>N</i>,<i>N</i>-diisopropyl-3-phenylpropanamide and (+)-(2<i>R</i>,3<i>S</i>)-3-bromo-2-chloro-<i>N</i>-(4-nitrophenyl)-3-phenylpropanamide Acta Crystallographica Section C, 2000, 56, e354-e355 |
| 2011282 | CIF HKL Paper | C41 H48 Br N O4 | P 41 | 16.2515; 16.2515; 13.7964 90; 90; 90 | 3643.8 | Schneider, Monica; Linden, Anthony; Rippert, Andreas, J. (<i>M</i>)- and (<i>P</i>)-8-[(1<i>S</i>,2<i>R</i>)-2-hydroxy-1-methyl-2-phenylethyl]-8-methyl-8,9-dihydro-7<i>H</i>-dinaphth[2,1-<i>c</i>:1',2'-<i>e</i>]azepinium bromide solvates Acta Crystallographica Section C, 2000, 56, 1004-1006 |
| 2011464 | CIF HKL Paper | C13 H17 N3 O4 | P 41 | 16.128; 16.128; 5.195 90; 90; 90 | 1351.3 | Emge, T. J.; Agrawal, A.; Dalessio, J. P.; G. Dukovic; J. A. Inghrim; K. Janjua; M. Macaluso; L. L. Robertson; T. J. Stiglic; Y. Volovik; M. M. Georgiadis Alaninyltryptophan hydrate, glycyltryptophan dihydrate and tryptophylglycine hydrate Acta Crystallographica Section C, 2000, 56, e469-e471 |
| 2012724 | CIF HKL Paper | C40 H44 Cu2 N4 O4 | P 41 | 13.2963; 13.2963; 20.6366 90; 90; 90 | 3648.38 | Friščić, Tomislav; Lough, Alan J.; Ferguson, George; Kaitner, Branko Enantiomeric bis(μ-<i>N</i>,<i>N</i>'-hexamethylenedisalicylaldiminato)dicopper(II) complexes Acta Crystallographica Section C, 2002, 58, m313-m315 |
| 2014393 | CIF Paper | C4 H6 Cl3 N O4 | P 41 | 9.4416; 9.4416; 20.213 90; 90; 90 | 1801.9 | Rodrigues, V. H.; Matos Beja, A.; Paixão, J. A.; Costa, M. M. R. R. Glycinium trichloroacetate Acta Crystallographica Section C, 2006, 62, o71-o72 |
| 2016123 | CIF HKL Paper | C19 H18 N2 O7 S | P 41 | 7.1807; 7.1807; 36.171 90; 90; 90 | 1865.1 | Zhang, Jing; Zhu, Long-Guan Different supramolecular assemblies in two 1:1 proton-transfer compounds of sulfobenzoic acids with aromatic amines Acta Crystallographica Section C, 2007, 63, o484-o486 |
| 2016285 | CIF HKL Paper | In0.459 K0.917 Nb0.541 O5 P | P 41 | 9.3091; 9.3091; 10.9744 90; 90; 90 | 951.03 | Artem A. Babaryk; Igor V. Zatovsky; Vyacheslav N. Baumer; Nikolay S. Slobodyanik; Domasevitch, Konstantin V. The complex phosphate K~0.92~In~0.46~Nb~0.54~OPO~4~: a new representative of the KTiOPO~4~ family Acta Crystallographica Section C, 2007, 63, i105-i108 |
| 2016470 | CIF HKL Paper | C12 H21 N O3 | P 41 | 8.2616; 8.2616; 17.517 90; 90; 90 | 1195.6 | Foces-Foces, C.; López-Rodríguez, M.; Pérez, C. A case of concomitant polymorphism and spontaneous resolution: the tetragonal phase of 5-hydroxymethyl-7,7,<i>N</i>-trimethyl-6-oxabicyclo[3.2.1]octane-1-carboxamide Acta Crystallographica Section C, 2008, 64, o95-o97 |
| 2020422 | CIF HKL Paper | C14 H15 N5 O3 | P 41 | 10.281404; 10.281404; 26.15892 90; 90; 90 | 2765.19 | Fischer, Franziska; Schmidt, Martin U.; Greiser, Sebastian; Emmerling, Franziska The challenging case of the theophylline‒benzamide cocrystal Acta Crystallographica Section C, 2016, 72, 217-224 |
| 2100298 | CIF HKL Paper | C10 H24 Co N2 O13 | P 41 | 11.425; 11.425; 27.248 90; 90; 90 | 3556.7 | Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures Acta Crystallographica Section B, 2005, 61, 675-688 |
| 2100299 | CIF HKL Paper | C10 H24 Co N2 O13 | P 41 | 11.306; 11.306; 27.041 90; 90; 90 | 3456.5 | Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt Three modulation patterns in four related [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~ structures Acta Crystallographica Section B, 2005, 61, 675-688 |
| 2100522 | CIF HKL Paper | C6 D7 N O | P 41 | 15.41038; 15.41038; 19.68 90; 90; 90 | 4673.6 | Damay, F.; Carretero-Genevrier, A.; Cousson, A.; Rodriguez-Carvajal, J.; Van Beek, W.; Fillaux, F. Synchrotron and neutron diffraction study of 4-methylpyridine-<i>N</i>-oxide at low temperature Acta Crystallographica Section B, 2006, 62, 627-633 |
| 2102240 | CIF Paper | C16 H28 N2 O4 S2 | P 41 | 11.3877; 11.3877; 15.9829 90; 90; 90 | 2072.66 | Kojić-Prodić, Biserka; Perić, Berislav; Zoran Štefanić; Anton Meden; Makarević, Janja; Jokić, Milan; Žinić, Mladen Supramolecular assembling using synthons with NH—CO(S)—CS—NH and NH—CO—CO—NH functionalities: crystal structures of (<i>S</i>,<i>S</i>)-<i>N</i>,<i>N</i>'-monothiooxalyldileucine methyl ester and its dithio analogue Acta Crystallographica Section B, 2004, 60, 90-96 |
| 2103329 | CIF Paper | C9 H12 O | P 41 | 9.848; 9.864; 8.166 90; 90; 90 | 793.3 | Wójcik, Grażyna; Holband, Jolanta Variable-temperature studies of the 4-isopropylphenol crystal structure from X-ray diffraction. Comparison of thermal expansion and molecular dynamics with spectroscopic results Acta Crystallographica Section B, 2002, 58, 684-689 |
| 2103330 | CIF HKL Paper | C9 H12 O | P 41 | 9.859; 9.865; 8.221 90; 90; 90 | 799.6 | Wójcik, Grażyna; Holband, Jolanta Variable-temperature studies of the 4-isopropylphenol crystal structure from X-ray diffraction. Comparison of thermal expansion and molecular dynamics with spectroscopic results Acta Crystallographica Section B, 2002, 58, 684-689 |
| 2103331 | CIF HKL Paper | C9 H12 O | P 41 | 9.928; 9.934; 8.316 90; 90; 90 | 820.16 | Wójcik, Grażyna; Holband, Jolanta Variable-temperature studies of the 4-isopropylphenol crystal structure from X-ray diffraction. Comparison of thermal expansion and molecular dynamics with spectroscopic results Acta Crystallographica Section B, 2002, 58, 684-689 |
| 2104368 | CIF HKL Paper | C18 H24 N5 O2 P3 S2 | P 41 | 11.4912; 11.4912; 16.789 90; 90; 90 | 2216.95 | Coles, Simon; Davies, David; Hursthouse, Michael; Yeşilot, Serkan; Çoşut, Bünyemin; Kılıç, Adem Absolute structure determination as a reference for the enantiomeric resolution of racemic mixtures of cyclophosphazenes <i>via</i> chiral high-performance liquid chromatography Acta Crystallographica Section B, 2009, 65, 355-362 |
| 2200282 | CIF HKL Paper | C24 H37 N3 O8 | P 41 | 11.698; 11.698; 19.643 90; 90; 90 | 2688 | Geßmann, Renate; Brückner, Hans; Kokkinidis, Michael Tripeptide Z‒Aib‒Aib‒Hyp‒OMe Acta Crystallographica Section E, 2001, 57, o492-o494 |
| 2202695 | CIF HKL Paper | C14 H20 Cl3 N O6 | P 41 | 9.1926; 9.1926; 22.724 90; 90; 90 | 1920.3 | Ohba, Shigeru; Sato, Hideyuki; Iida, Masatoshi; Chida, Noritaka (+)-Methyl (4<i>R</i>,5<i>S</i>)-4-[(<i>R</i>)-1-hydroxybut-3-enyl]-5-2,2-dimethyl-trichloroacetamido-1,3-dioxane-5-carboxylate Acta Crystallographica Section E, 2003, 59, o1259-o1260 |
| 2204482 | CIF HKL Paper | C15 H15 N3 O4 | P 41 | 7.7618; 7.7618; 24.35 90; 90; 90 | 1467 | Shang Shan; Wei-Xiao Hu; Duan-Jun Xu 3,4-Dimethoxybenzaldehyde 4-nitrophenylhydrazone Acta Crystallographica Section E, 2004, 60, o2059-o2061 |
| 2205827 | CIF HKL Paper | Ce4 O14 Si4 | P 41 | 6.7964; 6.7964; 24.7282 90; 90; 90 | 1142.22 | Bin Deng; James A. Ibers Dicerium disilicate, Ce~2~[Si~2~O~7~] Acta Crystallographica Section E, 2005, 61, i76-i78 |
| 2206287 | CIF HKL Paper | C14 H30 O4 Si | P 41 | 12.3616; 12.3616; 11.1685 90; 90; 90 | 1706.6 | Fan, Hong-Tao; Schürmann, Markus; Preut, Hans; Krause, Norbert (2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>R</i>)-2-(<i>tert</i>-Butyldimethylsilyloxymethyl)-2,4,5-trimethyltetrahydrofuran-3,4-diol Acta Crystallographica Section E, 2005, 61, o1987-o1988 |
| 2208534 | CIF Paper | C16 H18 In N3 O10 | P 41 | 9.7681; 9.7681; 19.632 90; 90; 90 | 1873.2 | Rong-Chang Zhang; Chun-Hui Yu An indium(III) complex with pyridine-2,6-dicarboxylate Acta Crystallographica Section E, 2006, 62, m807-m809 |
| 2208557 | CIF HKL Paper | C14 H19 Cu N5 S2 | P 41 | 7.294; 7.294; 33.549 90; 90; 90 | 1784.9 | You, Zhong-Lu; Wang, Jia; Han, Xiao [<i>N</i>,<i>N</i>-Diethyl-<i>N</i>'-(2-pyridylmethylene)ethane-1,2-diamine]dithiocyanatocopper(II) Acta Crystallographica Section E, 2006, 62, m860-m861 |
| 2209459 | CIF HKL Paper | C14 H14 N4 O2 S2 | P 41 | 8.67; 8.67; 20.927 90; 90; 90 | 1573.1 | Tatiana N. Drebushchak; Mikhail A. Mikhailenko; Elena V. Boldyreva; Tatyana P. Shakhtshneider Tetragonal polymorph of the 1:1 adduct of sulfathiazole with pyridine Acta Crystallographica Section E, 2006, 62, o2669-o2671 |
| 2209551 | CIF HKL Paper | C28 H42 O2 | P 41 | 11.909; 11.909; 18.083 90; 90; 90 | 2564.6 | Jin-Long Wu (a<i>R</i>,1<i>R</i>,2<i>S</i>,5<i>R</i>)-5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl (4-<i>tert</i>-butylcyclohexylidene)acetate Acta Crystallographica Section E, 2006, 62, o2967-o2968 |
| 2211281 | CIF HKL Paper | C29 H26 N4 O5 S | P 41 | 14.1908; 14.1908; 13.76 90; 90; 90 | 2771 | Liu, Hui; Wang, Hong-Qing; Liu, Zhao-Jie Ethyl {4-[5-(3-methylphenyl)-3-methylsulfanyl-4-oxo-1-phenylpyrazolo[3,4-<i>d</i>]pyrimidin-6-yloxy]phenoxy}acetate Acta Crystallographica Section E, 2006, 62, o5459-o5461 |
| 2212368 | CIF HKL Paper | C13 H20 O7 | P 41 | 14.1641; 14.1641; 9.2045 90; 90; 90 | 1846.62 | Michela Simone; George W. J. Fleet; David J. Watkin 3,3':5,6-Di-<i>O</i>-isopropylidene-3-<i>C</i>-hydroxymethyl-<small>D</small>-<i>allono</i>-1,4-lactone: an organic structure containing large unoccupied voids Acta Crystallographica Section E, 2007, 63, o799-o801 |
| 2213796 | CIF HKL Paper | C70 H44 Cl8 D2 N2 O4 P2 Pd | P 41 | 19.866; 19.866; 17.497 90; 90; 90 | 6905.3 | Alexander Briceño; Romano Dorta <i>cis</i>-Dichloridobis{[(<i>S</i>)-<i>N</i>-(3,5-dioxa-4-phosphacyclohepta[2,1-<i>a</i>;3,4-<i>a</i>']dinaphthalen-4-yl]dibenz[<i>b</i>,<i>f</i>]azepin-κ<i>P</i>}palladium(II) deuterochloroform disolvate Acta Crystallographica Section E, 2007, 63, m1718-m1719 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!