Crystallography Open Database
Search results
Result: there are 401 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 |
2214084 | CIF HKL Paper | C10 H20 O5 | P 41 | 8.7954; 8.7954; 30.0676 90; 90; 90 | 2326 | Simon Parsons 15-Crown-5 Acta Crystallographica Section E, 2007, 63, o3130-o3130 |
2214628 | CIF HKL Paper | C24 H24 N5 O4 P3 | P 41 | 12.9555; 12.9555; 15.029 90; 90; 90 | 2522.5 | Lenka Dastychová; Zdirad Žák; Milan Alberti; Jan Taraba <i>gem</i>-2,2-Diamino-4,4,6,6-tetraphenoxy-1,3,5-cyclotriaza-λ^5^-phosphorine Acta Crystallographica Section E, 2007, 63, o3500-o3500 |
2218218 | CIF HKL Paper | C7 H14 Cl N O | P 41 | 6.655; 6.655; 18.145 90; 90; 90 | 803.6 | Siczek, Miłosz; Lis, Tadeusz (<i>R</i>)-({-})-3-Hydroxyquinuclidinium chloride Acta Crystallographica Section E, 2008, 64, o842 |
2218674 | CIF HKL Paper | C22 H24 Br2 N4 O4 Zn | P 41 | 9.824; 9.824; 26.12 90; 90; 90 | 2520.9 | Lemoine, Pascale; Viossat, Bernard; Brion, Jean Daniel; Bekaert, Alain Dibromidobis(4-hydroxy-1,5-dimethyl-2-phenyl-3-pyrazolone)zinc(II) Acta Crystallographica Section E, 2008, 64, m891-m892 |
2223345 | CIF HKL Paper | C15 H25 N O3 S | P 41 | 7.9038; 7.9038; 50.228 90; 90; 90 | 3137.7 | Zhou, Wei; Zhang, Shijie; Hu, Weixiao (<i>R</i>)-({-})-<i>N</i>-Isovalerylcamphorsultam Acta Crystallographica Section E, 2009, 65, o2371 |
2223701 | CIF HKL Paper | C14 H11 Cl N2 O | P 41 | 13.5588; 13.5588; 14.3993 90; 90; 90 | 2647.2 | Fan, Chuan-Gang; Song, Ming-Zhi <i>N</i>'-(2-Chlorobenzylidene)benzohydrazide Acta Crystallographica Section E, 2009, 65, o2679 |
2224179 | CIF HKL Paper | C11 H21 N3 O5 | P 41 | 9.3194; 9.3194; 17.442 90; 90; 90 | 1514.86 | Abbas, Cécile; Jamart Grégoire, Brigitte; Vanderesse, Régis; Didierjean, Claude Boc-AzAla-Ala-OMe Acta Crystallographica Section E, 2009, 65, o3079 |
2225167 | CIF HKL Paper | K0.96 Mg0.32 Nb0.68 O5 P | P 41 | 6.5261; 6.5261; 10.8427 90; 90; 90 | 461.79 | Babaryk, Artem A.; Bon, Vladimir; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Pekhnyo, Vasily Reinvestigation of KMg~1/3~Nb~2/3~OPO~4~ Acta Crystallographica Section E, 2010, 66, i15-i16 |
2235594 | CIF HKL Paper | C17 H15 N O | P 41 | 9.8731; 9.8731; 14.2455 90; 90; 90 | 1388.6 | Zhou, Li; Wang, Chuan-Hu; Zhou, Mi (<i>Z</i>)-3-<i>o</i>-Tolyl-3-(<i>p</i>-tolyloxy)acrylonitrile Acta Crystallographica Section E, 2012, 68, o2085 |
2239399 | CIF HKL Paper | C14.68 H39.35 Cl1.35 F6 Ir N O2 P4 | P 41 | 14.04454; 14.04454; 14.2657 90; 90; 90 | 2813.9 | Merola, Joseph S.; Slebodnick, Carla; Berg, Michael; Ritchie, Melissa K. <i>mer</i>-Hydridotris(trimethylphosphane-κ<i>P</i>)(<small>D</small>-valinato-κ^2^<i>N</i>,<i>O</i>)iridium hexafluoridophosphate dichloromethane 0.675-solvate Acta Crystallographica Section E, 2014, 70, m82 |
2241867 | CIF HKL Paper | C12 H13 N O8 | P 41 | 9.6621; 9.6621; 27.894 90; 90; 90 | 2604.1 | Hulushe, S. T.; Hosten, E. C.; Watkins, G. M. Dimethylammonium 2,4,5-tricarboxybenzoate: an example of the decarbonylation of <i>N</i>,<i>N</i>-dimethylformamide in the presence of a metal and a benzenepolycarboxylic acid. Is zirconium(IV) the <i>Tsotsi</i>? Acta Crystallographica Section E, 2016, 72, 1521-1525 |
2310996 | CIF | Cl8 I Sb | P 41 | 6.98; 6.98; 24.2 90; 90; 90 | 1179.03 | Vonk, C.G.; Wiebenga, E.H. The crystal structure of I Sb Cl8 and I Al Cl6 Acta Crystallographica (1,1948-23,1967), 1959, 12, 859-866 |
2311324 | CIF Paper | C9 H15 N3 S | P 41 | 9.0124; 9.0124; 12.82 90; 90; 90 | 1041.28 | Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Hassan, Alaa A.; Abdel-Aziz, Ahmed T; Albayati, Mustafa R. Crystal structure of 1-(cyclo-pentyl-idene-amino)-3-(prop-2-en-1-yl)thio-urea. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o924-5 |
4000713 | CIF | C12 H0 Mn2 N16 Nb O6 | P 41 | 10.45; 10.45; 22.736 90; 90; 90 | 2482.8 | Pinkowicz, Dawid; Podgajny, Robert; Nitek, Wojciech; Rams, Michał; Majcher, Anna Małgorzata; Nuida, Tomohiro; Ohkoshi, Shin-ichi; Sieklucka, Barbara Multifunctional Magnetic Molecular {[MnII(urea)2(H2O)]2[NbIV(CN)8]}nSystem: Magnetization-Induced SHG in the Chiral Polymorph Chemistry of Materials, 2011, 23, 21 |
4020259 | CIF | C18 H19 Br N4 O8 | P 41 | 11.7529; 11.7529; 15.9649 90; 90; 90 | 2205.2 | Manuela Tosin; Colin O'Brien; Geraldine M. Fitzpatrick; Helge Müller-Bunz; W. Kenneth Glass; Paul V. Murphy Journal of Organic Chemistry, 2005, 70, 4096-4106 |
4021972 | CIF | C28 H29 Fe N O | P 41 | 9.7784; 9.7784; 22.852 90; 90; 90 | 2185 | Theresa Ahern; Helge Müller-Bunz; Patrick J. Guiry The Synthesis of N,O-Ferrocenyl Pyrrolidine-Containing Ligands and Their Application in the Diethyl- and Diphenylzinc Addition to Aromatic Aldehydes Journal of Organic Chemistry, 2006, 71, 7596-7602 |
4022172 | CIF | C28 H37 Fe N O3 S2 | P 41 | 11.8067; 11.8067; 19.3721 90; 90; 90 | 2700.43 | Guillaume Grach; Jana Sopkova-de Oliveira Santos; Jean-François Lohier; Ljubica Mojovic; Nelly Plé; Alain Turck; Vincent Reboul; Patrick Metzner Diastereoselective Addition of Enantiopure Lithium tert-Butylsulfinylferrocene to Imines Journal of Organic Chemistry, 2006, 71, 9572-9579 |
4022924 | CIF | C27 H33 Br O2 | P 41 | 13.4226; 13.4226; 13.1399 90; 90; 90 | 2367.4 | Douglass F. Taber; M. Inthikhab Sikkander; Pierre H. Storck Enantioselective Synthesis of (+)-Majusculone Journal of Organic Chemistry, 2007, 72, 4098-4101 |
4024141 | CIF | C31 H37 N O2 | P 41 | 11.125; 11.125; 22.9386 90; 90; 90 | 2839 | Hideko Koshima; Michitaro Fukano; Hidehiro Uekusa Diastereospecific Photocyclization of a Isopropylbenzophenone Derivative in Crystals and the Morphological Changes Journal of Organic Chemistry, 2007, 72, 6786-6791 |
4024474 | CIF | C22 H18 Cl N O2 S | P 41 | 14.1895; 14.1895; 9.755 90; 90; 90 | 1964.09 | Michael Harmata; Kanok-on Rayanil; Vinson R. Espejo; Charles L. Barnes Benzothiazines in Synthesis. Further Studies of the Intramolecular, Stereoselective Addition of Sulfonimidoyl Carbanions to α,β-Unsaturated Functional Groups Journal of Organic Chemistry, 2009, 74, 3214-3216 |
4024937 | CIF | C20 H28 N2 O2 | P 41 | 14.6394; 14.6394; 18.0698 90; 90; 90 | 3872.58 | Bret R. Van Ausdall; Jeremy L. Glass; Kelly M. Wiggins; Atta M. Aarif; Janis Louie A Systematic Investigation of Factors Influencing the Decarboxylation of Imidazolium Carboxylates Journal of Organic Chemistry, 2009, 74, 7935-7942 |
4025408 | CIF | C6 H8 F N O2 | P 41 | 6.5963; 6.5963; 13.975 90; 90; 90 | 608.07 | Jindřich Karban; Jan Sýkora; Jiří Kroutil; Ivana Císařová; Zdeňka Padělková; Miloš Buděšínský Synthesis of All Configurational Isomers of 1,6-Anhydro-2,3,4-trideoxy-2,3-epimino-4-fluoro-β-d-hexopyranoses Journal of Organic Chemistry, 2010, 75, 3443-3446 |
4025662 | CIF | C17 H17 N O | P 41 | 10.00744; 10.00744; 13.5007 90; 90; 90 | 1352.08 | Hidetsugu Tabata; Hiroyuki Suzuki; Kumi Akiba; Hideyo Takahashi; Hideaki Natsugari Atropisomeric Properties of 7-, 8-, and 9-Membered-Ring Dibenzolactams: Conformation, Thermal Stability, and Chemical Reactivity Journal of Organic Chemistry, 2010, 75, 5984-5993 |
4025693 | CIF | C6 H8 O4 S | P 41 | 11.16; 11.16; 5.904 90; 90; 90 | 735.3 | Thanikachalam Gunasundari; Srinivasan Chandrasekaran Enantioselective and Protecting Group-Free Synthesis of 1-Deoxythionojirimycin, 1-Deoxythiomannojirimycin, and 1-Deoxythiotalonojirimycin Journal of Organic Chemistry, 2010, 75, 6685-6688 |
4027102 | CIF | C86 H64 Cl4 O6 P2 | P 41 | 11.2117; 11.2117; 54.8735 90; 90; 90 | 6897.7 | Bunpei Hatano; Kazuyuki Hashimoto; Hiroshi Katagiri; Tatsuro Kijima; Satoshi Murakami; Shigeru Matsuba; Miho Kusakari Enantioresolution of 2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl Oxide Using Inclusion Complex with Chiral 2,2'-Dihydroxy-1,1'-binaphtyl Journal of Organic Chemistry, 2012, 77, 3595-3597 |
4027575 | CIF | C27 H32 O7 | P 41 | 10.6771; 10.6771; 21.568 90; 90; 90 | 2458.76 | Jonathan M. Faber; Wilhelm A. Eger; Craig M. Williams Enantioselective Total Synthesis of the Mexicanolides: Khayasin, Proceranolide, and Mexicanolide Journal of Organic Chemistry, 2012, 77, 8913-8921 |
4027605 | CIF | C13 H11 F N O S | P 41 | 9.0364; 9.0364; 14.7769 90; 90; 90 | 1206.63 | Jun Li; Yunfei Cai; Weiliang Chen; Xiaohua Liu; Lili Lin; Xiaoming Feng Highly Enantioselective Fluorination of Unprotected 3-Substituted Oxindoles: One-Step Synthesis of BMS 204352 (MaxiPost) Journal of Organic Chemistry, 2012, 77, 9148-9155 |
4028234 | CIF | C19 H18 O3 S | P 41 | 17.0756; 17.0756; 5.7157 90; 90; 90 | 1666.56 | Guanghu Tong; Bo Zhu; Richmond Lee; Wenguo Yang; Davin Tan; Caiyun Yang; Zhiqiang Han; Lin Yan; Kuo-Wei Huang; Zhiyong Jiang Highly Enantio- and Diastereoselective Allylic Alkylation of Morita-Baylis-Hillman Carbonates with Allyl Ketones Journal of Organic Chemistry, 2013, 78, 5067-5072 |
4029156 | CIF | C20 H18 Cl F N12 | P 41 | 21.1267; 21.1267; 4.6047 90; 90; 90 | 2055.3 | Li, Jiang-Tao; Wang, Li-Xia; Wang, De-Xian; Zhao, Liang; Wang, Mei-Xiang Synthesis, Resolution, Structure, and Racemization of Inherently Chiral 1,3-Alternate Azacalix[4]pyrimidines: Quantification of Conformation Mobility. The Journal of organic chemistry, 2014, 79, 2178-2188 |
4029263 | CIF | C15 H23 N O2 S | P 41 | 10.0361; 10.0361; 15.3067 90; 90; 90 | 1541.74 | Priede, Martins; Kazak, Mihail; Kalnins, Toms; Shubin, Kirill; Suna, Edgars Diastereoselective Hydroxymethylation of Cyclic N-tert-Butanesulfinylketimines Using Methoxymethanol as Formaldehyde Source. The Journal of organic chemistry, 2014, 79, 3715-3724 |
4033181 | CIF | C20 H33 B N2 O4 S | P 41 | 11.3384; 11.3384; 17.9222 90; 90; 90 | 2304.07 | Rarig, Robert-André F; Nelson, John M.; Vedejs, Edwin Synthesis of a Nonracemic C2-Symmetric Tetrahydro-1,4-azaborine and Evaluation of Hydroboration Enantioselectivity. The Journal of organic chemistry, 2017, 82, 12757-12762 |
4034782 | CIF | C20 H19 Cl2 N O2 | P 41 | 7.52861; 7.52861; 32.1688 90; 90; 90 | 1823.33 | Maslivetc, Vladimir A.; Turner, Danielle N.; McNair, Kimberly N.; Frolova, Liliya; Rogelj, Snezna; Maslivetc, Anna A.; Aksenov, Nicolai A.; Rubina, Marina; Rubin, Michael Desymmetrization of Cyclopropenes via the Potassium-Templated Diastereoselective 7- exo- trig Cycloaddition of Tethered Amino Alcohols toward Enantiopure Cyclopropane-Fused Oxazepanones with Antimycobacterial Activity. The Journal of organic chemistry, 2018, 83, 5650-5664 |
4035247 | CIF | C16 H13 B F3 N3 O S | P 41 | 7.908; 7.908; 25.1636 90; 90; 90 | 1573.64 | Potopnyk, Mykhaylo A.; Volyniuk, Dmytro; Ceborska, Magdalena; Cmoch, Piotr; Hladka, Iryna; Danyliv, Yan; Gražulevičius, Juozas Vidas Benzo[4,5]thiazolo[3,2- c][1,3,5,2]oxadiazaborinines: Synthesis, Structural, and Photophysical Properties. The Journal of organic chemistry, 2018, 83, 12129-12142 |
4036138 | CIF | C24 H23 Br F3 N O3 | P 41 | 11.971; 11.971; 16.556 90; 90; 90 | 2372.6 | Wang, Dong-Ling; Liang, Zhi-Qin; Chen, Kun-Quan; Sun, De-Qun; Ye, Song Enantioselective N-heterocyclic carbene-catalyzed synthesis of trifluoromethyldihydropyridinones. The Journal of organic chemistry, 2015, 80, 5900-5905 |
4036841 | CIF | C20 H20 F2 N2 O3 | P 41 | 10.32; 10.32; 18.06 90; 90; 90 | 1923 | Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko Electroreductive Intermolecular Coupling of Uracils with Aromatic Ketones: Synthesis of 6-Substituted and cis-5,6-Disubstituted 5,6-Dihydro-1,3-dimethyluracils and Their Transformation to 6-Substituted 1,3-Dimethyluracils, trans-5,6-Disubstituted 5,6-Dihydro-1,3-dimethyluracils, and 4,5,5-Trisubstituted 3-Methyloxazolizin-2-ones. The Journal of organic chemistry, 2016, 81, 5101-5119 |
4038059 | CIF | C29 H30 Fe N O P | P 41 | 8.22498; 8.22498; 36.194 90; 90; 90 | 2448.53 | Arthurs, Ross A.; Hughes, David L.; Richards, Christopher John Stereoselective Synthesis of all Possible Phosferrox Ligand Diastereoisomers Displaying Three Elements of Chirality: Stereochemical Optimization for Asymmetric Catalysis. The Journal of organic chemistry, 2020 |
4061835 | CIF | C42 H49 Cl O5 P Rh | P 41 | 10.831; 10.831; 31.904 90; 90; 90 | 3742.7 | Selent, Detlef; Baumann, Wolfgang; Kempe, Rhett; Spannenberg, Anke; Röttger, Dirk; Wiese, Klaus-Diether; Börner, Armin Reactions of a Hydroxy Phosphonite Ligand in the Coordination Sphere of Rhodium(I) Organometallics, 2003, 22, 4265-4271 |
4062451 | CIF | C28 H38 N6 Ti | P 41 | 9.3107; 9.3107; 30.4556 90; 90; 90 | 2640.17 | Coles, Martyn P.; Hitchcock, Peter B. Exploration of the Suitability of Bicyclic Guanidinates as Ligands in Catalytic Chemistry Mediated by Titanium Organometallics, 2003, 22, 5201-5211 |
4065639 | CIF | C26 H28 O9 Ru Si | P 41 | 8.3891; 8.3891; 39.28 90; 90; 90 | 2764.4 | Yamamoto, Yoshihiko; Yamashita, Ken; Nakamura, Mitsutaka Synthesis of Organometallic Analogues of SpirocyclicC-Arylribosides Organometallics, 2010, 29, 1472 |
4067478 | CIF | C36 H50 Au Cl P2 Zr2 | P 41 | 11.2225; 11.2225; 28.17 90; 90; 90 | 3547.9 | Büschel, Susanne; Daniliuc, Constantin; Jones, Peter G.; Tamm, Matthias Ambiphilic Reactivity of a Phosphane-Functionalized Cycloheptatrienyl−Cyclopentadienyl Zirconium Sandwich Complex Organometallics, 2010, 29, 671 |
4069487 | CIF | C33 H41 Fe N3 O2 Si2 | P 41 | 19.213; 19.213; 11.9944 90; 90; 90 | 4427.6 | Tondreau, Aaron M.; Darmon, Jonathan M.; Wile, Bradley M.; Floyd, Sarah K.; Lobkovsky, Emil; Chirik, Paul J. Enantiopure Pyridine Bis(oxazoline) “Pybox” and Bis(oxazoline) “Box” Iron Dialkyl Complexes: Comparison to Bis(imino)pyridine Compounds and Application to Catalytic Hydrosilylation of Ketones Organometallics, 2009, 28, 3928 |
4072866 | CIF | C74 H60 Cu2 P2 Pt2 | P 41 | 12.329; 12.329; 39.604 90; 90; 90 | 6020 | Casas, José M.; Forniés, Juan; Fuertes, Sara; Martín, Antonio; Sicilia, Violeta New Mono- and Polynuclear Alkynyl Complexes Containing Phenylacetylide as Terminal or Bridging Ligand. X-ray Structures of the Compounds NBu4[Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2], [Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)(CO)], [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(μ-C⋮CPh)}2], and [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2Cu}2] Organometallics, 2007, 26, 1674 |
4075429 | CIF | C39 H44 Cl2 Cu F6 N4 O2 P | P 41 | 10.6787; 10.6787; 34.894 90; 90; 90 | 3979.1 | Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Sore, Nicholas T.; Rath, Rakesh K.; McFarlane, William; Harrington, Ross W.; Clegg, William Modular Synthesis of a New Class of Bis(amino-oxazoline) Using Palladium-Catalyzed Buchwald−Hartwig Amination Methodology Organometallics, 2006, 25, 4341 |
4076317 | CIF | C38 H18 Co4 O12 | P 41 | 11.3; 11.3; 28.1345 90; 90; 90 | 3592.5 | Melikyan, Gagik G.; Rivas, Bianca; Harutyunyan, Stepan; Carlson, Louis; Sepanian, Ruth Cobaltocene-Induced Low-Temperature Radical Coupling Reactions in a Cobalt‒Alkyne Series Organometallics, 2012, 31, 1653 |
4084164 | CIF | C16 H25 N O2 Sn | P 41 | 10.1368; 10.1368; 18.0925 90; 90; 90 | 1859.1 | Yasuda, Makoto; Nagano, Yoshitaka; Yunoki, Hiroshi; Tsuruwa, Kensuke; Baba, Akio Chiral Transfer in the Reaction of Aminoallylic Stannanes with Carbonyls in Two Different Modes using Tin(II) and Indium(III) Halides for the Synthesis of Each Enantiomer Organometallics, 2014, 33, 3924 |
4084171 | CIF | C15 H22 Br N O2 Sn | P 41 | 10.0506; 10.0506; 17.8645 90; 90; 90 | 1804.57 | Yasuda, Makoto; Nagano, Yoshitaka; Yunoki, Hiroshi; Tsuruwa, Kensuke; Baba, Akio Chiral Transfer in the Reaction of Aminoallylic Stannanes with Carbonyls in Two Different Modes using Tin(II) and Indium(III) Halides for the Synthesis of Each Enantiomer Organometallics, 2014, 33, 3924 |
4100229 | CIF | C28 H30 Br Cl6 S16 | P 41 | 12.3265; 12.3265; 29.6626 90; 90; 90 | 4507 | Michio M. Matsushita; Tadashi Sugawara Current-Induced Low-Resistance State and Its Crystal Structure of a TTF-Based Dimeric Donor Salt Journal of the American Chemical Society, 2005 |
4100230 | CIF | C28 H30 Br Cl6 S16 | P 41 | 12.4007; 12.4007; 29.8325 90; 90; 90 | 4587.6 | Michio M. Matsushita; Tadashi Sugawara Current-Induced Low-Resistance State and Its Crystal Structure of a TTF-Based Dimeric Donor Salt Journal of the American Chemical Society, 2005 |
4100231 | CIF | C28 H30 Br Cl6 S16 | P 41 | 12.3954; 12.3954; 29.811 90; 90; 90 | 4580.3 | Michio M. Matsushita; Tadashi Sugawara Current-Induced Low-Resistance State and Its Crystal Structure of a TTF-Based Dimeric Donor Salt Journal of the American Chemical Society, 2005 |
4101156 | CIF | C34 H22 | P 41 | 15.5345; 15.5352; 19.5287 90.021; 90.022; 90 | 4712.9 | Miao, Qian; Chi, Xiaoliu; Zeis, Roswitha; Lefenfeld, Michael; Kloc, Christian; Siegrist, Theo; Steigerwald, Michael; Nuckolls, Colin Organization of Acenes with a Cruciform Assembly Motif Journal of the American Chemical Society, 2006 |
4102586 | CIF | C18 H18 Br2 O2 | P 41 | 10.8373; 10.8373; 14.8921 90; 90; 90 | 1749 | Ilija Čorić; Sreekumar Vellalath; Benjamin List Catalytic Asymmetric Transacetalization Journal of the American Chemical Society, 2010, 132, 8536-8537 |
4103882 | CIF | C83 H62 F24 N14 P4 Ru2 | P 41 | 25.5737; 25.5737; 12.5736 90; 90; 90 | 8223.3 | Kari A. McGee; Kent R. Mann Inefficient Crystal Packing in Chiral [Ru(phen)3](PF6)2 Enables Oxygen Molecule Quenching of the Solid-State MLCT Emission Journal of the American Chemical Society, 2009, 131, 1896-1902 |
4105604 | CIF | C40 H50 Cl3 Fe N3 S | P 41 | 12.73727; 12.73727; 25.1972 90; 90; 90 | 4087.94 | Yosra M. Badiei; Maxime A. Siegler; David P. Goldberg O2 Activation by Bis(imino)pyridine Iron(II)-Thiolate Complexes Journal of the American Chemical Society, 2011, 133, 1274-1277 |
4106900 | CIF | C22 H60 Fe N2 P2 Si4 | P 41 | 11.9184; 11.9184; 24.2844 90; 90; 90 | 3449.56 | Po-Heng Lin; Nathan C. Smythe; Serge I. Gorelsky; Steven Maguire; Neil J. Henson; Ilia Korobkov; Brian L. Scott; John C. Gordon; R. Tom Baker; Muralee Murugesu Importance of Out-of-State Spin-Orbit Coupling for Slow Magnetic Relaxation in Mononuclear FeII Complexes Journal of the American Chemical Society, 2011, 133, 15806-15809 |
4107677 | CIF | C8 H6 Br F5 N2 | P 41 | 7.424; 7.424; 19.255 90; 90; 90 | 1061.25 | Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations Journal of the American Chemical Society, 2008, 130, 4600-4601 |
4107888 | CIF | C15 H13 Br O3 | P 41 | 9.2942; 9.2942; 16.1873 90; 90; 90 | 1398.3 | Ying-Qing Jiang; Yong-Ling Shi; Min Shi Chiral Phosphine-Catalyzed Enantioselective Construction of γ-Butenolides Through Substitution of Morita-Baylis-Hillman Acetates with 2-Trimethylsilyloxy Furan Journal of the American Chemical Society, 2008, 130, 7202-7203 |
4109262 | CIF | C27 H49 N3 O6 | P 41 | 11.0742; 11.0742; 25.464 90; 90; 90 | 3122.9 | Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin Journal of the American Chemical Society, 2007, 129, 4039-4048 |
4110272 | CIF | C84 H24 B2 F40 N6 Ru | P 41 | 12.8314; 12.8314; 44.695 90; 90; 90 | 7358.8 | Kari A. McGee; David J. Veltkamp; Brian J. Marquardt; Kent R. Mann Porous Crystalline Ruthenium Complexes Are Oxygen Sensors Journal of the American Chemical Society, 2007, 129, 15092-15093 |
4110917 | CIF | C63 H172 N36 O44 | P 41 | 22.65; 22.65; 21.63 90; 90; 90 | 11097 | Lisa M. Heitmann; Alexander B. Taylor; P. John Hart; Adam R. Urbach Sequence-Specific Recognition and Cooperative Dimerization of N-Terminal Aromatic Peptides in Aqueous Solution by a Synthetic Host Journal of the American Chemical Society, 2006, 128, 12574-12581 |
4114284 | CIF | C98 H110 Cl8 F6 Mo4 N12 O16 P Zn | P 41 | 13.8487; 13.8487; 57.189 90; 90; 90 | 10968.1 | F. Albert Cotton; Naresh S. Dalal; Chun Y. Liu; Carlos A. Murillo; J. Micah North; Xiaoping Wang Fully Localized Mixed-Valence Oxidation Products of Molecules Containing Two Linked Dimolybdenum Units: An Effective Structural Criterion Journal of the American Chemical Society, 2003, 125, 12945-12952 |
4114285 | CIF | C98 H110 Cl8 Co F6 Mo4 N12 O16 P | P 41 | 13.8316; 13.8316; 57.273 90; 90; 90 | 10957.1 | F. Albert Cotton; Naresh S. Dalal; Chun Y. Liu; Carlos A. Murillo; J. Micah North; Xiaoping Wang Fully Localized Mixed-Valence Oxidation Products of Molecules Containing Two Linked Dimolybdenum Units: An Effective Structural Criterion Journal of the American Chemical Society, 2003, 125, 12945-12952 |
4114773 | CIF | C30 H32 Cl2 Cr O5 | P 41 | 19.7635; 19.7635; 15.172 90; 90; 90 | 5926.1 | Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure Journal of the American Chemical Society, 2002, 124, 5109-5116 |
4115318 | CIF | C19 H30 O4 | P 41 | 9.415; 9.415; 20.513 90; 90; 90 | 1818.32 | Paul A. Wender; Jeremy L. Baryza; Chad E. Bennett; F. Christopher Bi; Stacey E. Brenner; Michael O. Clarke; Joshua C. Horan; Cindy Kan; Emmanuel Lacôte; Blaise Lippa; Peter G. Nell; Tim M. Turner The Practical Synthesis of a Novel and Highly Potent Analogue of Bryostatin Journal of the American Chemical Society, 2002, 124, 13648-13649 |
4121346 | CIF | C102 H96 Ce K2 O12 | P 41 | 20.0895; 20.0895; 23.6913 90; 90; 90 | 9561.5 | Jerome R. Robinson; Zachary Gordon; Corwin H. Booth; Patrick J. Carroll; Patrick J. Walsh; Eric J. Schelter Tuning Reactivity and Electronic Properties through Ligand Reorganization within a Cerium Heterobimetallic Framework Journal of the American Chemical Society, 2013, 135, 19016-19024 |
4126338 | CIF | C31 H43 B N4 | P 41 | 15.8086; 15.8086; 11.7043 90; 90; 90 | 2925.04 | Chen, Wen-Ching; Shih, Wei-Chih; Jurca, Titel; Zhao, Lili; Andrada, Diego M.; Peng, Chun-Jung; Chang, Chun-Chi; Liu, Shu-Kai; Wang, Yi-Ping; Wen, Yuh-Sheng; Yap, Glenn P. A.; Hsu, Chao-Ping; Frenking, Gernot; Ong, Tiow-Gan Carbodicarbenes: Unexpected π-Accepting Ability during Re-activity with Small Molecules. Journal of the American Chemical Society, 2017 |
4127089 | CIF | C14 H14 O2 | P 41 | 7.4122; 7.4122; 19.6939 90; 90; 90 | 1082 | Robinson, Emily E.; Thomson, Regan J. A Strategy for the Convergent and Stereoselective Assembly of Polycyclic Molecules. Journal of the American Chemical Society, 2018 |
4128178 | CIF | C32 H34 Cl2 F4 Ir N3 O2 S | P 41 | 12.3048; 12.3048; 21.882 90; 90; 90 | 3313.1 | Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst. Journal of the American Chemical Society, 2019, 141, 2661-2677 |
4128494 | CIF | C6 H18 As Li N2 | P 41 | 8.612; 8.612; 14.7393 90; 90; 90 | 1093.16 | Hadlington, Terrance J.; Szilvási, Tibor; Driess, Matthias Versatile Tautomerization of EH<sub>2</sub>-Substituted Silylenes (E = N, P, As) in the Coordination Sphere of Nickel. Journal of the American Chemical Society, 2019, 141, 3304-3314 |
4128623 | CIF | C22 H19 Br2 N O2 | P 41 | 17.9521; 17.9521; 12.3975 90; 90; 90 | 3995.44 | Sandmeier, Tobias; Goetzke, F. Wieland; Krautwald, Simon; Carreira, Erick M. Iridium-Catalyzed Enantioselective Allylic Substitution with Aqueous Solutions of Nucleophiles. Journal of the American Chemical Society, 2019, 141, 12212-12218 |
4129686 | CIF | C34 H33 N3 O4 Ti | P 41 | 13.3617; 13.3617; 16.3676 90; 90; 90 | 2922.2 | Seo, Min-Seob; Kim, Hyunwoo (1)H NMR chiral analysis of charged molecules via ion pairing with aluminum complexes. Journal of the American Chemical Society, 2015, 137, 14190-14195 |
4133688 | CIF | C78 H78 Al F6 N6 O7 P | P 41 | 13.5965; 13.5965; 37.2086 90; 90; 90 | 6878.56 | Arnold, Amela; Sherbow, Tobias J.; Sayler, Richard I.; Britt, R. David; Thompson, Emily J.; Muñoz, M Teresa; Fettinger, James C.; Berben, Louise A. Organic Electron Delocalization Modulated by Ligand Charge States in [L<sub>2</sub>M]<sup> <i>n-</i> </sup> Complexes of Group 13 Ions. Journal of the American Chemical Society, 2019, 141, 15792-15803 |
4133689 | CIF | C66 H54 Al N6 O4 | P 41 | 13.5799; 13.5799; 37.5593 90; 90; 90 | 6926.4 | Arnold, Amela; Sherbow, Tobias J.; Sayler, Richard I.; Britt, R. David; Thompson, Emily J.; Muñoz, M Teresa; Fettinger, James C.; Berben, Louise A. Organic Electron Delocalization Modulated by Ligand Charge States in [L<sub>2</sub>M]<sup> <i>n-</i> </sup> Complexes of Group 13 Ions. Journal of the American Chemical Society, 2019, 141, 15792-15803 |
4301260 | CIF | C6 H10 Au Cl | P 41 | 8.3936; 8.3936; 11.2283 90; 90; 90 | 791.06 | Jiang Wu; Peter Kroll; H. V. Rasika Dias Gold(I) Chloride Coordinated 3-Hexyne Inorganic Chemistry, 2009, 48, 423-425 |
4302963 | CIF | C18 H16 Co Na2 O10 | P 41 | 9.966; 9.966; 20.472 90; 90; 90 | 2033.3 | Jie-Peng Zhang; Sujit K. Ghosh; Jian-Bin Lin; Susumu Kitagawa New Heterometallic Carboxylate Frameworks: Synthesis, Structure, Robustness, Flexibility, and Porosity Inorganic Chemistry, 2009, 48, 7970-7976 |
4302964 | CIF | C20 H20 Co Na2 O10 | P 41 | 10.0292; 10.0292; 20.808 90; 90; 90 | 2093 | Jie-Peng Zhang; Sujit K. Ghosh; Jian-Bin Lin; Susumu Kitagawa New Heterometallic Carboxylate Frameworks: Synthesis, Structure, Robustness, Flexibility, and Porosity Inorganic Chemistry, 2009, 48, 7970-7976 |
4304011 | CIF | Br10 Fe La6 | P 41 | 8.2546; 8.2546; 30.033 90; 90; 90 | 2046.4 | Chong Zheng; Hansjürgen Mattausch; Constantin Hoch; Arndt Simon La6Br10Fe: A La6Fe Octahedron with a Mixed M6X12/M6X8 Type Environment Inorganic Chemistry, 2008, 47, 2356-2361 |
4304236 | CIF | C18 H41 K N2 O3.5 | P 41 | 10.5356; 10.5356; 41.326 90; 90; 90 | 4587.1 | Ajay Venugopal; Raphael J. F. Berger; Alexander Willner; Tania Pape; Norbert W. Mitzel Potassium Hydroxylamine Complexes Inorganic Chemistry, 2008, 47, 4506-4512 |
4304595 | CIF | C25 H46 Cl N5 Ni O6 | P 41 | 12.6088; 12.6088; 18.18 90; 90; 90 | 2890.3 | Guang-Chuan Ou; Long Jiang; Xiao-Long Feng; Tong-Bu Lu Spontaneous Resolution of a Racemic Nickel(II) Complex and Helicity Induction via Hydrogen Bonding: The Effect of Chiral Building Blocks on the Helicity of One-Dimensional Chains Inorganic Chemistry, 2008, 47, 2710-2718 |
4304756 | CIF | C50 H50 N7 P2 Re S2 | P 41 | 12.387; 12.387; 30.963 90; 90; 90 | 4750.9 | Elena López-Torres; Ulrich Abram Rhenium Complexes with Triazine Derivatives Formed from Semicarbazones and Thiosemicarbazones Inorganic Chemistry, 2008, 47, 2890-2896 |
4308381 | CIF | C32 H68 N4 O8 Zn4 | P 41 | 13.0143; 13.0143; 26.6298 90; 90; 90 | 4510.3 | Tang, Yongjun; Kassel, W. Scott; Zakharov, Lev N.; Rheingold, Arnold L.; Kemp, Richard A. Insertion Reactions of Carbon Dioxide into Zn‒N Bonds: Syntheses and Structures of Tetrameric and Dimeric Alkylzinc Carbamato Complexes Inorganic Chemistry, 2005, 44, 359-364 |
4308549 | CIF | C27 H63 I4 N9 O9 U | P 41 | 13.5474; 13.5474; 53.2687 90; 90; 90 | 9776.5 | Jean-Claude Berthet; Pierre Thuéry; Michel Ephritikhine New Efficient Synthesis of [UI4(MeCN)4]. X-ray Crystal Structures of [UI2(MeCN)7][UI6], [UI4(py)3], and [U(dmf)9]I4 Inorganic Chemistry, 2005, 44, 1142-1146 |
4310878 | CIF | C4 H14 F4 N2 Ni2 O5 S | P 41 | 10.8722; 10.8722; 8.9098 90; 90; 90 | 1053.18 | J. N. Behera; K. V. Gopalkrishnan; C. N. R. Rao Synthesis, Structure, and Magnetic Properties of Amine-Templated Open-Framework Nickel(II) Sulfates Inorganic Chemistry, 2004, 43, 2636-2642 |
4312225 | CIF | C33 H29 Fe2 O8 P S2 | P 41 | 14.0285; 14.0285; 38.4236 90; 90; 90 | 7561.7 | Richard D. Adams; Shaobin Miao Metal Carbonyl Derivatives of Sulfur-Containing Quinones and Hydroquinones: Synthesis, Structures, and Electrochemical Properties Inorganic Chemistry, 2004, 43, 8414-8426 |
4313132 | CIF | C59 H42 Ge4 O10 Ru5 | P 41 | 23.7015; 23.7015; 12.3989 90; 90; 90 | 6965.2 | Richard D. Adams; Burjor Captain; Wei Fu Germanium-Rich Pentaruthenium Carbonyl Clusters Including Ru5(CO)11(μ-GePh2)4(μ5-C) and Its Reactions with Hydrogen Inorganic Chemistry, 2003, 42, 1328-1333 |
4313982 | CIF | C12 H18 Cu2 N2 O10 | P 41 | 8.4015; 8.4015; 12.015 90; 90; 90 | 848.1 | Tian-Fu Liu; Hao-Ling Sun; Song Gao; Shi-Wei Zhang; Tai-Chu Lau Ferromagnetic Ordering and Metamagnetism in Malonate Bridged 3D Diamond-like and Honeycomb-like Networks: [Cu(mal)(DMF)]n and {[Cu(mal)(0.5pyz)].H2O}n (mal = Malonate Dianion, DMF =N,N-dimethylformamide, pyz = Pyrazine) Inorganic Chemistry, 2003, 42, 4792-4794 |
4314507 | CIF | C48 H32 Cl4 In4 N8 O0 Se4 | P 41 | 12.1496; 12.1496; 34.47 90; 90; 90 | 5088.2 | Zhi-Xin Lei; Qin-Yu Zhu; Ming-Hui Zhang; Jian-Bing Jiang; Ya-Ping Zhang; Jie Dai Indium Chalcogenido Clusters Coordinated by 1,10-Phenanthroline, [InQ(phen)Cl]4 (Q = Se, S), a Simplified Model of Inorganic-Organic Hybrid Material with Cluster-to-Ligand Charge Transfer Inorganic Chemistry, 2010, 49, 353-355 |
4316324 | CIF | C24 H68 Li2 Mn N4 S4 Si4 | P 41 | 11.1899; 11.1899; 35.457 90; 90; 90 | 4439.7 | Chhatra B. Khadka; Daniel G. Macdonald; Yanhua Lan; Annie K. Powell; Dieter Fenske; John F. Corrigan Trimethylsilylchalcogenolates of Co(II) and Mn(II): From Mononuclear Coordination Complexes to Clusters Containing -ESiMe3 Moieties (E = S, Se) Inorganic Chemistry, 2010, 49, 7289-7297 |
4317068 | CIF | C16 H22 B10 N2 O2 | P 41 | 12.1116; 12.1116; 14.0454 90; 90; 90 | 2060.3 | Yulia Sevryugina; Richard L. Julius; M. Frederick Hawthorne Novel Approach to Aminocarboranes by Mild Amidation of Selected Iodo-carboranes Inorganic Chemistry, 2010, 49, 10627-10634 |
4317488 | CIF | C44 H20 F28 Fe2 N6 Ni O12 | P 41 | 16.5975; 16.5975; 18.8733 90; 90; 90 | 5199.2 | Asako Kamiyama; Tomoko Noguchi; Takashi Kajiwara; Tasuku Ito Syntheses, Structures, and Properties of Trinuclear Complexes [M(bpca)2{M'(hfac)2}2], Constructed with the Complexed Bridging Ligand [M(bpca)2] [M, M' = Ni(II), Mn(II); Cu(II), Mn(II); Fe(II), Mn(II); Ni(II), Fe(II); and Fe(II), Fe(II); Hbpca = Bis(2-pyridylcarbonyl)amine, Hhfac = Hexafluoroacetylacetone] Inorganic Chemistry, 2002, 41, 507-512 |
4317489 | CIF | C44 H20 F24 Fe3 N6 O12 | P 41 | 16.5136; 16.5136; 18.5718 90; 90; 90 | 5064.5 | Asako Kamiyama; Tomoko Noguchi; Takashi Kajiwara; Tasuku Ito Syntheses, Structures, and Properties of Trinuclear Complexes [M(bpca)2{M'(hfac)2}2], Constructed with the Complexed Bridging Ligand [M(bpca)2] [M, M' = Ni(II), Mn(II); Cu(II), Mn(II); Fe(II), Mn(II); Ni(II), Fe(II); and Fe(II), Fe(II); Hbpca = Bis(2-pyridylcarbonyl)amine, Hhfac = Hexafluoroacetylacetone] Inorganic Chemistry, 2002, 41, 507-512 |
4318924 | CIF | C15 H13 Br N3 O3 Re | P 41 | 8.6095; 8.6095; 22.2176 90; 90; 90 | 1646.85 | Sangeeta Ray Banerjee; Murali K. Levadala; Neva Lazarova; Lihui Wei; John F. Valliant; Karin A. Stephenson; John W. Babich; Kevin P. Maresca; Jon Zubieta Bifunctional Single Amino Acid Chelates for Labeling of Biomolecules with the {Tc(CO)3}+ and {Re(CO)3}+ Cores. Crystal and Molecular Structures of [ReBr(CO)3(H2NCH2C5H4N)], [Re(CO)3{(C5H4NCH2)2NH}]Br, [Re(CO)3{(C5H4NCH2)2NCH2CO2H}]Br, [Re(CO)3{X(Y)NCH2CO2CH2CH3}]Br (X = Y = 2-pyridylmethyl; X = 2-pyridylmethyl, Y = 2-(1-methylimidazolyl)methyl; X = Y = 2-(1-methylimidazolyl)methyl), [ReBr(CO)3{(C5H4NCH2)NH(CH2C4H3S)}], and [Re(CO)3{(C5H4NCH2)N(CH2C4H3S)(CH2CO2)}] Inorganic Chemistry, 2002, 41, 6417-6425 |
4320160 | CIF | C18 H24 Br0.29 Cl0.71 N2 O5 P2 Re | P 41 | 12.8979; 12.8979; 13.456 90; 90; 90 | 2238.5 | Liang Xu; Mark P. Lowe; Steven J. Rettig; Chris Orvig [ReO(N2O2)X] Complexes: "4 + 1"? Inorganic Chemistry, 2001, 40, 4623-4626 |
4322130 | CIF | C7 H2 F6 O8 Ru | P 41 | 10.9; 10.9; 10.997 90; 90; 90 | 1306.6 | Tiziana Funaioli; Claudia Cavazza; Fabio Marchetti; Giuseppe Fachinetti Aqueous Organometallic Chemistry of Ruthenium(II). Aquo Carbonyl Derivatives and Related Ethene Hydrocarboxylation in Fully Aqueous Solvent Inorganic Chemistry, 1999, 38, 3361-3368 |
4325897 | CIF | C45 H60 Cu5 N13 O19 Tm | P 41 | 19.1568; 19.1568; 18.3956 90; 90; 90 | 6750.9 | Curtis M. Zaleski; Choong-Sun Lim; Annabel D. Cutland-Van Noord; Jeff W. Kampf; Vincent L. Pecoraro Effects of the Central Lanthanide Ion Crystal Radius on the 15-MCCuII(N)pheHA-5 Structure Inorganic Chemistry, 2011, 50, 7707-7717 |
4325909 | CIF | C45 H67 Cu5 N12 O25 Sm | P 41 | 19.31; 19.31; 18.33 90; 90; 90 | 6834.8 | Curtis M. Zaleski; Choong-Sun Lim; Annabel D. Cutland-Van Noord; Jeff W. Kampf; Vincent L. Pecoraro Effects of the Central Lanthanide Ion Crystal Radius on the 15-MCCuII(N)pheHA-5 Structure Inorganic Chemistry, 2011, 50, 7707-7717 |
4325912 | CIF | C46 H75 Cu5 Eu N12 O28 | P 41 | 19.2559; 19.2559; 18.367 90; 90; 90 | 6810.3 | Curtis M. Zaleski; Choong-Sun Lim; Annabel D. Cutland-Van Noord; Jeff W. Kampf; Vincent L. Pecoraro Effects of the Central Lanthanide Ion Crystal Radius on the 15-MCCuII(N)pheHA-5 Structure Inorganic Chemistry, 2011, 50, 7707-7717 |
4325913 | CIF | C45 H62 Cu5 Gd N13 O29 | P 41 | 19.246; 19.246; 18.373 90; 90; 90 | 6805.5 | Curtis M. Zaleski; Choong-Sun Lim; Annabel D. Cutland-Van Noord; Jeff W. Kampf; Vincent L. Pecoraro Effects of the Central Lanthanide Ion Crystal Radius on the 15-MCCuII(N)pheHA-5 Structure Inorganic Chemistry, 2011, 50, 7707-7717 |
4325915 | CIF | C46 H73 Cu5 Dy N12 O27 | P 41 | 19.2036; 19.2036; 18.33 90; 90; 90 | 6759.7 | Curtis M. Zaleski; Choong-Sun Lim; Annabel D. Cutland-Van Noord; Jeff W. Kampf; Vincent L. Pecoraro Effects of the Central Lanthanide Ion Crystal Radius on the 15-MCCuII(N)pheHA-5 Structure Inorganic Chemistry, 2011, 50, 7707-7717 |
4325916 | CIF | C45 H67 Cu5 Ho N12 O25 | P 41 | 19.244; 19.244; 18.344 90; 90; 90 | 6793.4 | Curtis M. Zaleski; Choong-Sun Lim; Annabel D. Cutland-Van Noord; Jeff W. Kampf; Vincent L. Pecoraro Effects of the Central Lanthanide Ion Crystal Radius on the 15-MCCuII(N)pheHA-5 Structure Inorganic Chemistry, 2011, 50, 7707-7717 |
4326324 | CIF | C74 H81 In2 N5 O26 | P 41 | 9.848; 9.848; 35.0588 90; 90; 90 | 3400.11 | Sihai Yang; Gregory S. B. Martin; Jeremy J. Titman; Alexander J. Blake; David R. Allan; Neil R. Champness; Martin Schröder Pore with Gate: Enhancement of the Isosteric Heat of Adsorption of Dihydrogen via Postsynthetic Cation Exchange in Metal-Organic Frameworks Inorganic Chemistry, 2011, 50, 9374-9384 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!