Crystallography Open Database
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Searching space group like 'P 21 21 21'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2242408 | CIF HKL | C16 H14 N2 O3 S | P 21 21 21 | 8.6877; 9.6547; 18.137 90; 90; 90 | 1521.3 | Yennawar, Hemant P.; Bradley, Heather G.; Perhonitch, Kristen C.; Reppert, Haley E.; Silverberg, Lee J. Spontaneous resolution and crystal structure of (2<i>S</i>)-2-(3-nitrophenyl)-3-phenyl-2,3,5,6-tetrahydro-4<i>H</i>-1,3-thiazin-4-one; crystal structure of <i>rac</i>-2-(4-nitrophenyl)-3-phenyl-2,3,5,6-tetrahydro-4<i>H</i>-1,3-thiazin-4-one Acta Crystallographica Section E, 2018, 74, 454-457 |
| 2242426 | CIF HKL Paper | C36 H55 N O15 | P 21 21 21 | 10.3581; 13.4039; 26.1689 90; 90; 90 | 3633.26 | Gelbrich, Thomas; Langes, Christoph; Stefinovic, Marijan; Griesser, Ulrich J. Naloxegol hydrogen oxalate displaying an hydrogen-bonded layer structure Acta Crystallographica Section E, 2018, 74, 474-477 |
| 2242435 | CIF HKL Paper | C17 H25 N O5 | P 21 21 21 | 6.618; 7.1197; 34.7351 90; 90; 90 | 1636.65 | Oishi, Takeshi; Yoritate, Makoto; Sato, Takaaki; Chida, Noritaka Crystal structure of ({-})-(5<i>R</i>,7<i>R</i>,8<i>S</i>,9<i>R</i>,10<i>S</i>)-8-methyl-7-[(5<i>R</i>)-3-methyl-2-oxooxolan-3-en-5-yl]-1-aza-6-oxatricyclo[8.3.0.0^5,9^]tridecan-13-one monohydrate Acta Crystallographica Section E, 2018, 74, 555-558 |
| 2242475 | CIF HKL | C15 H22 Br N O2 | P 21 21 21 | 6.279; 15.661; 15.88 90; 90; 90 | 1561.57 | Blignaut, Jacques; Lemmerer, Andreas An investigation to elucidate the factors dictating the crystal structure of seven ammonium carboxylate molecular salts Acta Crystallographica Section E, 2018, 74, 580-586 |
| 2242513 | CIF HKL Paper | C36 H38 O8 S | P 21 21 21 | 10.0069; 10.1898; 32.0045 90; 90; 90 | 3263.4 | Clarke, Zane; Barnes, Evan; Prichard, Kate L.; Mares, Laura J.; Clegg, Jack K.; McCluskey, Adam; Houston, Todd A.; Simone, Michela I. The crystal structures of 3-<i>O</i>-benzyl-1,2-<i>O</i>-isopropylidene-5-<i>O</i>-methanesulfonyl-6-<i>O</i>-triphenylmethyl-α-<small>D</small>-glucofuranose and its azide displacement product Acta Crystallographica Section E, 2018, 74, 862-867 |
| 2242514 | CIF HKL Paper | C35 H35 N3 O5 | P 21 21 21 | 10.0943; 10.9625; 27.5392 90; 90; 90 | 3047.45 | Clarke, Zane; Barnes, Evan; Prichard, Kate L.; Mares, Laura J.; Clegg, Jack K.; McCluskey, Adam; Houston, Todd A.; Simone, Michela I. The crystal structures of 3-<i>O</i>-benzyl-1,2-<i>O</i>-isopropylidene-5-<i>O</i>-methanesulfonyl-6-<i>O</i>-triphenylmethyl-α-<small>D</small>-glucofuranose and its azide displacement product Acta Crystallographica Section E, 2018, 74, 862-867 |
| 2242521 | CIF HKL Paper | C15 H13 N O2 | P 21 21 21 | 4.8637; 14.6601; 16.6512 90; 90; 90 | 1187.27 | Moussa Slimane, Nabila; Bouhidel, Zakaria; Cherouana, Aouatef A new crystal form and antimicrobial activity of (<i>E</i>)-1-[3-(2-hydroxybenzylideneamino)phenyl]ethanone Acta Crystallographica Section E, 2018, 74, 884-888 |
| 2242556 | CIF HKL Paper | C5 H9 N O2 | P 21 21 21 | 5.2794; 8.8686; 11.5321 90; 90; 90 | 539.94 | Koenig, Jonas J.; Neudörfl, Jörg-M.; Hansen, Anne; Breugst, Martin Redetermination of the solvent-free crystal structure of <small>L</small>-proline Acta Crystallographica Section E, 2018, 74, 1067-1070 |
| 2242558 | CIF HKL Paper | C15 H14 N2 O2 | P 21 21 21 | 7.6419; 11.8889; 14.8082 90; 90; 90 | 1345.4 | Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher The crystal structure of (<i>E</i>)-2-ethyl-<i>N</i>-(4-nitrobenzylidene)aniline: three-dimensional supramolecular assembly mediated by C—H···O hydrogen bonds and nitro···π(arene) interactions Acta Crystallographica Section E, 2018, 74, 1071-1074 |
| 2242585 | CIF HKL Paper | C13 H6 Cl4 O S | P 21 21 21 | 3.9867; 13.4564; 25.573 90; 90; 90 | 1371.91 | Murthy, T. N. Sanjeeva; Atioğlu, Zeliha; Akkurt, Mehmet; Chidan Kumar, C. S.; Veeraiah, M. K.; Quah, Ching Kheng; Siddaraju, B. P. Crystal structure and Hirshfeld surface analysis of (2<i>E</i>)-3-(2,4-dichlorophenyl)-1-(2,5-dichlorothiophen-3-yl)prop-2-en-1-one Acta Crystallographica Section E, 2018, 74, 1201-1205 |
| 2242609 | CIF HKL | C7 H7 F6 N2 P | P 21 21 21 | 7.8484; 10.8964; 11.8669 90; 90; 90 | 1014.85 | Mague, Joel T.; Larrabee, Erin; Olivier, David; Vaccaro, Francesca; Riley, Kevin E.; Koplitz, Lynn V. Crystal structures of the hexafluoridophosphate salts of the isomeric 2-, 3- and 4-cyano-1-methylpyridinium cations and determination of solid-state interaction energies Acta Crystallographica Section E, 2018, 74, 1322-1329 |
| 2242610 | CIF HKL | C7 H7 F6 N2 P | P 21 21 21 | 8.5293; 8.6264; 13.3589 90; 90; 90 | 982.91 | Mague, Joel T.; Larrabee, Erin; Olivier, David; Vaccaro, Francesca; Riley, Kevin E.; Koplitz, Lynn V. Crystal structures of the hexafluoridophosphate salts of the isomeric 2-, 3- and 4-cyano-1-methylpyridinium cations and determination of solid-state interaction energies Acta Crystallographica Section E, 2018, 74, 1322-1329 |
| 2242617 | CIF HKL Paper | C14 H21 Cl2 N2 O2 P | P 21 21 21 | 10.6894; 11.1623; 14.0025 90; 90; 90 | 1670.75 | Rohde Jr, Laurence N.; Zeller, Matthias; Jackson, John A. Crystal structures of chiral 2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphospholidin-2-one derivatives for the absolute configuration at phosphorus Acta Crystallographica Section E, 2018, 74, 1330-1335 |
| 2242667 | CIF HKL Paper | C9 H11 N O3 | P 21 21 21 | 4.6775; 13.0996; 14.1984 90; 90; 90 | 869.98 | Gomes, Ligia R.; de Souza, Marcus V. N.; Da Costa, Cristiane F.; Wardell, James L.; Low, John Nicolson Crystal structures and Hirshfeld surfaces of four methoxybenzaldehyde oxime derivatives, 2-MeO-<i>X</i>C~6~H~3~C=NOH (<i>X</i> = H and 2-, 3- and 4-MeO): different conformations and hydrogen-bonding patterns Acta Crystallographica Section E, 2018, 74, 1553-1560 |
| 2242685 | CIF HKL Paper | C18 H20 O2 S | P 21 21 21 | 10.4311; 11.0892; 12.8868 90; 90; 90 | 1490.65 | Gall, James H.; White, J. Derek; MacNicol, David D.; Frampton, Christopher S. The first spontaneous resolution of a sulfoxide: Dianin's compound analogue, (<i>R</i>)-4-(4-hydroxyphenyl)-2,2,4-trimethylthiachroman-1-oxide Acta Crystallographica Section E, 2018, 74, 1633-1636 |
| 2242728 | CIF HKL | C21 H19 Co N4 O4 | P 21 21 21 | 6.924; 14.007; 40.339 90; 90; 90 | 3912.3 | Ohba, Shigeru; Tsuchimoto, Masanobu; Yamada, Naoki Investigation of nitro–nitrito photoisomerization: crystal structures of <i>trans</i>-{2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}(pyridine/4-methylpyridine)nitrocobalt(III) Acta Crystallographica Section E, 2018, 74, 1759-1763 |
| 2242751 | CIF HKL Paper | C16 H17 N O5 | P 21 21 21 | 4.6993; 10.038; 30.155 90; 90; 90 | 1422.5 | Kamaal, Saima; Faizi, Md. Serajul Haque; Ali, Akram; Ahmad, Musheer; Iskenderov, Turganbay Crystal structure of 4-[(3-methoxy-2-oxidobenzylidene)azaniumyl]benzoic acid methanol monosolvate Acta Crystallographica Section E, 2018, 74, 1847-1850 |
| 2242813 | CIF HKL | C34 H38 O9 | P 21 21 21 | 11.8027; 13.2843; 19.0835 90; 90; 90 | 2992.1 | Kumar, Rajesh; Ogbeide, K. Osahon; Mujeeb-Ur-Rehman; Owolabi, Bodunde; Falodun, Abiodun; Choudhary, M. Iqbal; Yousuf, Sammer Crystal structure, Hirshfeld surface analysis and electrostatic potential study of naturally occurring cassane-type diterpenoid Pulcherrimin C monohydrate at 100K Acta Crystallographica Section E, 2019, 75, 119-123 |
| 2242826 | CIF HKL Paper | C17 H14 O | P 21 21 21 | 6.10537; 7.58687; 26.8196 90; 90; 90 | 1242.3 | Kikuchi, Takuya; Gontani, Saori; Miyanaga, Kyohei; Kurata, Takaaki; Akatani, Yoshiki; Matsumoto, Shinya Crystal structure of benzyl 2-naphthyl ether, a sensitiser for thermal paper Acta Crystallographica Section E, 2019, 75, 242-245 |
| 2242880 | CIF HKL Paper | C9 H11 B10 F7 | P 21 21 21 | 6.7872; 11.6926; 19.4863 90; 90; 90 | 1546.43 | Watson, James D.; Benton, Amanda; Tricas, Hugo; Rosair, Georgina M.; Welch, Alan J. Crystal structure of 1-heptafluorotolyl-<i>closo</i>-1,2-dicarbadodecaborane Acta Crystallographica Section E, 2019, 75, 512-515 |
| 2242887 | CIF HKL Paper | C38 H50 N2 O7 | P 21 21 21 | 10.993; 13.198; 23.799 90; 90; 90 | 3453 | Ivantcova, Polina M.; Sokolov, Mikhail N.; Kudryavtsev, Konstantin V.; Churakov, Andrei V. Crystal structure of 4-[(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-isopropyl-5-methylcyclohexyl] 2-methyl (2<i>S</i>,4<i>S</i>,5<i>R</i>)-1-[(2<i>S</i>,3<i>R</i>,5<i>R</i>)-5-methoxycarbonyl-2-(2-methylphenyl)pyrrolidine-3-carbonyl]-5-(2-methylphenyl)pyrrolidine-2,4-dicarboxylate Acta Crystallographica Section E, 2019, 75, 537-539 |
| 2242895 | CIF HKL Paper | C3 H9 B12 Cl11 N Na O2 S | P 21 21 21 | 9.1943; 12.9081; 19.4486 90; 90; 90 | 2308.18 | Jenne, Carsten; van Lessen, Valentin Na^+^[Me~3~NB~12~Cl~11~]^{-^}·SO~2~: a rare example of a sodium‒SO~2~ complex Acta Crystallographica Section E, 2019, 75, 607-610 |
| 2242968 | CIF HKL Paper | C20 H25 N O3 S | P 21 21 21 | 8.3344; 10.5937; 21.1228 90; 90; 90 | 1864.98 | McAdam, C. John; Hanton, Lyall R.; Moratti, Stephen C.; Simpson, Jim; Wickramasinhage, Ravindra N. Structure and Hirshfeld surface analysis of the salt <i>N</i>,<i>N</i>,<i>N</i>-trimethyl-1-(4-vinylphenyl)methanaminium 4-vinylbenzenesulfonate Acta Crystallographica Section E, 2019, 75, 946-950 |
| 2243002 | CIF HKL Paper | C11 H5 F4 N O | P 21 21 21 | 5.4199; 10.3293; 17.4076 90; 90; 90 | 974.54 | Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T. Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines Acta Crystallographica Section E, 2019, 75, 1102-1107 |
| 2243004 | CIF HKL Paper | C15 H7 F4 N O | P 21 21 21 | 5.4703; 9.2548; 24.109 90; 90; 90 | 1220.56 | Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T. Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines Acta Crystallographica Section E, 2019, 75, 1102-1107 |
| 2243014 | CIF HKL Paper | C27 H32 N4 O7 | P 21 21 21 | 8.8417; 11.3252; 25.7003 90; 90; 90 | 2573.47 | Filali, Mouad; Elmsellem, Hicham; Hökelek, Tuncer; El-Ghayoury, Abdelkrim; Stetsiuk, Oleh; El Hadrami, El Mestafa; Ben-Tama, Abdessalam Crystal structure, Hirshfeld surface analysis and corrosion inhibition study of 3,6-bis(pyridin-2-yl)-4-{[(3a<i>S</i>,5<i>S</i>,5a<i>R</i>,8a<i>R</i>,8b<i>S</i>)-2,2,7,7-tetramethyltetrahydro-5<i>H</i>-bis[1,3]dioxolo[4,5-<i>b</i>:4',5'-<i>d</i>]pyran-5-yl)methoxy]methyl}pyridazine monohydrate Acta Crystallographica Section E, 2019, 75, 1169-1174 |
| 2243096 | CIF HKL Paper | C18 H18 F2 N2 O3 | P 21 21 21 | 13.4775; 28.026; 9.1085 90; 90; 90 | 3440.5 | Artheswari, G.; Maheshwaran, V.; Gautham, N. Crystal structure and Hirshfeld surface analysis of 3-(cyclopropylmethoxy)-4-(difluoromethoxy)-<i>N</i>-(pyridin-2-ylmethyl)benzamide Acta Crystallographica Section E, 2019, 75, 1515-1518 |
| 2243101 | CIF HKL Paper | C18 H22 N2 O4 | P 21 21 21 | 6.5009; 7.9735; 32.155 90; 90; 90 | 1666.8 | Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions Acta Crystallographica Section E, 2019, 75, 1494-1506 |
| 2243112 | CIF HKL Paper | C64 H33 F10 N5 Ni S2 | P 21 21 21 | 12.6269; 18.0525; 24.9524 90; 90; 90 | 5687.83 | Gutzeit, Florian; Neumann, Tjorge; Näther, Christian; Herges, Rainer Crystal structure of (15,20-bis(2,3,4,5,6-pentafluorophenyl)-5,10-{(4-methylpyridine-3,5-diyl)bis[(sulfanediylmethylene)[1,1'-biphenyl]-4',2-diyl]}porphyrinato)nickel(II) dichloromethane <i>x</i>-solvate (<i>x</i> > 1/2) Acta Crystallographica Section E, 2019, 75, 1558-1563 |
| 2243119 | CIF HKL Paper | C18 H32 F6 Fe O10 S2 | P 21 21 21 | 8.6618; 16.261; 19.0572 90; 90; 90 | 2684.2 | Riemersma, Charl F.; Monkcom, Emily C.; Klein Gebbink, Robertus J. M.; Lutz, Martin Crystal structure of tetrakis(tetrahydrofuran-κ<i>O</i>)bis(trifluoromethanesulfonato-κ<i>O</i>)iron(II) Acta Crystallographica Section E, 2019, 75, 1548-1551 |
| 2243205 | CIF HKL Paper | C46 H56 O15 | P 21 21 21 | 8.973; 20.9171; 23.9201 90; 90; 90 | 4489.5 | Yang, Hequn; Zhao, Jiangyu; Talipov, Samat; Izotova, Lidiya; Aisa, Hadji Akbar; Ibragimov, Bakhtiyar Crystal and molecular structure of jatrophane diterpenoid (2<i>R</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,7<i>S</i>,8<i>S</i>,9<i>S</i>,13<i>S</i>,14<i>S</i>,15<i>R</i>)-2,3,8,9-tetraacetoxy-5,14-bis(benzoyloxy)-15-hydroxy-7-(isobutanoyloxy)jatropha-6(17),11(<i>E</i>)-diene Acta Crystallographica Section E, 2019, 75, 1884-1887 |
| 2243236 | CIF HKL Paper | C26 H18 Br Cl N4 S | P 21 21 21 | 9.5735; 9.686; 25.644 90; 90; 90 | 2377.9 | Shamanth, Sadashivamurthy; Mantelingu, Kempegowda; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Crystal structures of three 6-aryl-2-(4-chlorobenzyl)-5-[(1<i>H</i>-indol-3-yl)methyl]imidazo[2,1-<i>b</i>][1,3,4]thiadiazoles Acta Crystallographica Section E, 2020, 76, 18-24 |
| 2243242 | CIF HKL Paper | C18 H19 Br F N3 S | P 21 21 21 | 6.8473; 12.5587; 19.809 90; 90; 90 | 1703.44 | Abdelrazeq, Alaa S.; Ghabbour, Hazem A.; El-Emam, Ali A.; Osman, Doaa Ahmed; Garcia-Granda, Santiago Synthesis and crystal structure of 3-(adamantan-1-yl)-4-(2-bromo-4-fluorophenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione Acta Crystallographica Section E, 2020, 76, 162-166 |
| 2243253 | CIF HKL Paper | C26 H25 N3 O | P 21 21 21 | 6.2502; 15.7915; 20.7395 90; 90; 90 | 2046.99 | Gomes, Ligia R.; Low, John Nicolson; Borges, Fernanda; Gaspar, Alexandra; Mesiti, Francesco The synthesis, crystal structure and Hirshfeld analysis of 4-(3,4-dimethylanilino)-<i>N</i>-(3,4-dimethylphenyl)quinoline-3-carboxamide Acta Crystallographica Section E, 2020, 76, 201-207 |
| 2243259 | CIF HKL Paper | C50 H57 N6 O10.5 | P 21 21 21 | 9.9955; 15.8364; 31.1356 90; 90; 90 | 4928.5 | Le, Thuy Quynh; Nguyen, Xuan Tu; Nguyen, Hung Huy; Mac, Dinh Hung; Bui, Thai Thanh Thu Crystal structure of a tripeptide biphenyl hybrid C~50~H~56~N~6~O~10~·0.5H~2~O Acta Crystallographica Section E, 2020, 76, 257-260 |
| 2243288 | CIF HKL Paper | C17 H18 Cl N O2 | P 21 21 21 | 6.459; 7.3545; 31.3436 90; 90; 90 | 1488.91 | Oubella, Ali; Ait Itto, My Youssef; Auhmani, Aziz; Riahi, Abdelkhalek; Daran, Jean-Claude; Auhmani, Abdelwahed Crystal structure of (<i>R</i>)-5-[(<i>R</i>)-3-(4-chlorophenyl)-5-methyl-4,5-dihydroisoxazol-5-yl]-2-methylcyclohex-2-enone Acta Crystallographica Section E, 2020, 76, 400-403 |
| 2243379 | CIF HKL Paper | C9 H9 N O4 | P 21 21 21 | 4.9279; 10.635; 15.8788 90; 90; 90 | 832.18 | Greene, John; Kopplin, Noa; Roireau, Jack; Bezpalko, Mark; Kassel, Scott; Giuliano, Michael W.; Giuliano, Robert Synthesis and crystal structure of (2<i>S</i>,4a<i>R</i>,8a<i>R</i>)-6-oxo-2,4a,6,8a-tetrahydropyrano[3,2-<i>b</i>]pyran-2-carboxamide Acta Crystallographica Section E, 2020, 76, 761-764 |
| 2243386 | CIF HKL Paper | C16 H14 Cl2 F N3 | P 21 21 21 | 6.073; 15.9782; 16.386 90; 90; 90 | 1590.03 | Özkaraca, Kadriye; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Suleymanova, Gulnar T.; Shikhaliyeva, Irada M.; Bhattarai, Ajaya Crystal structure and Hirshfeld surface analysis of 4-{2,2-dichloro-1-[(<i>E</i>)-(4-fluorophenyl)diazenyl]ethenyl}-<i>N</i>,<i>N</i>-dimethylaniline Acta Crystallographica Section E, 2020, 76, 811-815 |
| 2243394 | CIF HKL Paper | C14 H21 F N2 O7 | P 21 21 21 | 7.0961; 7.4967; 30.757 90; 90; 90 | 1636.19 | Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions Acta Crystallographica Section E, 2020, 76, 841-847 |
| 2243401 | CIF HKL | C30 H24 O2 | P 21 21 21 | 7.3431; 11.5468; 25.7555 90; 90; 90 | 2183.79 | Brown, Loren C.; Iacono, Scott T.; Balaich, Gary J. Crystal structures of 6-cyclopropyl-1,3-diphenylfulvene and 6-(2,3-dimethoxynaphthyl)-1,3-diphenylfulvene Acta Crystallographica Section E, 2020, 76, 896-899 |
| 2243420 | CIF HKL Paper | Co4 H O13 P3 Sr | P 21 21 21 | 5.1245; 12.0491; 15.7118 90; 90; 90 | 970.13 | Cherif, Fatima-Zahra; Taibi, Mhamed; Boukhari, Ali; Aride, Jilali; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structure of SrCo~4~(OH)(PO~4~)~3~, a new hydroxyphosphate Acta Crystallographica Section E, 2020, 76, 1022-1026 |
| 2243444 | CIF HKL Paper | C21 H18 O7 | P 21 21 21 | 7.4958; 12.422; 20.325 90; 90; 90 | 1892.5 | Leepasert, Theerachart; Saparpakorn, Patchreenart; Chainok, Kittipong; Duangthongyou, Tanwawan Crystal structure of 5-[(benzoyloxy)methyl]-5,6-dihydroxy-4-oxocyclohex-2-en-1-yl benzoate Acta Crystallographica Section E, 2020, 76, 1096-1100 |
| 2243467 | CIF HKL | C18 H22 N2 O4 | P 21 21 21 | 7.9845; 8.5641; 25.649 90; 90; 90 | 1753.9 | Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R. DMT analogues: <i>N</i>-ethyl-<i>N</i>-propyltryptamine and <i>N</i>-allyl-<i>N</i>-methytryptamine as their hydrofumarate salts Acta Crystallographica Section E, 2020, 76, 1201-1205 |
| 2243478 | CIF HKL Paper | C15 H15 N O | P 21 21 21 | 5.2133; 18.3625; 26.0799 90; 90; 90 | 2496.6 | Flores Manuel, Fermin; Sosa Rivadeneyra, Martha; Bernès, Sylvain One molecule, three crystal structures: conformational trimorphism of <i>N</i>-[(1<i>S</i>)-1-phenylethyl]benzamide Acta Crystallographica Section E, 2020, 76, 1229-1233 |
| 2243535 | CIF HKL Paper | C28 H38 Fe2 N2 Si | P 21 21 21 | 12.0132; 14.0683; 15.7169 90; 90; 90 | 2656.2 | Krupp, Anna; Wegge, Jessica; Otte, Felix; Kleinheider, Johannes; Wall, Helene; Strohmann, Carsten Crystal structures of [(<i>N</i>,<i>N</i>-dimethylamino)methyl]ferrocene and (<i>R</i>~p~,<i>R</i>~p~)-bis{2-[(dimethylamino)methyl]ferrocenyl}dimethylsilane Acta Crystallographica Section E, 2020, 76, 1437-1441 |
| 2243556 | CIF HKL | C12 H17 Cu N O6 | P 21 21 21 | 7.0614; 11.0738; 17.6541 90; 90; 90 | 1380.49 | Katsuumi, Natsuki; Onami, Yuika; Pradhan, Sayantan; Haraguchi, Tomoyuki; Akitsu, Takashiro Crystal structure and Hirshfeld surface analysis of (aqua-κ<i>O</i>)(methanol-κ<i>O</i>)[<i>N</i>-(2-oxidobenzylidene)threoninato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II) Acta Crystallographica Section E, 2020, 76, 1539-1542 |
| 2243560 | CIF HKL Paper | C3 H5 Cs O2 | P 21 21 21 | 4.4242; 6.2866; 21.4422 90; 90; 90 | 596.38 | Fábry, Jan; Samolová, Erika Layered alkali propanoates <i>M</i>^+^(C~2~H~5~COO)^{-^}; <i>M</i>^+^ = Na^+^, K^+^, Rb^+^, Cs^+^ Acta Crystallographica Section E, 2020, 76, 1508-1513 |
| 2243567 | CIF HKL Paper | C24 H32 N2 O9 | P 21 21 21 | 9.9759; 10.6052; 22.8535 90; 90; 90 | 2417.82 | Ouiyangkul, Passaporn; Saithong, Saowanit; Tantishaiyakul, Vimon Syntheses and crystal structures of hydrated and anhydrous 1:2 cocrystals of oxyresveratrol and zwitterionic proline Acta Crystallographica Section E, 2020, 76, 1528-1534 |
| 2243568 | CIF HKL Paper | C24 H30 N2 O8 | P 21 21 21 | 9.8293; 10.4915; 22.9863 90; 90; 90 | 2370.44 | Ouiyangkul, Passaporn; Saithong, Saowanit; Tantishaiyakul, Vimon Syntheses and crystal structures of hydrated and anhydrous 1:2 cocrystals of oxyresveratrol and zwitterionic proline Acta Crystallographica Section E, 2020, 76, 1528-1534 |
| 2243571 | CIF HKL Paper | C14 H12 I N O | P 21 21 21 | 8.173; 11.8143; 13.1721 90; 90; 90 | 1271.88 | Kansiz, Sevgi; Agar, Tuggan; Dege, Necmi; Dogan, Onur Erman; Ahmed, Ruby; Saif, Eiad Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-{[(2-iodophenyl)imino]methyl}-6-methylphenol Acta Crystallographica Section E, 2020, 76, 1595-1598 |
| 2243649 | CIF HKL Paper | C18 H21 Br N2 O3 | P 21 21 21 | 6.9824; 13.2292; 19.4903 90; 90; 90 | 1800.35 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions Acta Crystallographica Section E, 2020, 76, 1779-1793 |
| 2243650 | CIF HKL Paper | C18 H21 I N2 O3 | P 21 21 21 | 7.0101; 13.3796; 19.5524 90; 90; 90 | 1833.87 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions Acta Crystallographica Section E, 2020, 76, 1779-1793 |
| 2243692 | CIF HKL Paper | C18 H19 F N2 O2 | P 21 21 21 | 7.3286; 11.3388; 20.304 90; 90; 90 | 1687.21 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243696 | CIF HKL Paper | C18 H19 I N2 O2 | P 21 21 21 | 7.4528; 17.1306; 27.903 90; 90; 90 | 3562.4 | Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions Acta Crystallographica Section E, 2021, 77, 5-13 |
| 2243730 | CIF HKL Paper | C12 H9 N3 O4 S | P 21 21 21 | 7.1335; 11.7297; 15.4593 90; 90; 90 | 1293.54 | Kansiz, Sevgi; Dege, Necmi; Ozturk, Seyhan; Akdemir, Nesuhi; Tarcan, Erdoğan; Arslanhan, Ali; Saif, Eiad Crystal structure and Hirshfeld surface analysis of 2-methyl-3-nitro-<i>N</i>-[(<i>E</i>)-(5-nitrothiophen-2-yl)methylidene]aniline Acta Crystallographica Section E, 2021, 77, 138-141 |
| 2243740 | CIF HKL Paper | C28 H21 N3 O | P 21 21 21 | 10.7038; 11.6096; 17.5182 90; 90; 90 | 2176.93 | Naghiyev, Farid N.; Grishina, Maria M.; Khrustalev, Victor N.; Khalilov, Ali N.; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G. Crystal structure and Hirshfeld surface analysis of 3-amino-1-oxo-2,6,8-triphenyl-1,2,7,8-tetrahydroisoquinoline-4-carbonitrile Acta Crystallographica Section E, 2021, 77, 195-199 |
| 2243745 | CIF HKL Paper | C20 H27 N | P 21 21 21 | 10.05103; 10.62943; 15.64759 90; 90; 90 | 1671.74 | Acelas, Mauricio; Dugarte-Dugarte, Analio; Romero Bohórquez, Arnold R.; Henao, José Antonio; Delgado, José Miguel; Díaz de Delgado, Graciela Synthesis, crystal structure, Hirshfeld surface analysis and energy framework calculations of <i>trans</i>-3,7,9,9-tetramethyl-10-(prop-2-yn-1-yl)-1,2,3,4,4a,9,9a,10-octahydroacridine Acta Crystallographica Section E, 2021, 77, 226-232 |
| 2243774 | CIF HKL Paper | C12 H10 Br N O3 S | P 21 21 21 | 4.8436; 13.9149; 18.5479 90; 90; 90 | 1250.1 | Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O. Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one Acta Crystallographica Section E, 2021, 77, 341-345 |
| 2243822 | CIF HKL Paper | C6 H16 B K | P 21 21 21 | 7.4758; 7.6682; 14.801 90; 90; 90 | 848.48 | Fecker, Ann Christin; Freytag, Matthias; Walter, Marc D.; Jones, Peter G. Crystal structure of potassium triethylhydridoborate (`superhydride') Acta Crystallographica Section E, 2021, 77, 592-595 |
| 2243842 | CIF HKL Paper | C20 H23 N O2 | P 21 21 21 | 6.1313; 7.371; 38.1143 90; 90; 90 | 1722.53 | Miyamoto, Hisakazu; Takahashi, Hiroki Crystal structure and photoreactive behaviour of <i>N</i>,<i>N</i>-diisopropyl(<i>p</i>-phenylphenyl)glyoxylamide Acta Crystallographica Section E, 2021, 77, 653-657 |
| 2243859 | CIF HKL Paper | C15 H12 N2 O2 | P 21 21 21 | 6.569; 12.7956; 14.1278 90; 90; 90 | 1187.5 | Ali, Arif; Muslim, Mohd; Kamaal, Saima; Ahmed, Adeeba; Ahmad, Musheer; Shahid, M.; Khan, Jamal A.; Dege, Necmi; Javed, Saleem; Mashrai, Ashraf Crystal structure, Hirshfeld and electronic transition analysis of 2-[(1<i>H</i>-benzimidazol-1-yl)methyl]benzoic acid Acta Crystallographica Section E, 2021, 77, 755-758 |
| 2243874 | CIF HKL | C26 H38 O5 S | P 21 21 21 | 6.4201; 17.6239; 20.8997 90; 90; 90 | 2364.74 | Rousselin, Yoann; Yolka, Sylvie; Clavel, Alexandre Crystal structures of two polymorphs of tixocortol pivalate Acta Crystallographica Section E, 2021, 77, 809-813 |
| 2243875 | CIF HKL | C26 H38 O5 S | P 21 21 21 | 6.0146; 19.2817; 20.9887 90; 90; 90 | 2434.1 | Rousselin, Yoann; Yolka, Sylvie; Clavel, Alexandre Crystal structures of two polymorphs of tixocortol pivalate Acta Crystallographica Section E, 2021, 77, 809-813 |
| 2243944 | CIF HKL Paper | C10 H12 Cl N O2 | P 21 21 21 | 6.8913; 7.6898; 19.7527 90; 90; 90 | 1046.75 | Belov, Feodor; Villinger, Alexander; von Langermann, Jan (<i>R</i>)-Baclofen [(<i>R</i>)-4-amino-3-(4-chlorophenyl)butanoic acid] Acta Crystallographica Section E, 2022, 78, 33-35 |
| 2243963 | CIF HKL Paper | C22 H24 N2 O6 | P 21 21 21 | 8.1864; 9.2061; 27.7903 90; 90; 90 | 2094.4 | Daoui, Said; Kansiz, Sevgi; Aktas, Feyzi Alkim; Dege, Necmi; Saif, Eiad; Benchat, Noureddine; Karrouchi, Khalid Crystal structure and molecular docking study of diethyl 2,2'-({[(1<i>E</i>,1'<i>E</i>)-(hydrazine-1,2-diylidene)bis(methanylylidene)]bis(4,1-phenylene)}bis(oxy))diacetate Acta Crystallographica Section E, 2022, 78, 88-91 |
| 2243992 | CIF HKL Paper | C11 H11 Br2 N | P 21 21 21 | 8.7761; 11.3876; 11.8654 90; 90; 90 | 1185.81 | Konovalova, Irina S.; Shishkina, Svitlana V.; Kobzev, Dmytro; Semenova, Olha; Tatarets, Anatoliy Crystal structures and Hirshfeld analysis of 4,6-dibromoindolenine and its quaternized salt Acta Crystallographica Section E, 2021, 77, 1203-1207 |
| 2243998 | CIF HKL Paper | C18 H18 N2 O3 S | P 21 21 21 | 5.9685; 11.058; 26.215 90; 90; 90 | 1730.2 | Simsek, Okan; Dincer, Muharrem; Dege, Necmi; Saif, Eiad; Yilmaz, Ibrahim; Cukurovali, Alaaddin Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-4-{[4-(3-methyl-3-phenylcyclobutyl)thiazol-2-yl]amino}-4-oxobut-2-enoic acid Acta Crystallographica Section E, 2022, 78 |
| 2244001 | CIF Paper | C9 H14 Cl N | P 21 21 21 | 6.7723; 7.1806; 20.542 90; 90; 90 | 998.94 | Kirchhoff, Jan-Lukas; Brieger, Lukas; Strohmann, Carsten Crystal structure and Hirshfeld surface analysis of (<i>S</i>)-<i>N</i>-methyl-1-phenylethan-1-aminium chloride Acta Crystallographica Section E, 2022, 78 |
| 2244017 | CIF HKL Paper | C10 H12 N2 O | P 21 21 21 | 5.852; 12.437; 12.444 90; 90; 90 | 905.7 | Rakhmonova, Dilnoza; Kadirova, Zukhra; Torambetov, Batirbay; Kadirova, Shakhnoza; Ashurov, Jamshid; Shishkina, Svitlana The molecular and crystal structures of 2-(3-hydroxypropyl)benzimidazole and its nitrate salt Acta Crystallographica Section E, 2022, 78 |
| 2244042 | CIF HKL Paper | C10 H10 N2 O2 | P 21 21 21 | 7.6496; 8.7565; 14.128 90; 90; 90 | 946.3 | Pintro, Chirs J.; Long, Analeece K.; Amonette, Allison J.; Lobue, James M.; Padgett, Clifford W. Crystal structures and Hirshfeld surface analysis of 5-amino-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid and 5-amino-3-(4-methoxyphenyl)isoxazole Acta Crystallographica Section E, 2022, 78, 336-339 |
| 2244048 | CIF HKL Paper | C10 H12 N2 O | P 21 21 21 | 8.2248; 8.7542; 13.0712 90; 90; 90 | 941.15 | Naeem, Marilyn; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. Crystal structure of serotonin Acta Crystallographica Section E, 2022, 78 |
| 2244052 | CIF HKL Paper | C15 H14 N4 O6 S2 | P 21 21 21 | 4.7727; 17.5228; 21.8526 90; 90; 90 | 1827.56 | Nisbet, Matthew L.; Puzan, Marissa; Wojtas, Lukasz; Samas, Brian; Wood, Geoffrey P. F. Crystal structures of anhydrous and hydrated ceftibuten Acta Crystallographica Section E, 2022, 78 |
| 2244053 | CIF HKL | C15 H19.3 N4 O8.65 S2 | P 21 21 21 | 4.669; 17.8029; 23.1486 90; 90; 90 | 1924.15 | Nisbet, Matthew L.; Puzan, Marissa; Wojtas, Lukasz; Samas, Brian; Wood, Geoffrey P. F. Crystal structures of anhydrous and hydrated ceftibuten Acta Crystallographica Section E, 2022, 78 |
| 2244099 | CIF HKL Paper | C17 H20 O4 | P 21 21 21 | 6.7641; 6.9254; 31.4538 90; 90; 90 | 1473.42 | Lu, Qiang-Qiang; Shi, Xin-Wei; Zhou, Ya-Fu; Cui, Xin-Ai; Wang, Hong Crystal structure and Hirshfeld analysis of (1a<i>S</i>,3a<i>R</i>,4a<i>S</i>,5a<i>R</i>)-15-acetoxylinden-7(11),8-trieno-12,8-lactone Acta Crystallographica Section E, 2022, 78, 1 |
| 2244172 | CIF HKL | C14 H22 N2 O7 | P 21 21 21 | 7.1185; 7.5255; 29.955 90; 90; 90 | 1604.7 | Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J. The structures of eleven (4-phenyl)piperazinium salts containing organic anions Acta Crystallographica Section E, 2022, 78, 1016-1027 |
| 2244181 | CIF HKL Paper | C16 H13 Au Cl P S | P 21 21 21 | 10.0322; 12.0784; 12.9412 90; 90; 90 | 1568.1 | Neils, Thomas; LaDuca, Andrew; Bender, John E.; Staples, Richard J.; Biros, Shannon M. Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κ<i>P</i>]gold(I) Acta Crystallographica Section E, 2022, 78 |
| 2244205 | CIF Paper | C12 H19 N3 O8 S | P 21 21 21 | 7.9857; 9.0145; 22.1621 90; 90; 90 | 1595.39 | Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Glidewell, Christopher; Parkin, Sean Synthesis and crystal structure of topiramate azidosulfate at 90K and 298K Acta Crystallographica Section E, 2022, 78, 984-988 |
| 2244206 | CIF Paper | C12 H19 N3 O8 S | P 21 21 21 | 8.0717; 9.1135; 22.506 90; 90; 90 | 1655.6 | Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Glidewell, Christopher; Parkin, Sean Synthesis and crystal structure of topiramate azidosulfate at 90K and 298K Acta Crystallographica Section E, 2022, 78, 984-988 |
| 2244227 | CIF HKL Paper | C6 H9 N2 O3 P Zn | P 21 21 21 | 5.1487; 8.5316; 20.371 90; 90; 90 | 894.8 | Wark, Stephen; Lyons, Megan J.; Slawin, Alexandra M. Z.; Harrison, William T. A. Consistent zincophosphite 4-ring 'ladder' chain structural motif with isomeric ligands. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 272-279 |
| 2244232 | CIF HKL | C19 H22 N2 O3 S | P 21 21 21 | 6.9503; 10.585; 24.975 90; 90; 90 | 1837.4 | Okmanov, Rasul Ya; Olimova, Manzura I.; Karabaeva, Surayyo B.; Sapaev, Frunza A.; Abdireymov, Kudaybergen B. Syntheses, crystal structures and Hirshfeld surface analyses of <i>N</i>-aryl-sulfonyl derivatives of cytisine. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 313-318 |
| 2244233 | CIF HKL | C17 H17 Cl N2 O3 S | P 21 21 21 | 7.1374; 11.448; 20.844 90; 90; 90 | 1703.1 | Okmanov, Rasul Ya; Olimova, Manzura I.; Karabaeva, Surayyo B.; Sapaev, Frunza A.; Abdireymov, Kudaybergen B. Syntheses, crystal structures and Hirshfeld surface analyses of <i>N</i>-aryl-sulfonyl derivatives of cytisine. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 313-318 |
| 2300044 | CIF | C21 H17 N5 O7 | P 21 21 21 | 22.788; 13.018; 6.92 90; 90; 90 | 2052.8 | Chernyshev, Vladimir V.; Yatsenko, Alexandr V.; Kuvshinov, Alexandr M.; Shevelev, Svyatoslav A. Unexpected molecular structure from laboratory powder diffraction data Journal of Applied Crystallography, 2002, 35, 669-673 |
| 2300119 | CIF Paper | ? | P 21 21 21 | 6.88; 11.91; 18.6 90; 90; 90 | 1524.1 | Immirzi, Attilio; Alfano, Davide; Tedesco, Consiglia New solutions to the problems of chain orientation and chain continuity in structure analysis of fibrous polymers. A reconsideration of the structure of polyisobutene Journal of Applied Crystallography, 2007, 40, 10-15 |
| 2300336 | CIF Paper | C15 H14 N2 O2 S | P 21 21 21 | 7.7598; 9.9684; 18.231 90; 90; 90 | 1410.2 | Eccles, Kevin S.; Stokes, Stephen P.; Daly, Carla A.; Barry, Nicola M.; McSweeney, Sharon P.; O'Neill, Damian J.; Kelly, Dawn M.; Jennings, W. Brian; Ní Dhubhghaill, O. M.; Moynihan, Humphrey A.; Maguire, Anita R.; Lawrence, Simon E. Evaluation of the Bruker SMART X2S: crystallography for the nonspecialist? Journal of Applied Crystallography, 2011, 44, 213-215 |
| 2300338 | CIF Paper | C15 H14 N2 O2 S | P 21 21 21 | 7.7592; 9.9677; 18.23 90; 90; 90 | 1409.9 | Eccles, Kevin S.; Stokes, Stephen P.; Daly, Carla A.; Barry, Nicola M.; McSweeney, Sharon P.; O'Neill, Damian J.; Kelly, Dawn M.; Jennings, W. Brian; Ní Dhubhghaill, O. M.; Moynihan, Humphrey A.; Maguire, Anita R.; Lawrence, Simon E. Evaluation of the Bruker SMART X2S: crystallography for the nonspecialist? Journal of Applied Crystallography, 2011, 44, 213-215 |
| 2300371 | CIF HKL Paper | C9 H13 N3 O5 | P 21 21 21 | 5.0784; 13.9046; 14.6992 90; 90; 90 | 1037.96 | Coome, J. A.; Goeta, A. E.; Howard, J. A. K.; Probert, M. R. <i>Masquerade</i>: removing non-sample scattering from integrated reflection intensities Journal of Applied Crystallography, 2012, 45, 292-298 |
| 2300374 | CIF Paper | C25 H30 N4 O3 | P 21 21 21 | 35.9422; 12.91819; 4.99532 90; 90; 90 | 2319.37 | Bushmarinov, Ivan S.; Dmitrienko, Artem O.; Korlyukov, Alexander A.; Antipin, Mikhail Yu. Rietveld refinement and structure verification using `Morse' restraints Journal of Applied Crystallography, 2012, 45, 1187-1197 |
| 2300384 | CIF HKL | C13 H10 O | P 21 21 21 | 7.979; 10.274; 12.103 90; 90; 90 | 992.2 | Reilly, Anthony M.; Wann, Derek A.; Gutmann, Matthias J.; Jura, Marek; Morrison, Carole A.; Rankin, David W. H. Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone Journal of Applied Crystallography, 2013, 46, 656-662 |
| 2300385 | CIF HKL | C13 H10 O | P 21 21 21 | 7.7145; 10.2301; 12.0269 90; 90; 90 | 949.2 | Reilly, Anthony M.; Wann, Derek A.; Gutmann, Matthias J.; Jura, Marek; Morrison, Carole A.; Rankin, David W. H. Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone Journal of Applied Crystallography, 2013, 46, 656-662 |
| 2300386 | CIF | C13 H10 O | P 21 21 21 | 7.9958; 10.2907; 12.174 90; 90; 90 | 1001.7 | Reilly, Anthony M.; Wann, Derek A.; Gutmann, Matthias J.; Jura, Marek; Morrison, Carole A.; Rankin, David W. H. Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone Journal of Applied Crystallography, 2013, 46, 656-662 |
| 2300392 | CIF | C10 H16 N O1.5 | P 21 21 21 | 7.3188; 11.2018; 24.0156 90; 90; 90 | 1968.89 | Krebs, Frederik C.; Jørgensen, Mikkel; Lebech, Bente; Frydenvang, Karla A perdeuterated cryoprotectant for neutron studies and a demonstration of its use for neutron powder diffraction onL-(−)-ephedrine hemihydrate Journal of Applied Crystallography, 2001, 34, 203 |
| 2300393 | CIF | C10 H16 N O1.5 | P 21 21 21 | 7.3105; 11.1878; 23.979 90; 90; 90 | 1961.2 | Krebs, Frederik C.; Jørgensen, Mikkel; Lebech, Bente; Frydenvang, Karla A perdeuterated cryoprotectant for neutron studies and a demonstration of its use for neutron powder diffraction onL-(−)-ephedrine hemihydrate Journal of Applied Crystallography, 2001, 34, 203 |
| 2300467 | CIF HKL Paper | C20 H15 Br | P 21 21 21 | 5.613; 8.5301; 31.4348 90; 90; 90 | 1505.08 | Tan, Seng Lim; Ng, Seik Weng Does the size of a crystal matter in an X-ray crystal structure analysis of a small molecule? Journal of Applied Crystallography, 2014, 47, 1443-1444 |
| 2300468 | CIF HKL Paper | C20 H15 Br | P 21 21 21 | 5.6011; 8.5219; 31.4741 90; 90; 90 | 1502.32 | Tan, Seng Lim; Ng, Seik Weng Does the size of a crystal matter in an X-ray crystal structure analysis of a small molecule? Journal of Applied Crystallography, 2014, 47, 1443-1444 |
| 2300469 | CIF HKL Paper | C20 H15 Br | P 21 21 21 | 5.6104; 8.5238; 31.496 90; 90; 90 | 1506.2 | Tan, Seng Lim; Ng, Seik Weng Does the size of a crystal matter in an X-ray crystal structure analysis of a small molecule? Journal of Applied Crystallography, 2014, 47, 1443-1444 |
| 2300470 | CIF HKL Paper | C20 H15 Br | P 21 21 21 | 5.6112; 8.5333; 31.4392 90; 90; 90 | 1505.37 | Tan, Seng Lim; Ng, Seik Weng Does the size of a crystal matter in an X-ray crystal structure analysis of a small molecule? Journal of Applied Crystallography, 2014, 47, 1443-1444 |
| 2300571 | CIF HKL Paper | C11 H10 O2 S | P 21 21 21 | 5.9633; 9.0417; 18.4007 90; 90; 90 | 992.14 | Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar An empirical correction for the influence of low-energy contamination Journal of Applied Crystallography, 2015, 48, 1907-1913 |
| 2300572 | CIF HKL Paper | C11 H10 O2 S | P 21 21 21 | 5.9641; 9.0419; 18.4027 90; 90; 90 | 992.4 | Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar An empirical correction for the influence of low-energy contamination Journal of Applied Crystallography, 2015, 48, 1907-1913 |
| 2300573 | CIF HKL Paper | C11 H10 O2 S | P 21 21 21 | 5.9633; 9.0417; 18.4007 90; 90; 90 | 992.14 | Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar An empirical correction for the influence of low-energy contamination Journal of Applied Crystallography, 2015, 48, 1907-1913 |
| 2300623 | CIF HKL Paper | C6 H16 Br N | P 21 21 21 | 7.9986; 8.2984; 13.55 90; 90; 90 | 899.39 | Yadav, Harsh; Sinha, Nidhi; Goel, Sahil; Hussain, Abid; Kumar, Binay Growth and structural and physical properties of diisopropylammonium bromide molecular single crystals Journal of Applied Crystallography, 2016, 49, 2053-2062 |
| 2300675 | CIF | C13 H11 N O5 | P 21 21 21 | 5.3386; 9.9878; 22.3493 90; 90; 90 | 1191.68 | Malaspina, Lorraine A.; Genoni, Alessandro; Jayatilaka, Dylan; Turner, Michael J.; Sugimoto, Kunihisa; Nishibori, Eiji; Grabowsky, Simon The advanced treatment of hydrogen bonding in quantum crystallography Journal of Applied Crystallography, 2021, 54 |
| 2300678 | CIF | C5 H12 O5 | P 21 21 21 | 8.264; 8.901; 8.9223 90; 90; 90 | 656.3 | Malaspina, Lorraine A.; Genoni, Alessandro; Jayatilaka, Dylan; Turner, Michael J.; Sugimoto, Kunihisa; Nishibori, Eiji; Grabowsky, Simon The advanced treatment of hydrogen bonding in quantum crystallography Journal of Applied Crystallography, 2021, 54 |
| 2300695 | CIF HKL | C6 H10 O5 | P 21 21 21 | 6.676; 7.531; 13.279 90; 90; 90 | 667.6 | Lu, Guihua; Zhou, Hengwei; Wei, Lai; Zhao, Xingyu; Li, Zhipeng; Huang, Yineng Growth and characterization of large centimetre-size levoglucosan single crystals Journal of Applied Crystallography, 2023, 56, 468-476 |
| 2300696 | CIF HKL | C6 H10 O5 | P 21 21 21 | 6.6601; 7.5006; 13.26 90; 90; 90 | 662.4 | Lu, Guihua; Zhou, Hengwei; Wei, Lai; Zhao, Xingyu; Li, Zhipeng; Huang, Yineng Growth and characterization of large centimetre-size levoglucosan single crystals Journal of Applied Crystallography, 2023, 56, 468-476 |
| 2300697 | CIF HKL | C6 H10 O5 | P 21 21 21 | 6.6457; 7.476; 13.26 90; 90; 90 | 658.8 | Lu, Guihua; Zhou, Hengwei; Wei, Lai; Zhao, Xingyu; Li, Zhipeng; Huang, Yineng Growth and characterization of large centimetre-size levoglucosan single crystals Journal of Applied Crystallography, 2023, 56, 468-476 |
| 2300711 | CIF Paper | C11 H10 O2 S | P 21 21 21 | 5.86; 8.933; 18.341 90; 90; 90 | 960.1 | Graw, Nico; Ruth, Paul Niklas; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: the long way to a successful charge-density investigation. Journal of applied crystallography, 2023, 56, 1315-1321 |
| 2300718 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.789; 5.958; 12.286 90; 90; 90 | 423.8 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300719 | CIF HKL | C3 H7 N O2 | P 21 21 21 | 5.784; 5.953; 12.272 90; 90; 90 | 422.6 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300720 | CIF HKL | C11 H10 O2 S | P 21 21 21 | 5.854; 8.929; 18.328 90; 90; 90 | 958 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300721 | CIF HKL | C11 H10 O2 S | P 21 21 21 | 5.86; 8.933; 18.341 90; 90; 90 | 960.1 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300722 | CIF HKL | C11 H10 O2 S | P 21 21 21 | 5.85; 8.924; 18.321 90; 90; 90 | 956.5 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300723 | CIF HKL | C11 H10 O2 S | P 21 21 21 | 5.854; 8.929; 18.328 90; 90; 90 | 958 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300724 | CIF HKL | C11 H10 O2 S | P 21 21 21 | 5.86; 8.933; 18.341 90; 90; 90 | 960.1 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300725 | CIF HKL | C11 H10 O2 S | P 21 21 21 | 5.85; 8.924; 18.321 90; 90; 90 | 956.5 | Ruth, Paul Niklas; Graw, Nico; Ernemann, Tobias; Herbst-Irmer, Regine; Stalke, Dietmar Indium <i>K</i>α radiation from a MetalJet X-ray source: comparison of the Eiger2 CdTe and Photon III detectors. Journal of applied crystallography, 2023, 56, 1322-1329 |
| 2300729 | CIF HKL | C16 H10 Br2 O | P 21 21 21 | 3.9774; 10.7746; 31.2387 90; 90; 90 | 1338.73 | Dyk, Konrad; Kinzhybalo, Vasyl; Horak, Yuriy; Butenko, Serhii; Siczek, Miłosz; Kamiński, Daniel M. Bending the bonds: unveiling halogen interactions in the elastic polymorph of 2,5-bis(3-bromophenyl)furan Journal of Applied Crystallography, 2024, 57 |
| 2300732 | CIF | C4 H12 Ca O10 | P 21 21 21 | 9.1718; 9.5882; 10.5502 90; 90; 90 | 927.8 | Kleemiss, Florian; Peyerimhoff, Norbert; Bodensteiner, Michael Refinement of X-ray and electron diffraction crystal structures using analytical Fourier transforms of Slater-type atomic wavefunctions in <i>Olex2</i>. Journal of applied crystallography, 2024, 57, 161-174 |
| 2310007 | CIF Paper | C4 H9 N O3 | P 21 21 21 | 9.1735; 11.4736; 5.4171 90; 90; 90 | 570.166 | Dittrich, B.; Sze, E.; Holstein, J. J.; Hübschle, C. B.; Jayatilaka, D. Crystal-field effects in <small>L</small>-homoserine: multipoles <i>versus</i> quantum chemistry Acta Crystallographica Section A, 2012, 68, 435-442 |
| 2310111 | CIF | B6 Cs2 O10 | P 21 21 21 | 6.18; 8.48; 9.17 90; 90; 90 | 480.567 | Krogh-Moe, J. The Crystal Structure of Cesium Triborate, Cs2 O (B2 O3)3 Acta Crystallographica (1,1948-23,1967), 1960, 13, 889-892 |
| 2310130 | CIF | C7 H13 N O5 | P 21 21 21 | 9.854; 9.249; 10.144 90; 90; 90 | 924.5 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310131 | CIF | C7 H13 N O5 | P 21 21 21 | 9.853; 9.251; 10.145 90; 90; 90 | 924.7 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310132 | CIF | C7 H13 N O5 | P 21 21 21 | 9.866; 9.25; 10.149 90; 90; 90 | 926.2 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310133 | CIF | C7 H13 N O5 | P 21 21 21 | 9.884; 9.253; 10.155 90; 90; 90 | 928.7 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310134 | CIF | C7 H13 N O5 | P 21 21 21 | 9.9026; 9.2485; 10.1662 90; 90; 90 | 931.06 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310135 | CIF | C7 H13 N O5 | P 21 21 21 | 9.9408; 9.2479; 10.1875 90; 90; 90 | 936.55 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310136 | CIF | C7 H13 N O5 | P 21 21 21 | 9.9748; 9.2492; 10.2103 90; 90; 90 | 941.99 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310137 | CIF | C7 H13 N O5 | P 21 21 21 | 10.0123; 9.2556; 10.2441 90; 90; 90 | 949.32 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310138 | CIF | C7 H13 N O5 | P 21 21 21 | 9.854; 9.249; 10.144 90; 90; 90 | 924.5 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310139 | CIF | C7 H13 N O5 | P 21 21 21 | 9.9408; 9.2479; 10.1875 90; 90; 90 | 936.55 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310140 | CIF | C7 H13 N O5 | P 21 21 21 | 9.9748; 9.2492; 10.2103 90; 90; 90 | 941.99 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310141 | CIF | C7 H13 N O5 | P 21 21 21 | 10.0123; 9.2556; 10.2441 90; 90; 90 | 949.32 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310142 | CIF | C16 H26 N2 O7 | P 21 21 21 | 10.1602; 10.4228; 16.3042 90; 90; 90 | 1726.58 | Kolstoe, Simon E.; Jenvey, Michelle C.; Purvis, Alan; Light, Mark E.; Thompson, Darren; Hughes, Peter; Pepys, Mark B.; Wood, Stephen P. Interaction of serum amyloid P component with hexanoyl bis(<small>D</small>-proline) (CPHPC) Acta Crystallographica Section D, 2014, 70, 2232-2240 |
| 2310246 | CIF | Mo Ni | P 21 21 21 | 9.108; 9.108; 8.852 90; 90; 90 | 734.324 | Shoemaker, C.B.; Shoemaker, D.P. The crystal structure of the delta phase, Mo-Ni Acta Crystallographica (1,1948-23,1967), 1963, 16, 997-1009 |
| 2310362 | CIF | Be Ca F Na O6 Si2 | P 21 21 21 | 7.401; 7.42; 9.939 90; 90; 90 | 545.804 | Cannillo, E.; Giuseppetti, G.; Tazzoli, V. The crystal structure of leucophanite Acta Crystallographica (1,1948-23,1967), 1967, 23, 255-259 |
| 2310384 | CIF | F3 H2 K | P 21 21 21 | 8.52; 11.09; 6.69 90; 90; 90 | 632.117 | Forrester, J.D.; Zalkin, A.; Senko, M.E.; Templeton, D.H. Crystal Structure of K H2 F3 and Geometry of the H2 F3(-) Ion Acta Crystallographica (1,1948-23,1967), 1963, 16, 58-62 |
| 2310396 | CIF | H3 O6 Rb Se2 | P 21 21 21 | 5.9192; 17.9506; 12.5038 90; 90; 90 | 1328.57 | Grimm, H.; Fitzgerald, W.J. A neutron investigation of the low-temperature structure of Rb H3 (Se O3)2 Acta Crystallographica A (24,1968-38,1982), 1978, 34, 268-274 |
| 2310481 | CIF | Co2 H33 N10 O18 S4 | P 21 21 21 | 16.36; 13.946; 9.978 90; 90; 90 | 2276.55 | Schaefer, W.P.; Marsh, G.E. The Structure of Decammine - mue-peroxo-dicobalt Monosulfate Tris(bisulfate) Acta Crystallographica (1,1948-23,1967), 1966, 21, 735-743 |
| 2310485 | CIF | O3 U | P 21 21 21 | 7.511; 5.466; 5.224 90; 90; 90 | 214.472 | Siegel, S.; Hoekstra, H.R.; Sherry, E. The Crystal Structure of High-Pressure U O3 Acta Crystallographica (1,1948-23,1967), 1966, 20, 292-295 |
| 2310583 | CIF | Cu H4 O5 Se | P 21 21 21 | 6.671; 9.193; 7.384 90; 90; 90 | 452.835 | Gattow, G. Die Kristallstruktur von Cu Se O3 (H2 O)2 (Chalkomenit) Acta Crystallographica (1,1948-23,1967), 1958, 11, 377-383 |
| 2310819 | CIF | H3 N O | P 21 21 21 | 7.297; 4.392; 4.885 90; 90; 90 | 156.557 | Meyers, E.A.; Lipscomb, W.N. The crystal structure of hydroxylamine Acta Crystallographica (1,1948-23,1967), 1955, 8, 583-587 |
| 2310915 | CIF | H7 N O6 | P 21 21 21 | 9.5; 14.66; 3.38 90; 90; 90 | 470.733 | Luzzati, V. Structure cristalline de H N O3 (H2 O)3. I. Resolution de la structure, utilisation de la fonction de Patterson Acta Crystallographica (1,1948-23,1967), 1953, 6, 152-157 |
| 2310926 | CIF | H5 N O | P 21 21 21 | 4.51; 5.587; 9.7 90; 90; 90 | 244.414 | Olovsson, I.; Templeton, D. H. The crystal structure of ammonia monohydrate Acta Crystallographica (1,1948-23,1967), 1959, 12, 827-832 |
| 2311087 | CIF | C3 H7 N O2 | P 21 21 21 | 5.928; 12.26; 5.794 90; 90; 90 | 421.092 | Hoser, Anna A.; Madsen, Anders Ø. Dynamic quantum crystallography: lattice-dynamical models refined against diffraction data. II. Applications to <small>L</small>-alanine, naphthalene and xylitol Acta Crystallographica Section A, 2017, 73, 102-114 |
| 2311089 | CIF | C5 H12 O5 | P 21 21 21 | 8.262; 8.9; 8.923 90; 90; 90 | 656.124 | Hoser, Anna A.; Madsen, Anders Ø. Dynamic quantum crystallography: lattice-dynamical models refined against diffraction data. II. Applications to <small>L</small>-alanine, naphthalene and xylitol Acta Crystallographica Section A, 2017, 73, 102-114 |
| 2311096 | CIF HKL Paper | C16 H18 O5 | P 21 21 21 | 8.015; 10.015; 17.703 90; 90; 90 | 1421 | Clabbers, Max T. B.; Gruene, Tim; van Genderen, Eric; Abrahams, Jan Pieter Reducing dynamical electron scattering reveals hydrogen atoms Acta Crystallographica Section A, 2019, 75, 82-93 |
| 2311097 | CIF HKL | C18 H16 N2 O6 S2 | P 21 21 21 | 10.996; 12.452; 13.218 90; 90; 90 | 1809.8 | Clabbers, Max T. B.; Gruene, Tim; van Genderen, Eric; Abrahams, Jan Pieter Reducing dynamical electron scattering reveals hydrogen atoms Acta Crystallographica Section A, 2019, 75, 82-93 |
| 2311101 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.9534; 12.2772; 5.7882 90; 90; 90 | 423.07 | Sovago, Ioana; Hoser, Anna A.; Madsen, Anders Ø. A combined model of electron density and lattice dynamics refined against elastic diffraction data. Thermodynamic properties of crystalline <small>L</small>-alanine Acta Crystallographica Section A, 2020, 76, 32-44 |
| 2311102 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.9534; 12.2772; 5.7882 90; 90; 90 | 423.07 | Sovago, Ioana; Hoser, Anna A.; Madsen, Anders Ø. A combined model of electron density and lattice dynamics refined against elastic diffraction data. Thermodynamic properties of crystalline <small>L</small>-alanine Acta Crystallographica Section A, 2020, 76, 32-44 |
| 2311103 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.9534; 12.2772; 5.7882 90; 90; 90 | 423.07 | Sovago, Ioana; Hoser, Anna A.; Madsen, Anders Ø. A combined model of electron density and lattice dynamics refined against elastic diffraction data. Thermodynamic properties of crystalline <small>L</small>-alanine Acta Crystallographica Section A, 2020, 76, 32-44 |
| 2311104 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.9534; 12.2772; 5.7882 90; 90; 90 | 423.07 | Sovago, Ioana; Hoser, Anna A.; Madsen, Anders Ø. A combined model of electron density and lattice dynamics refined against elastic diffraction data. Thermodynamic properties of crystalline <small>L</small>-alanine Acta Crystallographica Section A, 2020, 76, 32-44 |
| 2311105 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.9534; 12.2772; 5.7882 90; 90; 90 | 423.07 | Sovago, Ioana; Hoser, Anna A.; Madsen, Anders Ø. A combined model of electron density and lattice dynamics refined against elastic diffraction data. Thermodynamic properties of crystalline <small>L</small>-alanine Acta Crystallographica Section A, 2020, 76, 32-44 |
| 2311106 | CIF HKL Paper | C3 H7 N O2 | P 21 21 21 | 5.9534; 12.2772; 5.7882 90; 90; 90 | 423.07 | Sovago, Ioana; Hoser, Anna A.; Madsen, Anders Ø. A combined model of electron density and lattice dynamics refined against elastic diffraction data. Thermodynamic properties of crystalline <small>L</small>-alanine Acta Crystallographica Section A, 2020, 76, 32-44 |
| 2311197 | CIF Paper | C20 H18 N4 O3 | P 21 21 21 | 5.1506; 15.334; 22.965 90; 90; 90 | 1813.8 | Akkurt, Mehmet; Jarrahpour, Aliasghar; Chermahini, Mehdi Mohammadi; Shiri, Pezhman; Büyükgüngör, Orhan (E)-N-(1,3-Benzodioxol-5-yl)-1-(4-{[1-(prop-2-en-1-yl)-1H-1,2,3-triazol-4-yl]meth-oxy}phen-yl)methanimine. Acta crystallographica. Section E, Structure reports online, 2013, 69, o1576 |
| 2311215 | CIF Paper | C20 H14 F3 N S2 | P 21 21 21 | 9.847; 10.492; 17.819 90; 90; 90 | 1841 | Manjunath, B. C.; Manjula, M.; Raghavendra, K. R.; Ajay Kumar, K.; Lokanath, N. K. 4-(Thio-phen-2-yl)-2-[4-(tri-fluoro-meth-yl)phen-yl]-2,3-di-hydro-1,5-benzo-thia-zepine. Acta crystallographica. Section E, Structure reports online, 2014, 70, o261 |
| 2311243 | CIF Paper | C17 H15 N3 S | P 21 21 21 | 6.2091; 13.1804; 17.391 90; 90; 90 | 1423.3 | Mague, Joel T.; Akkurt, Mehmet; Mohamed, Shaaban K.; Hassan, Alaa A.; Albayati, Mustafa R. 4'-Phenyl-3,4-di-hydro-2H-spiro-[naph-tha-lene-1,3'-[1,2,4]triazole]-5'-thione. Acta crystallographica. Section E, Structure reports online, 2014, 70, o740-1 |
| 2311256 | CIF | C21 H26 N2 O3 | P 21 21 21 | 7.633; 14.455; 16.504 90; 90; 90 | 1821 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311258 | CIF | C5 H10 N2 O3 | P 21 21 21 | 5.094; 7.745; 15.941 90; 90; 90 | 628.9 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311259 | CIF | C21 H22 N2 | P 21 21 21 | 8.54; 11.086; 17.344 90; 90; 90 | 1642 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311260 | CIF | C21 H29 N3 | P 21 21 21 | 8.513; 11.527; 17.855 90; 90; 90 | 1752.1 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311261 | CIF | C3 H7 N O2 | P 21 21 21 | 5.791; 5.944; 12.269 90; 90; 90 | 422.3 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311262 | CIF | C19 H26 N6 O | P 21 21 21 | 11.25751; 15.43442; 22.52516 90; 90; 90 | 3913.82 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311263 | CIF | C14 H19 N O | P 21 21 21 | 6.816; 8.446; 21.186 90; 90; 90 | 1219.6 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311267 | CIF | C21 H22 N2 | P 21 21 21 | 6.0196; 12.7041; 21.6151 90; 90; 90 | 1652.98 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311268 | CIF | C16 H20 N2 O | P 21 21 21 | 8.695; 10.114; 15.544 90; 90; 90 | 1367 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311269 | CIF | C25 H31 N O5 | P 21 21 21 | 8.414; 13.76; 19.299 90; 90; 90 | 2234.4 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311271 | CIF | C19 H26 N6 O | P 21 21 21 | 11.25467; 15.43831; 22.51824 90; 90; 90 | 3912.61 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311278 | CIF Paper | C17 H12 Cl4 F N O4 | P 21 21 21 | 9.965; 10.982; 16.926 90; 90; 90 | 1852.3 | Zhong, Jia-Liang; Hou, Jia-Wei; Liu, Li-Hong; Liu, He Crystal structure of 1,7,8,9-tetra-chloro-4-(2-fluoro-benz-yl)-10,10-dimeth-oxy-4-aza-tri-cyclo-[5.2.1.0(2,6)]dec-8-ene-3,5-dione. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o32 |
| 2311279 | CIF Paper | C10 H15 Cl3 Ir N | P 21 21 21 | 8.25131; 11.85605; 12.9415 90; 90; 90 | 1266.04 | Morris, David M.; Merola, Joseph S. Serendipitous preparation of fac-(aceto-nitrile-κN)tri-chlorido-[(1,2,5,6-η)-cyclo-octa-1,5-diene]iridium(III). Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 371-373 |
| 2311311 | CIF | C14 H13 N O3 | P 21 21 21 | 7.43; 11.963; 12.648 90; 90; 90 | 1124.2 | Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Borges, Fernanda A comparison of the structures of some 2- and 3-substituted chromone derivatives: a structural study on the importance of the secondary carboxamide backbone for the inhibitory activity of MAO-B. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1270-1277 |
| 2311319 | CIF Paper | C17 H13 N O5 | P 21 21 21 | 6.8118; 13.6726; 15.909 90; 90; 90 | 1481.7 | Walki, Shashikanth; Naveen, S.; Kenchanna, S.; Mahadevan, K. M.; Kumara, M. N.; Lokanath, N. K. Crystal structure of 8-eth-oxy-3-(4-nitro-phen-yl)-2H-chromen-2-one. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o860-1 |
| 2311322 | CIF Paper | C15 H20 O6 | P 21 21 21 | 8.198; 10.029; 16.772 90; 90; 90 | 1378.96 | Çelik, Ísmail; Akkurt, Mehmet; Akşit, Hüseyin; Erenler, Ramazan; García-Granda, Santiago Crystal structure and computational study of 3,4-dihy-droxy-3-hy-droxy-methyl-9-methyl-6-methyl-idene-3a,4,5,6,6a,9,9a,9b-octa-hydro-azuleno[4,5-b]furan-2,8(3H,7H)-dione. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1425-1428 |
| 2311336 | CIF Paper | C20 H21 N O2 | P 21 21 21 | 5.8403; 16.3195; 17.3615 90; 90; 90 | 1654.7 | Aydın, Abdullah; Akkurt, Mehmet; Gul, Halise Inci; Yerdelen, Kadir Ozden; Celik, Raziye Catak Crystal structure of 1-{4-hy-droxy-3-[(pyrrolidin-1-yl)meth-yl]phen-yl}-3-phenyl-prop-2-en-1-one. Acta crystallographica. Section E, Crystallographic communications, 2016, 72, 696-698 |
| 2311344 | CIF Paper | C20 H34 O2 | P 21 21 21 | 7.1114; 16.3899; 32.812 90; 90; 90 | 3824.4 | Çelik, Ísmail; Ersanlı, Cem Cüneyt; Köseoğlu, Rahmi; Akşit, Hüseyin; Erenler, Ramazan; Demirtaş, Ibrahim; Akkurt, Mehmet Crystal structure of 3,4a,7,7,10a-penta-methyl-3-vinyl-dodeca-hydro-1<i>H</i>-benzo[<i>f</i>]chromen-9-ol isolated from <i>Sideritis perfoliata</i>. Acta crystallographica. Section E, Crystallographic communications, 2016, 72, 1380-1382 |
| 2311384 | CIF Paper | C38 H43 Cl4 N3 O4 | P 21 21 21 | 10.4539; 15.1917; 24.3677 90; 90; 90 | 3869.9 | Cunico, Wilson; Ferreira, Maria de Lourdes G; Wardell, James L.; Harrison, William T. A. Different intra- and inter-molecular hydrogen-bonding patterns in (3<i>S</i>,4a<i>S</i>,8a<i>S</i>)-2-[(2<i>R</i>,3<i>S</i>)-3-(2,5-<i>X</i><sub>2</sub>-benzamido)-2-(2,5-<i>X</i><sub>2</sub>-benzo-yloxy)-4-phenyl-butyl]-<i>N</i>-<i>tert</i>-butyldeca-hydro-iso-quinoline-3-carboxamides (<i>X</i> = H or Cl): compounds with moderate aspartyl protease inhibition activity. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 913-917 |
| 2311400 | CIF Paper | C29 H36 O4 | P 21 21 21 | 6.6663; 10.6256; 33.3005 90; 90; 90 | 2358.8 | Ogbeide, K. Osahon; Mujeeb-Ur-Rehman, ?; Owolabi, J. Bodunde; Falodun, Abiodun; Choudhary, M. Iqbal; Yousuf, Sammer Crystal structure and Hirshfeld surface analysis of pulcherrin J. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1572-1575 |
| 2311403 | CIF Paper | C13 H13 F N2 O3 | P 21 21 21 | 5.5357; 8.548; 27.026 90; 90; 90 | 1278.8 | Patel, U. H.; Jotaniya, Chintan; Shah, D. A.; Socha, Bhavesh Ethyl 2-amino-1-(4-fluoro-phen-yl)-5-oxo-4,5-di-hydro-1<i>H</i>-pyrrole-3-carboxyl-ate: crystal structure and Hirshfeld surface analysis. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1336-1340 |
| 2311408 | CIF | C6 H9 Cl2 Mn N O2 | P 21 21 21 | 6.862; 7.491; 18.047 90; 90; 90 | 927.7 | Kang, Linda; Lynch, Genevieve; Lynch, Will; Padgett, Clifford Manganese(II) chloride complexes with pyridine <i>N</i>-oxide (PNO) derivatives and their solid-state structures. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1434-1438 |
| 2311421 | CIF Paper | C20 H15 N O3 S2 | P 21 21 21 | 8.93; 10.8141; 18.6398 90; 90; 90 | 1800.04 | Dhanalakshmi, G.; Saravanan, Velu; Mohanakrishnan, Arasambattu K.; Aravindhan, S. Crystal structures of 1-benzene-sulfon-yl-2-methyl-3-(4-nitro-benzoyl)-2,3-di-hydro-1<i>H</i>-indole and 1-benzene-sulfon-yl-2-methyl-3-[(thio-phen-2-yl)carbon-yl]-2,3-di-hydro-1<i>H</i>-indole. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1555-1559 |
| 2311422 | CIF Paper | C30 H44 O3 | P 21 21 21 | 7.6131; 11.7216; 27.7076 90; 90; 90 | 2472.6 | Herrera-España, Angel D; Mena-Rejón, Gonzalo J; Hernández-Ortega, Simón; Quijano, Leovigildo; Mirón-López, Gumersindo Crystal structure of ochraceolide A isolated from <i>Elaeodendron trichotomum</i> (Turcz.) Lundell. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1475-1478 |
| 2311426 | CIF Paper | C26 H25 N O8 | P 21 21 21 | 7.4849; 16.2063; 20.0959 90; 90; 90 | 2437.68 | Sivakumar, P.; Israel, S.; Chakkaravarthi, G. Crystal structures of 2-methyl-pyridinium hydrogen 2,3-bis-(4-methyl-benzo-yloxy)succinate and bis-[4-methyl-pyridinium hydrogen 2,3-bis-(4-methyl-benzo-yloxy)succinate] penta-hydrate. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1483-1487 |
| 2311436 | CIF Paper | C31 H48 O6 | P 21 21 21 | 9.899; 10.103; 28.961 90; 90; 90 | 2896.4 | Piccialli, Vincenzo; Tuzi, Angela; Centore, Roberto Crystal structure of an ep-oxy-sterol: 9α,11α-ep-oxy-5α-cholest-7-ene-3β,5,6α-triol 3,6-di-acetate. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1603-1606 |
| 2311486 | CIF Paper | C12 H15 N8 O8.5 S | P 21 21 21 | 9.366; 15.203; 23.07 90; 90; 90 | 3285 | Benahsene, Amani Hind; Bendjeddou, Lamia; Merazig, Hocine Crystal structure of bis[bis(4-azaniumylphenyl) sulfone] tetranitrate monohydrate. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1721-1725 |
| 2311514 | CIF Paper | C5 H12 Br2 N2 | P 21 21 21 | 9.7298; 11.8643; 14.4933 90; 90; 90 | 1673.07 | Britvin, Sergey N.; Rumyantsev, Andrey M. Crystal structure of (1<i>S</i>,4<i>S</i>)-2,5-diazo-niabi-cyclo[2.2.1]heptane dibromide. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1861-1865 |
| 2311561 | CIF Paper | C11 H20 Ag Cr N2 O11 | P 21 21 21 | 8.78; 11.443; 16.573 90; 90; 90 | 1665.1 | Moon, Dohyun; Ryoo, Keon Sang; Choi, Jong-Ha Crystal structure of silver [(propane-1,3-diyl-dinitrilo-κ<sup>2</sup><i>N</i>,<i>N</i>')-tetra-acetato-κ<sup>4</sup><i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''']chromate(III) from synchrotron X-ray data. Acta crystallographica. Section E, Crystallographic communications, 2018, 74, 278-281 |
| 2311622 | CIF Paper | C62 H112.5 N11 O12.75 | P 21 21 21 | 12.496; 15.645; 35.653 90; 90; 90 | 6970.2 | Johnas, S. K. J.; Dittrich, B.; Meents, A.; Messerschmidt, M.; Weckert, E. F. Charge-density study on cyclosporine A. Acta crystallographica. Section D, Biological crystallography, 2009, 65, 284-293 |
| 2311630 | CIF | C18 H20 Cl N O8 | P 21 21 21 | 8.5456; 11.74; 19.269 90; 90; 90 | 1933.2 | Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H. Solvates of the antifungal drug griseofulvin: structural, thermochemical and conformational analysis. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 54-62 |
| 2311631 | CIF | C18 H19.5 Cl N0.5 O7 | P 21 21 21 | 8.6852; 15.047; 27.605 90; 90; 90 | 3607.6 | Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H. Solvates of the antifungal drug griseofulvin: structural, thermochemical and conformational analysis. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 54-62 |
| 2311675 | CIF Paper | C19 H14 N4 O4 | P 21 21 21 | 6.5715; 15.0533; 17.0598 90; 90; 90 | 1687.6 | Souza, Talita Evelyn; Rosa, Iara Maria Landre; Legendre, Alexandre Oliveira; Paschoal, Diego; Maia, Lauro J. Q.; Dos Santos, Hélio F; Matins, Felipe Terra; Doriguetto, Antonio Carlos Non-centrosymmetric crystals of new N-benzylideneaniline derivatives as potential materials for non-linear optics. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 416-426 |
| 2311807 | CIF | C8 H9 N O2 | P 21 21 21 | 3.9338; 14.022; 14.126 90; 90; 90 | 779.2 | Sparkes, Hazel A.; Sage, Henry J.; Yufit, Dmitry S. In-situ cryocrystallization of 1,2-dimethyl-3-nitrobenzene and 2,4-dimethyl-1-nitrobenzene. Acta crystallographica. Section C, Structural chemistry, 2014, 70, 872-875 |
| 2311853 | CIF Paper | C12 H26 N3 O P | P 21 21 21 | 6.3318; 10.3065; 23.1616 90; 90; 90 | 1511.5 | Keikha, Mojtaba; Pourayoubi, Mehrdad; Tarahhomi, Atekeh; van der Lee, Arie Syntheses and structures of four new mixed-amide phosphoric triamides. Acta crystallographica. Section C, Structural chemistry, 2016, 72, 251-259 |
| 2311867 | CIF Paper | C5 H5 Cl Li N | P 21 21 21 | 3.9329; 8.615; 17.836 90; 90; 90 | 604.3 | Jalil, AbdelAziz; Clymer, Rebecca N.; Hamilton, Clifton R.; Vaddypally, Shivaiah; Gau, Michael R.; Zdilla, Michael J. Structure of salts of lithium chloride and lithium hexafluorophosphate as solvates with pyridine and vinylpyridine and structural comparisons: (C<sub>5</sub>H<sub>5</sub>N)LiPF<sub>6</sub>, [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]LiPF<sub>6</sub>, [(C<sub>5</sub>H<sub>5</sub>N)LiCl]<sub>n</sub>, and [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>Li(μ-Cl)<sub>2</sub>Li[p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>. Acta crystallographica. Section C, Structural chemistry, 2017, 73, 264-269 |
| 2312003 | CIF Paper | C17 H13 N O4 | P 21 21 21 | 25.8641; 13.2022; 4.05295 90; 90; 90 | 1383.93 | Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627 |
| 2312004 | CIF Paper | C17 H15 N O5 | P 21 21 21 | 25.2195; 12.8116; 4.54932 90; 90; 90 | 1469.9 | Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627 |
| 2312017 | CIF HKL Paper | C38 H44 N4 Ni O6 | P 21 21 21 | 12.9336; 14.5249; 19.9141 90; 90; 90 | 3741.05 | Faizi, Md Serajul Haque; Dege, Necmi; Malinkin, Sergey Crystal structure and DFT study of bis-{(<i>S</i>)-2-[(2-hy-droxy-benzyl)-amino]-4-methyl-penta-noato-κ<sup>2</sup><i>N</i>,<i>O</i>}(1,10-phenanthroline-κ<sup>2</sup><i>N</i>,<i>N</i>')nickel(II). Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1393-1397 |
| 2312020 | CIF HKL Paper | C21 H18 N2 O6 | P 21 21 21 | 6.2899; 15.167; 17.938 90; 90; 90 | 1711.3 | Gayakhe, Vijay; Kapdi, Anant Ramakant; Borozdina, Yulia; Schulzke, Carola Crystal structure of 5-(dibenzo-furan-4-yl)-2'-deoxy-uridine. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1493-1496 |
| 2312042 | CIF HKL | C18 H18 Ba O16 | P 21 21 21 | 7.2781; 13.4581; 22.4129 90; 90; 90 | 2195.33 | Safari, Manije; Sedghiniya, Sima; Soleimannejad, Janet; Janczak, Jan Efficient modulation of a barium metal-organic framework using amino acids. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 114-121 |
| 2312061 | CIF HKL Paper | C15 H10 N2 O2 | P 21 21 21 | 7.7329; 8.2536; 19.2301 90; 90; 90 | 1227.35 | Erzunov, Dmitry; Rassolova, Anastasia; Rumyantsev, Roman; Maizlish, Vladimir; Tikhomirova, Tatiana; Vashurin, Arthur Crystal structures of 4-(2/3-meth-oxy-phen-oxy)phthalo-nitrile. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 172-176 |
| 2312083 | CIF HKL Paper | C18 H42 O21 | P 21 21 21 | 8.8921; 12.2495; 23.798 90; 90; 90 | 2592.2 | Kawasaki, Takuro; Takahashi, Miwako; Kiyanagi, Ryoji; Ohhara, Takashi Rearrangement of hydrogen bonds in dehydrated raffinose tetrahydrate: a time-of-flight neutron diffraction study. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 743-748 |
| 2312084 | CIF HKL Paper | C18 H40 O20 | P 21 21 21 | 8.987; 12.3973; 23.528 90; 90; 90 | 2621.4 | Kawasaki, Takuro; Takahashi, Miwako; Kiyanagi, Ryoji; Ohhara, Takashi Rearrangement of hydrogen bonds in dehydrated raffinose tetrahydrate: a time-of-flight neutron diffraction study. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 743-748 |
| 2312134 | CIF HKL Paper | C17 H24 N2 O5 | P 21 21 21 | 4.82; 19.11; 19.28 90; 90; 90 | 1775.9 | Gessmann, Renate; Garcia-Saez, Isabel; Simatos, Georgios; Mitraki, Anna Z-Ala-Ile-OH, a dipeptide building block suitable for the formation of orthorhombic microtubes. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 277-282 |
| 2312161 | CIF HKL Paper | C36 H66 O5 Si2 | P 21 21 21 | 13.2385; 14.5713; 20.3505 90; 90; 90 | 3925.66 | Kaiser, Maximilian; Weil, Matthias; Gärtner, Peter; Enev, Valentin Crystal structures of two 1,2,3,4-tetra-hydro-naphthalenes obtained during efforts towards the total synthesis of elisabethin A. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 177-181 |
| 2312291 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.7733; 5.9524; 12.2465 90; 90; 90 | 420.85 | Khouchen, Malak; Klar, Paul Benjamin; Chintakindi, Hrushikesh; Suresh, Ashwin; Palatinus, Lukas Optimal estimated standard uncertainties of reflection intensities for kinematical refinement from 3D electron diffraction data Acta Crystallographica Section A Foundations and Advances, 2023, 79, 427-439 |
| 2312292 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.7733; 5.9524; 12.2465 90; 90; 90 | 420.85 | Khouchen, Malak; Klar, Paul Benjamin; Chintakindi, Hrushikesh; Suresh, Ashwin; Palatinus, Lukas Optimal estimated standard uncertainties of reflection intensities for kinematical refinement from 3D electron diffraction data Acta Crystallographica Section A Foundations and Advances, 2023, 79, 427-439 |
| 2312293 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.7733; 5.9524; 12.2465 90; 90; 90 | 420.85 | Khouchen, Malak; Klar, Paul Benjamin; Chintakindi, Hrushikesh; Suresh, Ashwin; Palatinus, Lukas Optimal estimated standard uncertainties of reflection intensities for kinematical refinement from 3D electron diffraction data Acta Crystallographica Section A Foundations and Advances, 2023, 79, 427-439 |
| 2312294 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.7733; 5.9524; 12.2465 90; 90; 90 | 420.85 | Khouchen, Malak; Klar, Paul Benjamin; Chintakindi, Hrushikesh; Suresh, Ashwin; Palatinus, Lukas Optimal estimated standard uncertainties of reflection intensities for kinematical refinement from 3D electron diffraction data Acta Crystallographica Section A Foundations and Advances, 2023, 79, 427-439 |
| 2312295 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.7733; 5.9524; 12.2465 90; 90; 90 | 420.85 | Khouchen, Malak; Klar, Paul Benjamin; Chintakindi, Hrushikesh; Suresh, Ashwin; Palatinus, Lukas Optimal estimated standard uncertainties of reflection intensities for kinematical refinement from 3D electron diffraction data Acta Crystallographica Section A Foundations and Advances, 2023, 79, 427-439 |
| 2312350 | CIF HKL Paper | C29.1 H25.2 Cl0.2 N O4 | P 21 21 21 | 9.28862; 10.34013; 24.3525 90; 90; 90 | 2338.95 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
| 2312397 | CIF Paper | C29 H26 N2 O4 | P 21 21 21 | 33.5486; 26.4223; 5.36515 90; 90; 90 | 4755.84 | Guerain, Mathieu; Correia, Natalia T.; Roca-Paixão, Luisa; Chevreau, Hubert; Affouard, Frederic Using synchrotron high-resolution powder X-ray diffraction for the structure determination of a new cocrystal formed by two active principle ingredients. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 37-42 |
| 2312402 | CIF Paper | C16 H16 Br N O | P 21 21 21 | 5.6599; 7.9243; 34.353 90; 90; 90 | 1540.8 | Anzaldo, Bertin; Moreno Morales, Gloria E.; Villamizar C, Claudia P; Mendoza, Ángel; Hernández Téllez, Guadalupe (<i>S</i>)-(+)-1-(4-Bromo-phen-yl)-<i>N</i>-[(4-methoxyphen-yl)methyl-idene]ethyl-amine and bis-{(<i>S</i>)-(+)-1-(4-bromo-phen-yl)-<i>N</i>-[(4-methoxyphen-yl)methyl-idene]ethyl-amine-κ<i>N</i>}di-chlorido-palladium(II). Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 213-217 |
| 2312405 | CIF Paper | Cd5 H4 O12 P2 | P 21 21 21 | 5.8901; 9.3455; 18.7423 90; 90; 90 | 1031.69 | Eder, Felix; Weil, Matthias Cadmium phosphates Cd<sub>2</sub>(PO<sub>4</sub>)OH and Cd<sub>5</sub>(PO<sub>4</sub>)<sub>2</sub>(OH)<sub>4</sub> crystallizing in mineral structures. Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 207-212 |
| 2312470 | CIF Paper | C13 H14 O5 | P 21 21 21 | 4.9524; 11.0302; 20.9007 90; 90; 90 | 1141.72 | Decato, Daniel; Palatinus, Lukáš; Stierle, Andrea; Stierle, Donald Absolute structure determination of Berkecoumarin by X-ray and electron diffraction. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312550 | CIF Paper | C29 H40 O9 | P 21 21 21 | 9.2707; 15.2236; 20.0806 90; 90; 90 | 2834 | Asmaey, Mostafa A.; Kalofolias, Dimitris A.; Charavgi, Maria Despoina; Abdel-Rahim, Ismail R; Chrysina, Evangelia D.; Abatis, Dennis Crystal structure of the cytotoxic macrocyclic trichothecene Isororidin A. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312551 | CIF Paper | C29 H40 O9 | P 21 21 21 | 9.302; 15.412; 20.191 90; 90; 90 | 2894.6 | Asmaey, Mostafa A.; Kalofolias, Dimitris A.; Charavgi, Maria Despoina; Abdel-Rahim, Ismail R; Chrysina, Evangelia D.; Abatis, Dennis Crystal structure of the cytotoxic macrocyclic trichothecene Isororidin A. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312557 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.89; 5.99; 12.22 90; 90; 90 | 431 | Kumar, Anil; Jha, Kunal Kumar; Olech, Barbara; Goral, Tomasz; Malinska, Maura; Woźniak, Krzysztof; Dominiak, Paulina Maria TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 264-277 |
| 2312558 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.89; 5.99; 12.22 90; 90; 90 | 431 | Kumar, Anil; Jha, Kunal Kumar; Olech, Barbara; Goral, Tomasz; Malinska, Maura; Woźniak, Krzysztof; Dominiak, Paulina Maria TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 264-277 |
| 2312617 | CIF Paper | C4 H12 Ca O10 | P 21 21 21 | 9.1587; 9.5551; 10.5041 90; 90; 90 | 919.24 | Polo, Alvaro; Soriano, Alejandro; Rodríguez, Ricardo; Macías, Ramón; García-Orduña, Pilar; Sanz Miguel, Pablo J. Revisiting a natural wine salt: calcium (2R,3R)-tartrate tetrahydrate. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312618 | CIF HKL Paper | C24 H35 N2 O6.5 | P 21 21 21 | 8.1508; 11.0066; 25.7084 90; 90; 90 | 2306.37 | Liu, Jiyong; Shi, Dier; Yu, Kaxi; Liu, Shuna; Chen, Linshen; Hu, Xiurong Crystal structures and properties of derivatives of the alkaloid matrine: salts and hydrate forms. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312619 | CIF HKL Paper | C22 H32 N2 O5 | P 21 21 21 | 9.2999; 12.7329; 17.5349 90; 90; 90 | 2076.39 | Liu, Jiyong; Shi, Dier; Yu, Kaxi; Liu, Shuna; Chen, Linshen; Hu, Xiurong Crystal structures and properties of derivatives of the alkaloid matrine: salts and hydrate forms. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312691 | CIF Paper | C2 H9 As2 F12 N O3 S | P 21 21 21 | 9.711; 9.7629; 13.5461 90; 90; 90 | 1284.27 | Bockmair, Valentin; Klöck, Andreas; Hollenwäger, Dirk; Kornath, Andreas J. Diprotonation of taurine: 2-[dihydroxy(oxo)sulfanyliumyl]ethanaminium bis[hexafluoroarsenate(V)]. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312724 | CIF Paper | C6 H12 Cl N3 O3 | P 21 21 21 | 6.7936; 8.8294; 15.1621 90; 90; 90 | 909.47 | Vypritskaia, Angelina; Zou, Xiaodong; Yang, Taimin; Waterman, David Geoffrey How to use DIALS to process chemical crystallography 3D ED rotation data from pixel array detectors. Acta crystallographica. Section C, Structural chemistry, 2025, 81 |
| 2312738 | CIF Paper | C3 H6 F5 N O2 | P 21 21 21 | 5.5736; 9.2154; 12.7952 90; 90; 90 | 657.2 | Hollenwäger, Dirk; Leitz, Dominik; Bockmair, Valentin; Kornath, Andreas J. Monoprotonated species of 2-aminomalonyl difluoride, [C<sub>3</sub>H<sub>4</sub>F<sub>2</sub>NO<sub>2</sub>][H<sub>2</sub>F<sub>3</sub>]. Acta crystallographica. Section C, Structural chemistry, 2025, 81 |
| 2312743 | CIF HKL Paper | C22 H24 Cl N O4 | P 21 21 21 | 5.058; 14.786; 26.482 90; 90; 90 | 1981 | Movilla, Federico; Rey, Juan Manuel; López Borda, María Del Rosario; Di Salvo, Florencia Conformational versatility among crystalline solids of L-phenylalanine derivatives. Acta crystallographica. Section C, Structural chemistry, 2025, 81 |
| 2312763 | CIF Paper | C10 H16 N2 O3 S | P 21 21 21 | 5.17; 10.11; 20.71 90; 90; 90 | 1082.5 | Vlahakis, Niko; Qu, Songrong; Richards, Logan S.; Moraes, Lygia Silva de; Cascio, Duilio; Nelson, Hosea M.; Rodriguez, Jose A. Fast event-based electron counting for small-molecule structure determination by MicroED. Acta crystallographica. Section C, Structural chemistry, 2025, 81, 116-130 |
| 2312764 | CIF Paper | C36 H54 N2 O2 | P 21 21 21 | 7.16; 19.44; 29.78 90; 90; 90 | 4145.1 | Vlahakis, Niko; Qu, Songrong; Richards, Logan S.; Moraes, Lygia Silva de; Cascio, Duilio; Nelson, Hosea M.; Rodriguez, Jose A. Fast event-based electron counting for small-molecule structure determination by MicroED. Acta crystallographica. Section C, Structural chemistry, 2025, 81, 116-130 |
| 2312769 | CIF Paper | C20 H30 N8 O4 | P 21 21 21 | 6.9874; 13.8458; 21.4834 90; 90; 90 | 2078.44 | Chalupná, Simona; Hušák, Michal; Čejka, Jan; Fňukal, František; Klimeš, Jiří Computation screening for incorrectly determined cocrystal structures. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81, 208-216 |
| 2312779 | CIF Paper | C13 H12 O3 S2 | P 21 21 21 | 6.9815; 11.7185; 15.9642 90; 90; 90 | 1306.07 | Mama, Neliswa; Schoeman, Stiaan; Myburgh, Lisa; Hosten, Eric C. Synthesis and characterization of coumarin-derived sulfur analogues using Lawesson's reagent. Acta crystallographica. Section C, Structural chemistry, 2025, 81, 170-180 |
| 2312791 | CIF HKL Paper | F5 Hf K | P 21 21 21 | 6.2843; 7.8063; 15.8286 90; 90; 90 | 776.51 | Grigorieva, Oksana P.; Tafeenko, Viktor A.; Berdonosov, Peter S.; Dolgikh, Valery A. KHfF<sub>5</sub>: a new representative in the M<sup>I</sup>M<sup>IV</sup>F<sub>5</sub> family. Acta crystallographica. Section C, Structural chemistry, 2025, 81, 246-251 |
| 2312858 | CIF HKL | C4 H16 Cl4 Co N2 | P 21 21 21 | 9.7066; 7.6312; 16.9019 90; 90; 90 | 1251.97 | Jakhi, Shatakshi S.; Dhanetwal, Meenal; Reddy, V. Raghavendra; Hathwar, Venkatesha R. Effect of the transition metal on the structure and order-disorder phase transition in layered hybrid metal halides (CH<sub>3</sub>CH<sub>2</sub>NH<sub>3</sub>)<sub>2</sub>[MCl<sub>4</sub>] (M = Mn and Co). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2025, 81 |
| 3000056 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 23.432; 9.4425; 6.8835 90; 90; 90 | 1523 | Ewa Patyk-Kazmierczak; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000057 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 23.4; 9.4345; 6.8808 90; 90; 90 | 1519.1 | Ewa Patyk-Kazmierczak; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000058 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 23.352; 9.4208; 6.8757 90; 90; 90 | 1512.6 | Ewa Patyk-Kazmierczak; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000059 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 23.326; 9.3974; 6.8696 90; 90; 90 | 1505.8 | Ewa Patyk-Kazmierczak; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000060 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 23.14; 9.3447; 6.8365 90; 90; 90 | 1478.3 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000061 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 22.93; 9.244; 6.808 90; 90; 90 | 1443 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000062 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 22.66; 9.199; 6.7829 90; 90; 90 | 1413.9 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000063 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 22.38; 9.1047; 6.7256 90; 90; 90 | 1370.4 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000064 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 22.17; 9.0674; 6.7123 90; 90; 90 | 1349.3 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000065 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 22.09; 9.0351; 6.6903 90; 90; 90 | 1335.3 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000066 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.93; 9.0066; 6.6839 90; 90; 90 | 1320.2 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000067 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.9; 8.9676; 6.6585 90; 90; 90 | 1307.7 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000068 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.71; 8.9486; 6.639 90; 90; 90 | 1290 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000069 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.66; 8.915; 6.625 90; 90; 90 | 1279 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000070 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.64; 8.907; 6.621 90; 90; 90 | 1276 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000071 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.631; 8.8833; 6.6067 90; 90; 90 | 1269.5 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000072 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.61; 8.864; 6.5911 90; 90; 90 | 1262.5 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000073 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.183; 8.7794; 6.553 90; 90; 90 | 1218.7 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000074 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.092; 8.7772; 6.5461 90; 90; 90 | 1211.9 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000075 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.023; 8.7747; 6.5491 90; 90; 90 | 1208.1 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000076 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.025; 8.7621; 6.5392 90; 90; 90 | 1204.7 | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak To be published |
| 3000080 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.31; 8.8927; 6.4955 90; 90; 90 | 1231 | Patyk-Kaźmierczak, E.; Warren, M.; Allan, D.; Katrusiak, A. |
| 3000081 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 21.08; 8.7642; 6.5119 90; 90; 90 | 1202.9 | Patyk-Kaźmierczak, E.; Warren, M.; Allan, D.; Katrusiak, A. |
| 3000082 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 20.997; 8.7066; 6.5101 90; 90; 90 | 1190.1 | Patyk-Kaźmierczak, E.; Warren, M.; Allan, D.; Katrusiak, A. |
| 3000083 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 20.939; 8.6912; 6.5058 90; 90; 90 | 1184 | Patyk-Kaźmierczak, E.; Warren, M.; Allan, D.; Katrusiak, A. |
| 3000084 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 20.872; 8.6714; 6.4966 90; 90; 90 | 1175.8 | Patyk-Kaźmierczak, E.; Warren, M.; Allan, D.; Katrusiak, A. |
| 3000085 | On hold until 2017-05-30 | C6 H12 O6 | P 21 21 21 | 20.808; 8.6415; 6.475 90; 90; 90 | 1164.3 | Patyk-Kaźmierczak, E.; Warren, M.; Allan, D.; Katrusiak, A. |
| 3000217 | CIF | C27 H38 F N4 O11 P | P 21 21 21 | 5.34; 19.53; 29.98 90; 90; 90 | 3126.62 | Brázda, Petr; Palatinus, Lukáš; Babor, Martin Electron diffraction determines molecular absolute configuration in a pharmaceutical nanocrystal Science, 2019, 364, 667-669 |
| 3000283 | On hold until 2021-05-25 | C18 H27 N O2 | P 21 21 21 | 9.1371; 10.3821; 17.4893 90; 90; 90 | 1659.07 | Rodriguez-Arevalo, Sergio; Pujol, Eugenia; Abas, Sonia; Galdeano, Carles; Escolano, Carmen; Santiago To be published in Molecules |
| 3000306 | On hold until 2021-11-21 | C23 H25 F Fe N2 | P 21 21 21 | 9.9977; 11.1321; 17.8135 90; 90; 90 | 1982.56 | Rakovský, Erik; Šebesta, Radovan To be published |
| 3000315 | On hold until 2021-12-07 | C23 H25 F Fe N2 | P 21 21 21 | 9.9977; 11.1321; 17.8135 90; 90; 90 | 1982.56 | Rakovský, Erik; Šebesta, Radovan To be published |
| 3000316 | On hold until 2021-12-07 | C23 H25 F Fe N2 | P 21 21 21 | 9.9977; 11.1321; 17.8135 90; 90; 90 | 1982.56 | Rakovský, Erik; Šebesta, Radovan To be published |
| 3000317 | On hold until 2021-12-07 | C23 H25 F Fe N2 | P 21 21 21 | 9.9977; 11.1321; 17.8135 90; 90; 90 | 1982.56 | Rakovský, Erik; Šebesta, Radovan To be published |
| 3000339 | On hold until 2023-01-15 | C6 H16 N2 O9 Zn | P 21 21 21 | 7.7901; 11.2368; 13.2048 90; 90; 90 | 1155.89 | Rakovský, Erik; Pateda, Yogeswara Rao; Chrappová, Jana To be published in Crystallography Reports |
| 3000340 | On hold until 2023-01-15 | C6 H16 N2 O9 Zn | P 21 21 21 | 7.7901; 11.2368; 13.2048 90; 90; 90 | 1155.89 | Rakovský, Erik; Pateda, Yogeswara Rao; Chrappová, Jana To be published in Crystallography Reports |
| 3000341 | On hold until 2023-01-15 | C6 H16 N2 O9 Zn | P 21 21 21 | 7.7901; 11.2368; 13.2048 90; 90; 90 | 1155.89 | Rakovský, Erik; Pateda, Yogeswara Rao; Chrappová, Jana To be published in Crystallography Reports |
| 3000342 | On hold until 2023-01-15 | C6 H16 N2 O9 Zn | P 21 21 21 | 7.7901; 11.2368; 13.2048 90; 90; 90 | 1155.89 | Rakovský, Erik; Pateda, Yogeswara Rao; Chrappová, Jana To be published in Crystallography Reports |
| 3000406 | On hold until 2023-01-08 | C15 H17 N3 O3 | P 21 21 21 | 5.0099; 8.4438; 34.964 90; 90; 90 | 1479.07 | Chien-Wei Chiang To be published |
| 3000415 | CIF | C19 H20 O6 | P 21 21 21 | 6.4; 9.9684; 25.9394 90; 90; 90 | 1654.88 | Phansuang Udomputtimekakul Personal communication to COD, 2022 |
| 3000468 | On hold until 2024-05-12 | B12 H11 N Na | P 21 21 21 | 7.19271; 9.91793; 14.55046 90; 90; 90 | 1037.98 | Mark Paskevicius To be published |
| 3500026 | CIF | C4 H9 N O6 | P 21 21 21 | 7.6385; 7.773; 11.041 90; 90; 90 | 655.55 | Tobias Stürzer; Saulius Gražulis private communication Personal communication to COD, 2015 |
| 3500027 | CIF HKL | Co H9 N6 O6 | P 21 21 21 | 6.8358; 10.0116; 11.6421 90; 90; 90 | 796.75 | Miguel Quirós Redetermination of mer-[Co(NH3)3(NO2)3] Personal communication to COD, 2016 |
| 3500030 | CIF HKL | C13 H22 Cl N | P 21 21 21 | 7.9943; 12.4491; 12.9791 90; 90; 90 | 1291.7 | Thierry Maris Benzyltriethylammonium chloride Personal communication to COD, 2016 |
| 3500031 | CIF HKL | C6 H5 Br2 N | P 21 21 21 | 4.3237; 10.1666; 16.3253 90; 90; 90 | 717.62 | Thierry Maris 2,6-Dibromoaniline Personal communication to COD, 2016 |
| 3500039 | CIF HKL | C4 H5 Ca O6 | P 21 21 21 | 6.86394; 7.76619; 12.06935 90; 90; 90 | 643.377 | Armel Le Bail Calcium tartrate anhydrous form I Personal communication to COD, 2016 |
| 3500088 | CIF HKL | C21 H37 B O | P 21 21 21 | 8.6614; 9.6467; 23.5332 90; 90; 90 | 1966.29 | Thierry Maris methyl bis(2,6,6-trimethylbicyclo[3.1.1]heptan-3-yl)borinate Personal communication to COD, 2020 |
| 3500100 | CIF HKL | C8 H12 N4 O4 | P 21 21 21 | 5.6352; 7.1096; 24.7718 90; 90; 90 | 992.46 | Thierry Maris Personal communication to COD, 2020 |
| 3500133 | CIF HKL | C23 H27 Cl O7 | P 21 21 21 | 5.6107; 9.2303; 39.4699 90; 90; 90 | 2044.08 | Thierry Maris Empagliflozin Personal communication to COD, 2023 |
| 4000030 | CIF | C28 H28 I O4 P | P 21 21 21 | 10.131; 10.131; 25.682 90; 90; 90 | 2635.9 | Bourgogne, Cyril; Fur, Yvette Le; Juen, Patrick; Masson, Patrick; Nicoud, Jean-François; Masse, René Tetra(4-methoxyphenyl)phosphonium Iodide: A Twinned Crystal Built Up with Three-Dimensional Octupolar Nonlinear Optical Chromophores Chemistry of Materials, 2000, 12, 1025-1033 |
| 4000032 | CIF | C10 H56 N10 O29 P6 Ti3 | P 21 21 21 | 10.18; 15.8992; 23.2271 90; 90; 90 | 3759.4 | Guo, Yanghong; Shi, Zhan; Yu, Jihong; Wang, Jidong; Liu, Yunling; Bai, Ni; Pang, Wenqin Solvothermal Synthesis and Characterization of a New Titanium Phosphate with a One-Dimensional Chiral Chain Chemistry of Materials, 2001, 13, 203-207 |
| 4000103 | CIF | C42 H36 Cd N2 O4 | P 21 21 21 | 11.516; 16.417; 18.622 90; 90; 90 | 3520.6 | Chemistry of Materials, 2001 |
| 4000113 | CIF | C26 H31 Cl2 Cu N4 O1.5 | P 21 21 21 | 16.3139; 18.2111; 36.247 90; 90; 90 | 10768.8 | Chemistry of Materials, 2002 |
| 4000212 | CIF | C7 H7 Cu I N O | P 21 21 21 | 4.121; 8.376; 26.321 90; 90; 90 | 908.5 | Chemistry of Materials, 2002 |
| 4000228 | CIF | C2 H10 F3 Fe N2 O4 S | P 21 21 21 | 6.4111; 9.5223; 13.1307 90; 90; 90 | 801.61 | Chemistry of Materials, 2003 |
| 4000233 | CIF | C2 H11 Cr F3 N2 O3 P | P 21 21 21 | 12.801; 9.3375; 6.5081 90; 90; 90 | 777.9 | Fernández, Sergio; Mesa, José L.; Pizarro, José L.; Lezama, Luis; Arriortua, María I.; Rojo, Teófilo Hydrothermal Synthesis, Crystal Structures, Spectroscopic, and Magnetic Properties of Two New Organically Templated Monodimensional Phosphite Compounds: (C2H10N2)[M(HPO3)F3], M = V(III) and Cr(III)} Chemistry of Materials, 2003, 15, 1204-1209 |
| 4000234 | CIF | C2 H11 F3 N2 O3 P V | P 21 21 21 | 12.809; 9.518; 6.4403 90; 90; 90 | 785.2 | Fernández, Sergio; Mesa, José L.; Pizarro, José L.; Lezama, Luis; Arriortua, María I.; Rojo, Teófilo Hydrothermal Synthesis, Crystal Structures, Spectroscopic, and Magnetic Properties of Two New Organically Templated Monodimensional Phosphite Compounds: (C2H10N2)[M(HPO3)F3], M = V(III) and Cr(III)} Chemistry of Materials, 2003, 15, 1204-1209 |
| 4000418 | CIF | C14 H25 N3 O3 S | P 21 21 21 | 7.1549; 11.9854; 20.579 90; 90; 90 | 1764.7 | Chemistry of Materials, 2004 |
| 4000423 | CIF | C21 H31 N3 O3 S | P 21 21 21 | 7.6188; 7.7097; 36.33 90; 90; 90 | 2134 | Chemistry of Materials, 2004 |
| 4000439 | CIF | C25 H29 N3 O2 Zn | P 21 21 21 | 12.862; 13.097; 14.012 90; 90; 90 | 2360.4 | Chemistry of Materials, 2004 |
| 4000956 | CIF | C18 H17 N3 O | P 21 21 21 | 9.0264; 9.906; 16.8195 90; 90; 90 | 1503.92 | Schwartz, Erik; Lim, Eunhee; Gowda, Chandrakala M.; Liscio, Andrea; Fenwick, Oliver; Tu, Guoli; Palermo, Vincenzo; de Gelder, Rene; Cornelissen, Jeroen J. L. M.; Van Eck, Ernst R. H.; Kentgens, Arno P. M.; Cacialli, Franco; Nolte, Roeland J. M.; Samorì, Paolo; Huck, Wilhelm T. S.; Rowan, Alan E. Synthesis, Characterization, and Surface Initiated Polymerization of Carbazole Functionalized Isocyanides Chemistry of Materials, 2010, 22, 2597 |
| 4001285 | CIF | H2 Na Np O4 | P 21 21 21 | 5.8904; 7.6297; 8.154 90; 90; 90 | 366.46 | Almond, Philip M.; Skanthakumar, S.; Soderholm, L.; Burns, Peter C. Cation−Cation Interactions and Antiferromagnetism in Na[Np(V)O2(OH)2]: Synthesis, Structure, and Magnetic Properties Chemistry of Materials, 2007, 19, 280 |
| 4001400 | CIF | C H Ce0.9 Gd0.1 O4 | P 21 21 21 | 8.5501; 7.3054; 5.0045 90; 90; 90 | 312.591 | Go, Yong Bok; Jacobson, Allan J. Solid Solution Precursors to Gadolinia-Doped Ceria Prepared via a Low-Temperature Solution Route Chemistry of Materials, 2007, 19, 4702 |
| 4001451 | CIF | C17 H13 N5 O2 | P 21 21 21 | 17.1841; 12.4648; 6.7661 90; 90; 90 | 1449.27 | Kim, Tae Ho; Seo, Joobeom; Lee, Soo Jin; Lee, Shim Sung; Kim, Jineun; Jung, Jong Hwa Strongly Fluorescent Hydrogel as a Blue-Emitting Nanomaterial: An Approach toward Understanding Fluorescence−Structure Relationship Chemistry of Materials, 2007, 19, 5815 |
| 4001501 | CIF | C9 H22 N18 O2 | P 21 21 21 | 7.6212; 13.336; 18.566 90; 90; 90 | 1887 | Lotsch, Bettina V.; Schnick, Wolfgang From Triazines to Heptazines: Novel Nonmetal Tricyanomelaminates as Precursors for Graphitic Carbon Nitride Materials Chemistry of Materials, 2006, 18, 1891 |
| 4001543 | CIF | C13 H15 N O2 | P 21 21 21 | 6.2089; 8.9509; 23.295 90; 90; 90 | 1294.6 | Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi New Series of Organogelators Derived from a Combinatorial Library of Primary Ammonium Monocarboxylate Salts Chemistry of Materials, 2006, 18, 3795 |
| 4001589 | CIF | H6 Na3 O12 Si3 Tb | P 21 21 21 | 7.028; 11.757; 13.503 90; 90; 90 | 1115.7 | Wang, Guangmei; Li, Jiyang; Yu, Jihong; Chen, Peng; Pan, Qinhe; Song, Hongwei; Xu, Ruren Na3TbSi3O9·3H2O: A New Luminescent Microporous Terbium(III) Silicate Containing HelicalSechserSilicate Chains and 9-Ring Channels Chemistry of Materials, 2006, 18, 5637 |
| 4001635 | CIF | C5 H15 N O9 P2 Zn | P 21 21 21 | 10.42002; 10.45229; 11.62209 90; 90; 90 | 1265.8 | Simon-Masseron, Angélique; Paillaud, Jean-Louis; Patarin, Joël Mu-21: A Three-Dimensional Microporous Zincophosphate Obtained by Direct Synthesis and Reversible Dehydration of the Zincophosphate Mu-19 Chemistry of Materials, 2003, 15, 1000-1005 |
| 4001783 | CIF | Li4 O13 Se4 Sn | P 21 21 21 | 12.84; 12.93; 13.274 90; 90; 90 | 2203.8 | Kaib, Thomas; Bron, Philipp; Haddadpour, Sima; Mayrhofer, Leonhard; Pastewka, Lars; Järvi, Tommi T.; Moseler, Michael; Roling, Bernhard; Dehnen, Stefanie Lithium Chalcogenidotetrelates: LiChT—Synthesis and Characterization of New Li+Ion Conducting Li/Sn/Se Compounds Chemistry of Materials, 2013, 25, 2961 |
| 4001805 | CIF | Cs2 Ge3 Mg Se8 | P 21 21 21 | 7.6635; 12.7242; 17.7724 90; 90; 90 | 1733.02 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001807 | CIF | Cs2 Ge3 Se8 Zn | P 21 21 21 | 7.5756; 12.6191; 17.6543 90; 90; 90 | 1687.7 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001808 | CIF | Cs2 Ge3 Te8 Zn | P 21 21 21 | 8.1345; 13.1145; 18.8263 90; 90; 90 | 2008.4 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001809 | CIF | Cd Cs2 Ge3 S8 | P 21 21 21 | 7.4192; 12.5099; 17.0843 90; 90; 90 | 1585.65 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001810 | CIF | Cd Cs2 Ge3 Se8 | P 21 21 21 | 7.7048; 12.6822; 17.8208 90; 90; 90 | 1741.34 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001811 | CIF | Cs2 Mg Se8 Sn3 | P 21 21 21 | 7.9055; 12.7661; 18.474 90; 90; 90 | 1864.44 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001812 | CIF | Cs2 Se8 Sn3 Zn | P 21 21 21 | 7.8146; 12.6534; 18.3747 90; 90; 90 | 1816.91 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001813 | CIF | Cd Cs2 Se8 Sn3 | P 21 21 21 | 7.9335; 12.7336; 18.5387 90; 90; 90 | 1872.82 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001814 | CIF | Cs2 Hg S8 Sn3 | P 21 21 21 | 7.6672; 12.3405; 17.9011 90; 90; 90 | 1693.7 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4001815 | CIF | Cs2 Hg Se8 Sn3 | P 21 21 21 | 7.9196; 12.6657; 18.5375 90; 90; 90 | 1859.45 | Morris, Collin D.; Li, Hao; Jin, Hosub; Malliakas, Christos D.; Peters, John A.; Trikalitis, Pantelis N.; Freeman, Arthur J.; Wessels, Bruce W.; Kanatzidis, Mercouri G. Cs2MIIMIV3Q8(Q = S, Se, Te): An Extensive Family of Layered Semiconductors with Diverse Band Gaps Chemistry of Materials, 2013, 25, 3344 |
| 4002017 | CIF | C29 H34 N2 O3 Sn | P 21 21 21 | 10.4084; 12.4262; 21.8325 90; 90; 90 | 2823.75 | Rivera, José María; Reyes, Horacio; Cortés, Armando; Santillan, Rosa; Lacroix, Pascal G.; Lepetit, Christine; Nakatani, Keitaro; Farfán, Norberto Second-Harmonic Generation within theP212121Space Group, in a Series of Chiral (Salicylaldiminato)tin Schiff Base Complexes Chemistry of Materials, 2006, 18, 1174 |
| 4002018 | CIF | C28 H32 N2 O3 S Sn | P 21 21 21 | 9.9176; 13.6235; 20.3957 90; 90; 90 | 2755.71 | Rivera, José María; Reyes, Horacio; Cortés, Armando; Santillan, Rosa; Lacroix, Pascal G.; Lepetit, Christine; Nakatani, Keitaro; Farfán, Norberto Second-Harmonic Generation within theP212121Space Group, in a Series of Chiral (Salicylaldiminato)tin Schiff Base Complexes Chemistry of Materials, 2006, 18, 1174 |
| 4002019 | CIF | C29 H34 N2 O3 Sn | P 21 21 21 | 10.3454; 12.6901; 21.4191 90; 90; 90 | 2811.99 | Rivera, José María; Reyes, Horacio; Cortés, Armando; Santillan, Rosa; Lacroix, Pascal G.; Lepetit, Christine; Nakatani, Keitaro; Farfán, Norberto Second-Harmonic Generation within theP212121Space Group, in a Series of Chiral (Salicylaldiminato)tin Schiff Base Complexes Chemistry of Materials, 2006, 18, 1174 |
| 4002020 | CIF | C28 H32 N2 O3 Sn | P 21 21 21 | 10.6965; 12.8584; 20.0495 90; 90; 90 | 2757.61 | Rivera, José María; Reyes, Horacio; Cortés, Armando; Santillan, Rosa; Lacroix, Pascal G.; Lepetit, Christine; Nakatani, Keitaro; Farfán, Norberto Second-Harmonic Generation within theP212121Space Group, in a Series of Chiral (Salicylaldiminato)tin Schiff Base Complexes Chemistry of Materials, 2006, 18, 1174 |
| 4002381 | CIF | H2 O10 Rb2 Si3 Zr | P 21 21 21 | 10.4782; 13.3831; 7.294 90; 90; 90 | 1022.84 | Fewox, C.S.; Kirumakki, S.R.; Clearfield, A. Structural and mechanistic investigation of rubidium ion exchange in potassium zirconium trisilicate Chemistry of Materials (1,1989-), 2007, 19, 384-392 |
| 4002685 | CIF | C27 H29 Al Co N7 O | P 21 21 21 | 10.724; 15.309; 15.309 90; 90; 90 | 2513.3 | Thompson, Anthony B.; Pahls, Dale R.; Bernales, Varinia; Gallington, Leighanne C.; Malonzo, Camille D.; Webber, Thomas; Tereniak, Stephen J.; Wang, Timothy C.; Desai, Sai Puneet; Li, Zhanyong; Kim, In Soo; Gagliardi, Laura; Penn, R. Lee; Chapman, Karena W.; Stein, Andreas; Farha, Omar K.; Hupp, Joseph T.; Martinson, Alex B. F.; Lu, Connie C. Installing Heterobimetallic Cobalt‒Aluminum Single Sites on a Metal Organic Framework Support Chemistry of Materials, 2016, 28, 6753 |
| 4002752 | CIF | C8 H16 Cl3 N O2 | P 21 21 21 | 8.6082; 16.554; 17.9068 90; 90; 90 | 2551.72 | Ji, Chengmin; Wang, Sasa; Liu, Sijie; Sun, Zhihua; Zhang, Jing; Li, Lina; Luo, Junhua Exceptional Three-Level Switching Behaviors of Quadratic Nonlinear Optical Properties in a Tristable Molecule-Based Dielectric Chemistry of Materials, 2017, 29, 3251 |
| 4002953 | CIF | C10 H14 Br4 N4 Zn | P 21 21 21 | 7.2941; 15.3229; 15.3893 90; 90; 90 | 1720 | Yangui, Aymen; Roccanova, Rachel; McWhorter, Timothy M.; Wu, Yuntao; Du, Mao-Hua; Saparov, Bayrammurad Hybrid Organic‒Inorganic Halides (C5H7N2)2MBr4 (M = Hg, Zn) with High Color Rendering Index and High-Efficiency White-Light Emission Chemistry of Materials, 2019, 31, 2983 |
| 4002972 | CIF | C14 H14 Se | P 21 21 21 | 7.13182; 7.33176; 22.8392 90; 90; 90 | 1194.23 | Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J. Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry Chemistry of Materials, 2019, 31, 6598 |
| 4003000 | CIF | C20 H14 Ba5 Cl10 F20 O27 | P 21 21 21 | 13.739; 19.3401; 21.343 90; 90; 90 | 5671.1 | Dissanayake, K. Tauni; Amarasinghe, Dinesh K.; Suescun, Leopoldo; Rabuffetti, Federico A. Accessing Mixed-Halide Upconverters Using Heterohaloacetate Precursors Chemistry of Materials, 2019, 31, 6262 |
| 4003042 | CIF | C22 H16 N2 O2 | P 21 21 21 | 9.362; 11.627; 15.805 90; 90; 90 | 1720.4 | Wang, Xuan; Ma, Huili; Gu, Mingxing; Lin, Changqing; Gan, Nan; Xie, Zongliang; Wang, He; Bian, Lifang; Fu, Lishun; Cai, Suzhi; Chi, Zhenguo; Yao, Wei; An, Zhongfu; Shi, Huifang; Huang, Wei Multicolor Ultralong Organic Phosphorescence through Alkyl Engineering for 4D Coding Applications Chemistry of Materials, 2019, 31, 5584 |
| 4003055 | CIF | Cd Nb O3.14 S0.36 | P 21 21 21 | 7.47367; 7.473783; 10.56693 90; 90; 90 | 590.233 | Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A. Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx Chemistry of Materials, 2019, 31, 7626 |
| 4003087 | CIF | C26 H44 Cl5 N2 Sb | P 21 21 21 | 9.2542; 13.6419; 24.1148 90; 90; 90 | 3044.37 | Li, Zhongyuan; Li, Ye; Liang, Pei; Zhou, Tianliang; Wang, Le; Xie, Rong-Jun Dual-Band Luminescent Lead-Free Antimony Chloride Halides with Near-Unity Photoluminescence Quantum Efficiency Chemistry of Materials, 2019 |
| 4003139 | CIF | C27 H23 N3 O | P 21 21 21 | 9.44471; 10.54296; 21.2952 90; 90; 90 | 2120.47 | Niu, Guangle; Zhang, Ruoyao; Kwong, John P. C.; Lam, Jacky W. Y.; Chen, Congping; Wang, Jianguo; Chen, Yuncong; Feng, Xing; Kwok, Ryan T. K.; Sung, Herman H.-Y.; Williams, Ian D.; Elsegood, Mark R. J.; Qu, Jianan; Ma, Chao; Wong, Kam Sing; Yu, Xiaoqiang; Tang, Ben Zhong Specific Two-Photon Imaging of Live Cellular and Deep-Tissue Lipid Droplets by Lipophilic AIEgens at Ultralow Concentration Chemistry of Materials, 2018, 30, 4778 |
| 4003305 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.642; 14.5365; 14.957 90; 90; 90 | 1661.5 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003306 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.4503; 14.465; 15.649 90; 90; 90 | 1686.5 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003307 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.4439; 14.4725; 15.6319 90; 90; 90 | 1684.1 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003308 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.6421; 14.5416; 14.958 90; 90; 90 | 1662.3 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003309 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.425; 14.5177; 15.5242 90; 90; 90 | 1673.4 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003310 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.6459; 14.5442; 14.9647 90; 90; 90 | 1664.1 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003311 | CIF | C9 H11 Cr Mn N8 | P 21 21 21 | 7.712; 13.401; 14.058 90; 90; 90 | 1452.9 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003312 | CIF | C9 H15 Cr Mn N8 O2 | P 21 21 21 | 7.6695; 14.586; 15.013 90; 90; 90 | 1679.5 | Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials, 2016, 28, 7029 |
| 4003411 | CIF | C59 H35 Cl9 N6 | P 21 21 21 | 13.6522; 16.8556; 22.942 90; 90; 90 | 5279.3 | Etherington, Marc K.; Kukhta, Nadzeya A.; Higginbotham, Heather F.; Danos, Andrew; Bismillah, Aisha N.; Graves, David R.; McGonigal, Paul R.; Haase, Nils; Morherr, Antonia; Batsanov, Andrei S.; Pflumm, Christof; Bhalla, Vandana; Bryce, Martin R.; Monkman, Andrew P. Persistent Dimer Emission in Thermally Activated Delayed Fluorescence Materials. The journal of physical chemistry. C, Nanomaterials and interfaces, 2019, 123, 11109-11117 |
| 4003517 | CIF | H10 Lu2 O16 Se4 | P 21 21 21 | 6.4728; 6.8453; 16.2422 90; 90; 90 | 719.66 | Wu, Chao; Li, Longhua; Lin, Lin; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi Enhancement of Second-Order Optical Nonlinearity in a Lutetium Selenite by Monodentate Anion Partial Substitution Chemistry of Materials, 2020 |
| 4003555 | CIF | C7 H10 Br3 N Pb | P 21 21 21 | 7.887; 10.0639; 15.1133 90; 90; 90 | 1199.6 | Febriansyah, Benny; Neo, Chong Shern Daniel; Giovanni, David; Srivastava, Shivani; Lekina, Yulia; Koh, Teck Ming; Li, Yongxin; Shen, Ze Xiang; Asta, Mark; Sum, Tze Chien; Mathews, Nripan; England, Jason Targeted Synthesis of Trimeric Organic‒Bromoplumbate Hybrids That Display Intrinsic, Highly Stokes-Shifted, Broadband Emission Chemistry of Materials, 2020 |
| 4003691 | CIF | Ba Bi Cs3 O14 P4 | P 21 21 21 | 9.4656; 9.9015; 17.6265 90; 90; 90 | 1652.02 | Qi, Lu; Chen, Zhaohui; Shi, Xuerui; Zhang, Xiaodong; Jing, Qun; Li, Na; Jiang, Zhongqi; Zhang, Bingbing; Lee, Ming-Hsien A3BBi(P2O7)2 (A = Rb, Cs; B = Pb, Ba): Isovalent Cation Substitution to Sustain Large Second-Harmonic Generation Responses Chemistry of Materials, 2020 |
| 4003865 | CIF | C14 H18 Cl0.77 F0.23 Mn N9 P | P 21 21 21 | 10.6652; 11.9991; 16.053 90; 90; 90 | 2054.3 | He, Lei; Shi, Ping-Ping; Zhao, Meng-Meng; Liu, Cai-Ming; Zhang, Wen; Ye, Qiong Emergent Chirality and Nonlinear Optical Switching in a Ferroelastic Molecular Perovskite Solid Solution Chemistry of Materials, 2021, 33, 799-805 |
| 4004062 | CIF | C4 H10 I3 N O Pb | P 21 21 21 | 8.1767; 8.7039; 16.5225 90; 90; 90 | 1175.89 | Li, Zhi; Nega, Philip W.; Nellikkal, Mansoor Ani Najeeb; Dun, Chaochao; Zeller, Matthias; Urban, Jeffrey J.; Saidi, Wissam A.; Schrier, Joshua; Norquist, Alexander J.; Chan, Emory M. Dimensional Control over Metal Halide Perovskite Crystallization Guided by Active Learning Chemistry of Materials, 2022, 34, 756-767 |
| 4020001 | CIF | C28 H42 N6 O8 Si | P 21 21 21 | 6.9145; 20.9656; 21.9283 90; 90; 90 | 3178.9 | Yu Lin Jiang; Carissa J. Wiederholf; Jennifer N. Patro; Kazuhiro Haraguchi; Marc M. Greenberg Journal of Organic Chemistry, 2005, 70, 141-149 |
| 4020005 | CIF | C44 H38 N2 O2 P2 Pd | P 21 21 21 | 9.7483; 17.536; 21.06 90; 90; 90 | 3600.1 | Kevin R. Campos; Michel Journet; Sandra Lee; Edward J. J. Grabowski; Richard D. Tillyer Journal of Organic Chemistry, 2005, 70, 268-274 |
| 4020008 | CIF | C19 H17 N3 O | P 21 21 21 | 8.0723; 12.111; 34.684 90; 90; 90 | 3391 | Sébastien Schoumacker; Olivier Hamelin; Sébastien Téti; Jacques Pécaut; Marc Fontecave Journal of Organic Chemistry, 2005, 70, 301-308 |
| 4020009 | CIF | C14 H14 N2 O | P 21 21 21 | 15.139; 7.9773; 10.163 90; 90; 90 | 1227.4 | Sébastien Schoumacker; Olivier Hamelin; Sébastien Téti; Jacques Pécaut; Marc Fontecave Journal of Organic Chemistry, 2005, 70, 301-308 |
| 4020010 | CIF | C9 H13.5 Cl2 N2 Zn | P 21 21 21 | 7.1662; 7.6325; 23.207 90; 90; 90 | 1269.3 | Sébastien Schoumacker; Olivier Hamelin; Sébastien Téti; Jacques Pécaut; Marc Fontecave Journal of Organic Chemistry, 2005, 70, 301-308 |
| 4020022 | CIF | C40 H26 O2 | P 21 21 21 | 11.174; 13.185; 56.18 90; 90; 90 | 8277 | Matzger, Adam J.; Price, Christopher P. Journal of Organic Chemistry, 2005, 70, 1-6 |
| 4020027 | CIF | C20 H17 Br O6 | P 21 21 21 | 5.122; 17.263; 21.099 90; 90; 90 | 1865.6 | Hiroyuki Suga; Kei Inoue; Shuichi Inoue; Akikazu Kalehi; Motoo Shiro Journal of Organic Chemistry, 2005, 70, 47-56 |
| 4020042 | CIF | C12 H18 O5 | P 21 21 21 | 6.1456; 10.4226; 18.8079 90; 90; 90 | 1204.7 | Bhalchandra V. Joshi; Hyung Ryong Moon; James C. Fettinger; Victor E. Marquez; Kenneth A. Jacobson Journal of Organic Chemistry, 2005, 70, 439-447 |
| 4020050 | CIF | C28 H20 N O2 P | P 21 21 21 | 10.1891; 15.7633; 26.655 90; 90; 90 | 4281.2 | Heiko Bernsmann; Michel van den Berg; Rob Hoen; Adriaan J. Minnaard; Gerlinde Mehler; Manfred T. Reetz; Johannes G. de Vries; Ben L. Feringa Journal of Organic Chemistry, 2005, 70, 943-951 |
| 4020058 | CIF | C16 H14 N2 O3 S | P 21 21 21 | 7.9615; 9.9599; 38.3334 90; 90; 90 | 3039.68 | Tung Siu; Christine J. Picard; Andrei K. Yudin Journal of Organic Chemistry, 2005, 70, 932-937 |
| 4020061 | CIF | C17 H22 N2 O3 | P 21 21 21 | 6.527; 10.719; 23.553 90; 90; 90 | 1647.8 | Franca M. Cordero; Federica Pisaneschi; Karina Meschini Batista; Silvia Valenza; Fabrizio Machetti; Alberto Brandi Journal of Organic Chemistry, 2005, 70, 856-867 |
| 4020065 | CIF | C32 H37 N O8 S | P 21 21 21 | 8.549; 10.236; 35.646 90; 90; 90 | 3119 | Narayan S. Karunjule; Shankar D. Markad; Tarun Sharma; Sushma G. Sabharwal; Vedavati G. Puranik; Dilip D. Dhavale Journal of Organic Chemistry, 2005, 70, 1356-1363 |
| 4020070 | CIF | C62 H50 N2 O6 | P 21 21 21 | 11.2677; 16.808; 25.638 90; 90; 90 | 4855.5 | Hyuma Masu; Masaki Sakai; Keiki Kishikawa; Makoto Yamamoto; Kentaro Yamaguchi; Shigeo Kohmoto Journal of Organic Chemistry, 2005, 70, 1423-1431 |
| 4020074 | CIF | C24 H25 N O3 | P 21 21 21 | 6.102; 9.911; 30.75 90; 90; 90 | 1859 | Takashi Sakai; Yu Liu; Hiroshi Ohta; Toshinobu Korenaga; Tadashi Ema Journal of Organic Chemistry, 2005, 70, 1369-1375 |
| 4020077 | CIF | C14 H17 F3 O2 | P 21 21 21 | 5.8916; 8.8285; 26.731 90; 90; 90 | 1390.39 | Alice E. Lurain; Patrick J. Carroll; Patrick J. Walsh Journal of Organic Chemistry, 2005, 70, 1262-1268 |
| 4020086 | CIF | C13 H14 Br2 O | P 21 21 21 | 6.5473; 10.862; 18.6055 90; 90; 90 | 1323.16 | Gottschling, Stephen E.; Grant, Tina N.; Milnes, Kaarina K.; Jennings, Michael, C.; Baines, Kim M. Cyclopropyl Alkynes as Mechanistic Probes to Distinguish Between Vinyl Radical and Ionic Intermediates Journal of Organic Chemistry, 2005, 70, 2686-2695 |
| 4020094 | CIF | C16 H17 Br O2 | P 21 21 21 | 8.101; 9.767; 18.669 90; 90; 90 | 1477.3 | Shengming Ma; Bin Wu; Xuefeng Jiang; Shimin Zhao Journal of Organic Chemistry, 2005, 70, 2568-2575 |
| 4020113 | CIF | C29 H35 N2 O P | P 21 21 21 | 11.145; 22.855; 10.089 90; 90; 90 | 2569.9 | Mino, Takashi; Saito, Akio; Tanaka, Youichi; Hasegawa, Shintaro; Sato, Yutaka; Sakamoto, Masami; Fujita, Tsutomu Amination of N-Aryl Prolinol via Ring Expansion and Contraction: Application to the Chiral Ligand for the Catalytic Asymmetric Reaction Journal of Organic Chemistry, 2005, 70, 1937-1940 |
| 4020122 | CIF | C23 H25 N O5 S | P 21 21 21 | 7.2994; 14.3444; 20.455 90; 90; 90 | 2141.8 | Min-Ruei Tsai; Bo-Fong Chen; Chih-Ching Cheng; Nein-Chen Chang Journal of Organic Chemistry, 2005, 70, 1780-1785 |
| 4020138 | CIF | C29 H35 N O5 | P 21 21 21 | 10.265; 11.501; 20.442 90; 90; 90 | 2413.3 | Huifang Wu; Denzil Bernard; Weibin Chen; Gary D. Strahan; Jeffrey R. Deschamps; Damon A. Parrish; John W. Lewis; Alexander D. MacKerell, Jr.; Andrew Coop Journal of Organic Chemistry, 2005, 70, 1907-1910 |
| 4020153 | CIF | C17 H25 B F3 N | P 21 21 21 | 7.8196; 11.4374; 19.142 90; 90; 90 | 1712 | Yun Ma; Emil Lobkovsky; David B. Collum Journal of Organic Chemistry, 2005, 70, 2335-2337 |
| 4020163 | CIF | C14 H27 N O5 S Si | P 21 21 21 | 10.159; 11.094; 17.907 90; 90; 90 | 2018.2 | Maria C. Aversa; Anna Barattucci; Paola Bonaccorsi; Placido Giannetto L-Cysteine, a Versatile Source of Sulfenic Acids. Synthesis of Enantiopure Alliin analogues Journal of Organic Chemistry, 2005, 70, 1986-1992 |
| 4020169 | CIF | C40 H45 Br N2 O4 S | P 21 21 21 | 8.5839; 14.514; 30.157 90; 90; 90 | 3757.3 | Dwight D. Kim; Suk Joong Lee; Peter Beak Journal of Organic Chemistry, 2005, 70, 5376-5386 |
| 4020170 | CIF | C26 H32 Br N O4 | P 21 21 21 | 6.419; 17.531; 22.374 90; 90; 90 | 2517.8 | Dwight D. Kim; Suk Joong Lee; Peter Beak Journal of Organic Chemistry, 2005, 70, 5376-5386 |
| 4020171 | CIF | C14 H17 Br O2 | P 21 21 21 | 5.554; 10.954; 20.878 90; 90; 90 | 1270.2 | Dwight D. Kim; Suk Joong Lee; Peter Beak Journal of Organic Chemistry, 2005, 70, 5376-5386 |
| 4020193 | CIF | C33 H37 N O7 | P 21 21 21 | 10.0857; 15.8359; 17.7444 90; 90; 90 | 2834.1 | Darren B. Hansen; Xiaobo Wan; Patrick J. Carroll; Madeleine M. Joullié Journal of Organic Chemistry, 2005, 70, 3120-3126 |
| 4020209 | CIF | C38 H48 N4 O7 | P 21 21 21 | 11.8288; 17.1521; 17.8083 90; 90; 90 | 3613.1 | Eric J. Stoner; Michael S. Allen; Alan C. Christesen; Rodger F. Henry; L. Steven Hollis; Robert Keyes; Ian Marsden; Tamara C. Rehm; Sandeep G. Shiroor; Niru B. Soni; Kent D. Stewart Journal of Organic Chemistry, 2005, 70, 3332-3335 |
| 4020210 | CIF | C34 H42 N2 O7 | P 21 21 21 | 10.4915; 16.6596; 17.7783 90; 90; 90 | 3107.37 | Eric J. Stoner; Michael S. Allen; Alan C. Christesen; Rodger F. Henry; L. Steven Hollis; Robert Keyes; Ian Marsden; Tamara C. Rehm; Sandeep G. Shiroor; Niru B. Soni; Kent D. Stewart Journal of Organic Chemistry, 2005, 70, 3332-3335 |
| 4020213 | CIF | C28 H53 F2 N3 O7 Si2 | P 21 21 21 | 10.5215; 14.6712; 24.061 90; 90; 90 | 3714.1 | Xiao-Long Qiu; Feng-Ling Qing Journal of Organic Chemistry, 2005, 70, 3826-3837 |
| 4020214 | CIF | C15 H26 O4 | P 21 21 21 | 6.003; 9.981; 26.437 90; 90; 90 | 1584 | Alex M. Szpilman; Edward E. Korshin; Haim Rozenberg; Mario D. Bachi Journal of Organic Chemistry, 2005, 70, 3618-3632 |
| 4020216 | CIF | C27 H29 Cl2 N O3 | P 21 21 21 | 6.3071; 12.1522; 32.017 90; 90; 90 | 2454 | Hideko Koshima; Hirohisa Kawanishi; Masaki Nagano; Haitao Yu; Motoo Shiro; Takaaki Hosoya; Hidehiro Uekusa; Yuji Ohashi Journal of Organic Chemistry, 2005, 70, 4490-4497 |
| 4020217 | CIF | C27 H29 Cl2 N O3 | P 21 21 21 | 6.3028; 12.7985; 31.838 90; 90; 90 | 2568.2 | Hideko Koshima; Hirohisa Kawanishi; Masaki Nagano; Haitao Yu; Motoo Shiro; Takaaki Hosoya; Hidehiro Uekusa; Yuji Ohashi Journal of Organic Chemistry, 2005, 70, 4490-4497 |
| 4020218 | CIF | C27 H29 Cl2 N O3 | P 21 21 21 | 6.275; 12.617; 31.923 90; 90; 90 | 2527 | Hideko Koshima; Hirohisa Kawanishi; Masaki Nagano; Haitao Yu; Motoo Shiro; Takaaki Hosoya; Hidehiro Uekusa; Yuji Ohashi Journal of Organic Chemistry, 2005, 70, 4490-4497 |
| 4020222 | CIF | C12 H10 Br F O3 | P 21 21 21 | 3.9446; 15.7446; 18.1173 90; 90; 90 | 1125.2 | Gillian E. Morton; Anthony G. M. Barrett Journal of Organic Chemistry, 2005, 70, 3525-3529 |
| 4020224 | CIF | C33 H20 N O S3 | P 21 21 21 | 8.266; 11.948; 27.816 90; 90; 90 | 2747.3 | Yolanda Arroyo; Ángela Meana; J. Félix Rodríguez; Mercedes Santos; M. Ascensión Sanz-Tejedor; José. L. García Ruano Journal of Organic Chemistry, 2005, 70, 3914-3920 |
| 4020260 | CIF | C18 H20 N4 O8 | P 21 21 21 | 8.1212; 14.9889; 15.8159 90; 90; 90 | 1925.2 | 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 |
| 4020261 | CIF | C32 H38 N8 O16 | P 21 21 21 | 11.977; 15.047; 21.319 90; 90; 90 | 3842.2 | Manuela Tosin; Paul V. Murphy Journal of Organic Chemistry, 2005, 70, 4107-4117 |
| 4020285 | CIF | C22 H29 N O7 | P 21 21 21 | 7.8553; 12.6178; 21.7682 90; 90; 90 | 2157.59 | Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle Journal of Organic Chemistry, 2005, 70, 5070-5085 |
| 4020286 | CIF | C23 H31 N O7 | P 21 21 21 | 7.183; 12.295; 25.615 90; 90; 90 | 2262.2 | Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle Journal of Organic Chemistry, 2005, 70, 5070-5085 |
| 4020288 | CIF | C12 H15 N O4 | P 21 21 21 | 6.6205; 10.695; 16.226 90; 90; 90 | 1148.9 | Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle Journal of Organic Chemistry, 2005, 70, 5070-5085 |
| 4020297 | CIF | C15 H22 O2 S | P 21 21 21 | 9.566; 10.902; 14.003 90; 90; 90 | 1460.3 | Yusuke Nakashima; Toshio Shimizu; Kazunori Hirabayashi; Fujiko Iwasaki; Mikio Yamasaki; Nobumasa Kamigata Journal of Organic Chemistry, 2005, 70, 5020-5027 |
| 4020299 | CIF | C21 H21 Br O4 | P 21 21 21 | 6.112; 10.011; 30.05 90; 90; 90 | 1838 | Hideaki Watanabe; Mitsuhiro Iwamoto; Masahisa Nakada Journal of Organic Chemistry, 2005, 70, 4652-4658 |
| 4020300 | CIF | C19 H20 N2 O3 | P 21 21 21 | 7.7142; 12.489; 16.4407 90; 90; 90 | 1583.94 | Johannes Schütz; Petra Windisch; Elka Kristeva; Klaus Wurst; Karl-Hans Ongania; Ulrike E. I. Horvath; Herwig Schottenberger; Gerhard Laus; Helmut Schmidhammer Journal of Organic Chemistry, 2005, 70, 5323-5326 |
| 4020303 | CIF | C26 H28 N2 O3 | P 21 21 21 | 10.0199; 14.4855; 15.229 90; 90; 90 | 2210.39 | Johannes Schütz; Petra Windisch; Elka Kristeva; Klaus Wurst; Karl-Hans Ongania; Ulrike E. I. Horvath; Herwig Schottenberger; Gerhard Laus; Helmut Schmidhammer Journal of Organic Chemistry, 2005, 70, 5323-5326 |
| 4020304 | CIF | C19 H22 N2 O5 | P 21 21 21 | 8.4712; 9.1064; 21.7919 90; 90; 90 | 1681.07 | Johannes Schütz; Petra Windisch; Elka Kristeva; Klaus Wurst; Karl-Hans Ongania; Ulrike E. I. Horvath; Herwig Schottenberger; Gerhard Laus; Helmut Schmidhammer Journal of Organic Chemistry, 2005, 70, 5323-5326 |
| 4020305 | CIF | C34 H43 N3 O3 | P 21 21 21 | 9.4969; 14.4534; 21.8742 90; 90; 90 | 3002.51 | Johannes Schütz; Petra Windisch; Elka Kristeva; Klaus Wurst; Karl-Hans Ongania; Ulrike E. I. Horvath; Herwig Schottenberger; Gerhard Laus; Helmut Schmidhammer Journal of Organic Chemistry, 2005, 70, 5323-5326 |
| 4020316 | CIF | C18 H23 N O7 | P 21 21 21 | 5.513; 12.528; 26.192 90; 90; 90 | 1809 | Xiaochuan Chen; Jinchun Chen; Michael De Paolis; Jieping Zhu Journal of Organic Chemistry, 2005, 70, 4397-4408 |
| 4020327 | CIF | C29 H17 N5 O | P 21 21 21 | 13.346; 9.489; 36.686 89; 89; 90 | 4645 | Takanori Suzuki; Koji Ichioka; Hiroki Higuchi; Hidetoshi Kawai; Kenshu Fujiwara; Masakazu Ohkita; Takashi Tsuji; Yasutake Takahashi Journal of Organic Chemistry, 2005, 70, 5592-5598 |
| 4020328 | CIF | C29 H23 N5 O | P 21 21 21 | 8.925; 8.797; 31.697 90; 90; 90 | 2488.8 | Takanori Suzuki; Koji Ichioka; Hiroki Higuchi; Hidetoshi Kawai; Kenshu Fujiwara; Masakazu Ohkita; Takashi Tsuji; Yasutake Takahashi Journal of Organic Chemistry, 2005, 70, 5592-5598 |
| 4020330 | CIF | C28 H28 O5 | P 21 21 21 | 8.434; 10.485; 25.37 90; 90; 90 | 2243 | Takanori Suzuki; Koji Ichioka; Hiroki Higuchi; Hidetoshi Kawai; Kenshu Fujiwara; Masakazu Ohkita; Takashi Tsuji; Yasutake Takahashi Journal of Organic Chemistry, 2005, 70, 5592-5598 |
| 4020331 | CIF | C48 H58 O8 | P 21 21 21 | 11.679; 17.481; 20.736 90; 90; 90 | 4233 | Takanori Suzuki; Koji Ichioka; Hiroki Higuchi; Hidetoshi Kawai; Kenshu Fujiwara; Masakazu Ohkita; Takashi Tsuji; Yasutake Takahashi Journal of Organic Chemistry, 2005, 70, 5592-5598 |
| 4020336 | CIF | C16 H22 N P S Se | P 21 21 21 | 8.719; 13.16; 15.8 90; 90; 90 | 1812 | Tsutomu Kimura; Toshiaki Murai; Akihiro Miwa; Daisuke Kurachi; Haruhisa Yoshikawa; Shinzi Kato Journal of Organic Chemistry, 2005, 70, 5611-5617 |
| 4020344 | CIF | C66 H78 N9 O21 Rh2 | P 21 21 21 | 10.6025; 17.5485; 37.3067 90; 90; 90 | 6941.2 | Michael P. Doyle; John P. Morgan; James C. Fettinger; Peter Y. Zavalij; John T. Colyer; Daren J. Timmons; Michael D. Carducci Journal of Organic Chemistry, 2005, 70, 5291-5301 |
| 4020345 | CIF | C66 H84 N8 O22 Rh2 | P 21 21 21 | 10.8222; 21.851; 30.51 90; 90; 90 | 7214.9 | Michael P. Doyle; John P. Morgan; James C. Fettinger; Peter Y. Zavalij; John T. Colyer; Daren J. Timmons; Michael D. Carducci Journal of Organic Chemistry, 2005, 70, 5291-5301 |
| 4020346 | CIF | C71 H80 N12 O32 Rh2 S4 | P 21 21 21 | 15.934; 22.317; 24.695 90; 90; 90 | 8782 | Michael P. Doyle; John P. Morgan; James C. Fettinger; Peter Y. Zavalij; John T. Colyer; Daren J. Timmons; Michael D. Carducci Journal of Organic Chemistry, 2005, 70, 5291-5301 |
| 4020350 | CIF | C12 H13.33 Cl0.67 N2 O0.67 | P 21 21 21 | 5.5724; 12.1744; 24.426 90; 90; 90 | 1657 | Mark S. Kerr; Javier Read de Alaniz; Tomislav Rovis Journal of Organic Chemistry, 2005, 70, 5725-5728 |
| 4020351 | CIF | C15 H21 N O4 | P 21 21 21 | 7.3144; 8.326; 23.569 90; 90; 90 | 1435.34 | Thomas Hjelmgaard; Inger Søtofte; David Tanner Journal of Organic Chemistry, 2005, 70, 5688-5697 |
| 4020356 | CIF | C19 H25 N O8 | P 21 21 21 | 9.6172; 10.6768; 18.0297 90; 90; 90 | 1851.3 | Michael L. Wilson; Patrick J. Carroll; David R. Dalton Journal of Organic Chemistry, 2005, 70, 6492-6495 |
| 4020372 | CIF | C H N S | P 21 21 21 | 6.928; 9.9129; 12.5725 90; 90; 90 | 863.44 | Li Gao; Rawle I. Hollingsworth Design and Evaluation of Dihydroxytetrahydro-1H-pyrrolo[2,1-c]-[1,4]benzothiazines as Conformationally Restricted Transition-State Inhibitors of β-Ribosidases Journal of Organic Chemistry, 2005, 70, 9013-9016 |
| 4020378 | CIF | C16 H13 F3 N2 O | P 21 21 21 | 7.8186; 12.8815; 13.7597 90; 90; 90 | 1385.81 | Choong Leol Yoo; James C. Fettinger; Mark J. Kurth Stannous Chloride in Alcohol: A One-Pot Conversion of 2-Nitro-N-arylbenzamides to 2,3-Dihydro-1H-quinazoline-4-ones Journal of Organic Chemistry, 2005, 70, 6941-6943 |
| 4020379 | CIF | C17 H12 Fe N4 O | P 21 21 21 | 10.1002; 11.4854; 11.816 90; 90; 90 | 1370.71 | Francisco Otón; Alberto Tarraga; Arturo Espinosa; Maria D. Velasco; Delia Bautista; Pedro Molina Preparation, Structure, and Anion Sensing Properties of 1,n-Diaza[n]ferrocenophanes Journal of Organic Chemistry, 2005, 70, 6603-6608 |
| 4020390 | CIF | C17 H26 N2 O5 S | P 21 21 21 | 10.7925; 11.2104; 15.047 90; 90; 90 | 1820.5 | Ravindranadh V. Somu; Rodney L. Johnson Journal of Organic Chemistry, 2005, 70, 5954-5963 |
| 4020391 | CIF | C21 H32 N4 O5 S | P 21 21 21 | 9.8902; 10.0941; 23.188 90; 90; 90 | 2314.9 | Ravindranadh V. Somu; Rodney L. Johnson Journal of Organic Chemistry, 2005, 70, 5954-5963 |
| 4020392 | CIF | C21 H34 N4 O6 S | P 21 21 21 | 11.476; 14.104; 14.63 90; 90; 90 | 2367.9 | Ravindranadh V. Somu; Rodney L. Johnson Journal of Organic Chemistry, 2005, 70, 5954-5963 |
| 4020400 | CIF | C117 H149 Cl2 N5 O8 S8 | P 21 21 21 | 12.9144; 23.419; 38.574 90; 90; 90 | 11666.4 | Bang-Tun Zhao; María-Jesús Blesa; Nicolas Mercier; Franck Le Derf; Marc Sallé Journal of Organic Chemistry, 2005, 70, 6254-6257 |
| 4020409 | CIF | C19 H27 N O9 | P 21 21 21 | 6.8229; 15.473; 18.734 90; 90; 90 | 1977.8 | Jhimli Sengupta; Ranjan Mukhopadhyay; Anup Bhattacharjya; Mohan M. Bhadbhade; Gaurav V. Bhosekar Synthesis and Intramolecular Nitrile Oxide Cycloaddition of 3,5'-Ether-Linked Pseudooligosaccharide Derivatives: An Approach to Chiral Macrooxacycles Journal of Organic Chemistry, 2005, 70, 8579-8582 |
| 4020416 | CIF | C21 H30 N2 O5 | P 21 21 21 | 9.792; 10.144; 22.818 90; 90; 90 | 2266.5 | Sukeerthi Kumar; Céline Flamant-Robin; Qian Wang; Angèle Chiaroni; N. André Sasaki Journal of Organic Chemistry, 2005, 70, 5946-5953 |
| 4020420 | CIF | C24 H47 N3 O4 | P 21 21 21 | 9.87; 13.506; 21.404 90; 90; 90 | 2853.2 | Stephen Hanessian; Hongying Yun; Yihua Hou; Marina Tintelnot-Blomley Stereoselective Synthesis of Constrained Azacyclic Hydroxyethylene Isosteres as Aspartic Protease Inhibitors: Dipolar Cycloaddition and Related Methodologies toward Branched Pyrrolidine and Pyrrolidinone Carboxylic Acids Journal of Organic Chemistry, 2005, 70, 6746-6756 |
| 4020428 | CIF | C24 H31 N O3 | P 21 21 21 | 9.71; 10.824; 21.069 90; 90; 90 | 2214.4 | Stephen Hanessian; Yihua Hou; Malken Bayrakdarian; Marina Tintelnot-Blomley Stereoselective Synthesis of Constrained Oxacyclic Hydroxyethylene Isosteres of Aspartic Protease Inhibitors: Aldol and Mukaiyama Aldol Methodologies for Branched Tetrahydrofuran 2-Carboxylic Acids Journal of Organic Chemistry, 2005, 70, 6735-6745 |
| 4020436 | CIF | C28 H30 N2 O3 | P 21 21 21 | 18.3858; 26.1493; 10.2794 90; 90; 90 | 4942.09 | Gregory K. Friestad; Cristian Draghici; Mustapha Soukri; Jun Qin Journal of Organic Chemistry, 2005, 70, 6330-6338 |
| 4020440 | CIF | C23 H24 O2 S | P 21 21 21 | 14.615; 15.929; 8.391 90; 90; 90 | 1953.3 | Chisato Mukai; Fuyuhiko Inagaki; Tatsunori Yoshida; Katsuya Yoshitani; Yasuyuki Hara; Shinji Kitagaki Rh(I)-Catalyzed Pauson-Khand Reaction and Cycloisomerization of Allenynes: Selective Preparation of Monocyclic, Bicyclo[m.3.0], and Bicyclo[5.2.0] Ring Systems Journal of Organic Chemistry, 2005, 70, 7159-7171 |
| 4020443 | CIF | C13 H16 O3 | P 21 21 21 | 5.7086; 13.0589; 15.2878 90; 90; 90 | 1139.68 | Thomas D. Avery; Daniela Caiazza; Julie A. Culbert; Dennis K. Taylor; Edward R. T. Tiekink 1,2-Dioxines Containing Tethered Hydroxyl Functionality as Convenient Precursors for Pyran Syntheses Journal of Organic Chemistry, 2005, 70, 8344-8351 |
| 4020454 | CIF | C29 H36 N2 O7 | P 21 21 21 | 12.689; 16.874; 26.23 90; 90; 90 | 5616.2 | Pham, Tien Q.; Pyne, Stephen G.; Skelton, Brian W.; White, Allan H. Synthesis of Carbocyclic Hydantocidins via Regioselective and Diastereoselective Phosphine-Catalyzed [3 + 2]-Cycloadditions to 5-Methylenehydantoins Journal of Organic Chemistry, 2005, 70, 6369-6377 |
| 4020456 | CIF | C18 H33 N O4 | P 21 21 21 | 9.0715; 12.551; 17.8175 90; 90; 90 | 2028.64 | Esa T. T. Kumpulainen; Juho Helaja; Jari Koivisto; Ari M. P. Koskinen; Heidi Mansikkamäki; Kari Rissanen Journal of Organic Chemistry, 2005, 70, 6447-6453 |
| 4020457 | CIF | C14 H25 N O4 | P 21 21 21 | 6.325; 10.4854; 24.049 90; 90; 90 | 1594.9 | Esa T. T. Kumpulainen; Juho Helaja; Jari Koivisto; Ari M. P. Koskinen; Heidi Mansikkamäki; Kari Rissanen Journal of Organic Chemistry, 2005, 70, 6447-6453 |
| 4020463 | CIF | C21 H18 F3 N3 | P 21 21 21 | 7.4427; 14.1667; 16.6939 90; 90; 90 | 1760.18 | Graham Sandford; Rachel Slater; Dmitrii S. Yufit; Judith A. K. Howard; Antonio Vong Tetrahydropyrido[3,4-b]pyrazine Scaffolds from Pentafluoropyridine Journal of Organic Chemistry, 2005, 70, 7208-7216 |
| 4020474 | CIF | C20 H20 O8 | P 21 21 21 | 10.1647; 10.1944; 67.375 90; 90; 90 | 6981.6 | Chaomin Li; John A. Porco, Jr. Synthesis and NF-kB Inhibition of the Anti-Angiogenesis Agent(+) -Epoxyquinol A and Related Molecules Journal of Organic Chemistry, 2005, 70, 6053-6065 |
| 4020476 | CIF | C34 H26 Br2 O11 | P 21 21 21 | 8.007; 10.307; 41.274 90; 90; 90 | 3406.4 | Chaomin Li; John A. Porco, Jr. Synthesis of the Epoxyquinol Dimer RKB-3564 D: Utilization of an Alkoxysilanol to Promote [4+4] Dimerization Journal of Organic Chemistry, 2005, 70, 6053-6065 |
| 4020478 | CIF | C27 H26 O7 | P 21 21 21 | 10.216; 11.299; 19.715 90; 90; 90 | 2275.7 | Chaomin Li; John A. Porco, Jr. Journal of Organic Chemistry, 2005, 70, 6053-6065 |
| 4020482 | CIF | C25 H21 N3 | P 21 21 21 | 5.7312; 8.9039; 37.933 90; 90; 90 | 1935.74 | Jye-Shane Yang; Yan-Duo Lin; Ya-Ho Chang; Shin-Shin Wang Journal of Organic Chemistry, 2005, 70, 6066-6073 |
| 4020491 | CIF | C30 H32 O7 | P 21 21 21 | 9.5506; 13.846; 20.022 90; 90; 90 | 2647.6 | Tony K. M. Shing; Gulice Y. C. Leung; To Luk Arabinose-Derived Ketones as Catalysts for Asymmetric Epoxidation of Alkenes Journal of Organic Chemistry, 2005, 70, 7279-7289 |
| 4020497 | CIF | C38 H44 N2 O3 | P 21 21 21 | 11.0669; 13.257; 22.029 90; 90; 90 | 3232.1 | Rafael Pedrosa; Sonia Sayalero; Martina Vicente; Bernabé Casado Chiral Template Mediated Diastereoselective Intramolecular Diels-Alder Reaction Using Furan as a Diene. Toward the Synthesis of Enantiopure Trisubstituted Tetrahydroepoxyisoindolones Journal of Organic Chemistry, 2005, 70, 7273-7278 |
| 4020507 | CIF | C16 H15 N3 O5 | P 21 21 21 | 7.2933; 8.2345; 24.418 90; 90; 90 | 1466.4 | Xiaoguang Lei; Nava Zaarur; Michael Y. Sherman; John A. Porco, Jr. Journal of Organic Chemistry, 2005, 70, 6474-6483 |
| 4020540 | CIF | C23 H26 F3 N O2 | P 21 21 21 | 11.567; 13.101; 13.604 90; 90; 90 | 2061.6 | Hillary M. Peltier; Jonathan A. Ellman N-Sulfinyl Metalloenamine Conjugate Additions: Asymmetric Synthesis of Piperidines Journal of Organic Chemistry, 2005, 70, 7342-7345 |
| 4020541 | CIF | C12 H22 B O P | P 21 21 21 | 9.365; 10.6994; 13.7621 90; 90; 90 | 1378.96 | Yukitoshi Takahashi; Yoshikazu Yamamoto; Kosuke Katagiri; Hiroshi Danjo; Kentaro Yamaguchi; Tsuneo Imamoto P-Chiral o-Phosphinophenol as a P/O Hybrid Ligand: Preparation and Use in Cu-Catalyzed Asymmetric Conjugate Addition of Diethylzinc to Acyclic Enones Journal of Organic Chemistry, 2005, 70, 9009-9012 |
| 4020547 | CIF | C13 H15 N O4 | P 21 21 21 | 7.339; 8.269; 21.022 90; 90; 90 | 1275.7 | Sandra Izquierdo; Federico Rúa; Abdelouahid Sbai; Teodor Parella; Ángel Álvarez-Larena; Vicenç Branchadell; Rosa M. Ortuño (+)- and (-)-2-Aminocyclobutane-1-carboxylic Acids and Their Incorporation into Highly Rigid β-Peptides: Stereoselective Synthesis and a Structural Study Journal of Organic Chemistry, 2005, 70, 7963-7971 |
| 4020548 | CIF | C19 H24 N2 O5 | P 21 21 21 | 5.018; 18.2276; 20.8563 90; 90; 90 | 1907.6 | Sandra Izquierdo; Federico Rúa; Abdelouahid Sbai; Teodor Parella; Ángel Álvarez-Larena; Vicenç Branchadell; Rosa M. Ortuño (+)- and (-)-2-Aminocyclobutane-1-carboxylic Acids and Their Incorporation into Highly Rigid β-Peptides: Stereoselective Synthesis and a Structural Study Journal of Organic Chemistry, 2005, 70, 7963-7971 |
| 4020552 | CIF | C15 H25 N O8 | P 21 21 21 | 5.198; 16.182; 21.494 90; 90; 90 | 1808 | Juhienah K. Khalaf; Apurba Datta Stereoselective Route to the Ezoaminuroic Acid Core of the Ezomycins Journal of Organic Chemistry, 2005, 70, 6937-6940 |
| 4020560 | CIF | C66 H63 N6 O8.5 | P 21 21 21 | 11.737; 13.948; 34.381 90; 90; 90 | 5628.4 | Jonathan P. May; Pierre Fournier; Jonathan Pellicelli; Brian O. Patrick; David M. Perrin High Yielding Synthesis of 3a-Hydroxypyrrolo[2,3-b]indoline Dipeptide Methyl Esters: Synthons for Expedient Introduction of the Hydroxypyrroloindoline Moiety into Larger Peptide-Based Natural Products and for the Creation of Tryptathionine Bridges. Journal of Organic Chemistry, 2005, 70, 8424-8430 |
| 4020561 | CIF | C36 H35 N3 O4 | P 21 21 21 | 10.275; 16.361; 17.474 90; 90; 90 | 2937.5 | Jonathan P. May; Pierre Fournier; Jonathan Pellicelli; Brian O. Patrick; David M. Perrin High Yielding Synthesis of 3a-Hydroxypyrrolo[2,3-b]indoline Dipeptide Methyl Esters: Synthons for Expedient Introduction of the Hydroxypyrroloindoline Moiety into Larger Peptide-Based Natural Products and for the Creation of Tryptathionine Bridges. Journal of Organic Chemistry, 2005, 70, 8424-8430 |
| 4020572 | CIF | C18 H14 Br Cl F N O | P 21 21 21 | 5.2721; 12.916; 23.515 90; 90; 90 | 1601.3 | Michael C. Hillier; Jean-François Marcoux; Dalian Zhao; Edward J. J. Grabowski; Arlene E. McKeown; Richard D. Tillyer Stereoselective Formation of Carbon-Carbon Bonds via S~N2~-Displacement: Synthesis of Substituted Cycloalkyl[b]indoles Journal of Organic Chemistry, 2005, 70, 8385-8394 |
| 4020574 | CIF | C18 H21 N O3 | P 21 21 21 | 5.9101; 14.4928; 17.659 90; 90; 90 | 1512.6 | Romain Noël; Corinne Vanucci-Bacqué; Marie-Claude Fargeau-Bellassoued; Gérard Lhommet Synthesis of New Chiral 6-Carbonyl 2,3,8,8a-Tetrahydro-7H-oxazolo[3,2-a]pyridines Journal of Organic Chemistry, 2005, 70, 9044-9047 |
| 4020575 | CIF | C16 H19 N O2 | P 21 21 21 | 6.037; 7.533; 30.403 90; 90; 90 | 1382.6 | Romain Noël; Corinne Vanucci-Bacqué; Marie-Claude Fargeau-Bellassoued; Gérard Lhommet Synthesis of New Chiral 6-Carbonyl 2,3,8,8a-Tetrahydro-7H-oxazolo[3,2-a]pyridines Journal of Organic Chemistry, 2005, 70, 9044-9047 |
| 4020576 | CIF | C17 H21 N O2 | P 21 21 21 | 7.9659; 10.1397; 18.36 90; 90; 90 | 1483 | Romain Noël; Corinne Vanucci-Bacqué; Marie-Claude Fargeau-Bellassoued; Gérard Lhommet Synthesis of New Chiral 6-Carbonyl 2,3,8,8a-Tetrahydro-7H-oxazolo[3,2-a]pyridines Journal of Organic Chemistry, 2005, 70, 9044-9047 |
| 4020589 | CIF | C34 H50 O5 Si | P 21 21 21 | 7.8941; 15.213; 27.777 90; 90; 90 | 3335.8 | Santiago Díaz-Oltra; Juan Murga; Eva Falomir; Miguel Carda; Gabriel Peris; J. Alberto Marco Double Diastereoselection in Aldol Reactions Mediated by Dicyclohexylchloroborane between Chiral Aldehydes and a Chiral Ethyl Ketone Derived from L-Erythrulose. Synthesis of a C1-C9 Fragment of the Structure of the Antifungal Metabolite Soraphen A~1α~ Journal of Organic Chemistry, 2005, 70, 8130-8139 |
| 4020608 | CIF | C19 H20 Br N O5 | P 21 21 21 | 7.633; 8.8059; 27.8722 90; 90; 90 | 1873.4 | Zhiming Zhao; Eileen Duesler; Canhui Wang; Hua Guo; Patrick S. Mariano Photocyclization Reactions of Cyclohexa- and Cyclopenta-Fused Pyridinium Salts. Factors Governing Regioselectivity Journal of Organic Chemistry, 2005, 70, 8508-8512 |
| 4020639 | CIF | C21 H23 N3 O | P 21 21 21 | 6.0884; 10.5868; 26.996 90; 90; 90 | 1740.1 | Peruncheralathan, S.; Yadav, A. K.; Ila, H.; Junjappa, H. Highly Regioselective Synthesis of 1-Aryl-3 (or 5)-alkyl/aryl-5 (or 3)-(N-cycloamino)pyrazoles Journal of Organic Chemistry, 2005, 70, 9644-9647 |
| 4020640 | CIF | C49 H62 O10 Si2 | P 21 21 21 | 8.4077; 22.863; 24.921 90; 90; 90 | 4790.4 | William T. Lambert; Gregory H. Hanson; Farid Benayoud; Steven D. Burke Halichondrin B: Synthesis of the C1-C22 Subunit Journal of Organic Chemistry, 2005, 70, 9382-9398 |
| 4020642 | CIF | C28 H33 N3 | P 21 21 21 | 10.1911; 11.815; 19.571 90; 90; 90 | 2356.6 | José M. Concellón; Pablo L. Bernad; José Ramón Suárez; Santiago García-Granda; M. Rosario Díaz Selective Ring-Opening of Nonactivated Amino Aziridines by Thiols and Unusual Nucleophilic Substitution of a Dibenzylamino Group Journal of Organic Chemistry, 2005, 70, 9411-9416 |
| 4020644 | CIF | C24 H40 F N3 O3 S | P 21 21 21 | 9.548; 11.666; 47.61 90; 90; 90 | 5303 | Wanlong Jiang; Chen Chen; Dragan Marinkovic; Joe A. Tran; Caroline W. Chen; L. Melissa Arellano; Nicole S. White; Fabio C. Tucci Practical Asymmetric Synthesis of α-Branched 2-Piperazinylbenzylamines by 1,2-Additions of Organometallic Reagents to N-tert-Butanesulfinyl Imines Journal of Organic Chemistry, 2005, 70, 8924-8931 |
| 4020645 | CIF | C23 H38 F N3 O3 S | P 21 21 21 | 10.26; 11.8826; 20.4519 90; 90; 90 | 2493.4 | Wanlong Jiang; Chen Chen; Dragan Marinkovic; Joe A. Tran; Caroline W. Chen; L. Melissa Arellano; Nicole S. White; Fabio C. Tucci Practical Asymmetric Synthesis of α-Branched 2-Piperazinylbenzylamines by 1,2-Additions of Organometallic Reagents to N-tert-Butanesulfinyl Imines Journal of Organic Chemistry, 2005, 70, 8924-8931 |
| 4020647 | CIF | C24 H41 N3 O3 S | P 21 21 21 | 10.23; 12.844; 20.36 90; 90; 90 | 2675.3 | Wanlong Jiang; Chen Chen; Dragan Marinkovic; Joe A. Tran; Caroline W. Chen; L. Melissa Arellano; Nicole S. White; Fabio C. Tucci Practical Asymmetric Synthesis of α-Branched 2-Piperazinylbenzylamines by 1,2-Additions of Organometallic Reagents to N-tert-Butanesulfinyl Imines Journal of Organic Chemistry, 2005, 70, 8924-8931 |
| 4020648 | CIF | C20 H30 F N3 O3 S | P 21 21 21 | 7.2802; 9.3347; 31.939 90; 90; 90 | 2170.5 | Wanlong Jiang; Chen Chen; Dragan Marinkovic; Joe A. Tran; Caroline W. Chen; L. Melissa Arellano; Nicole S. White; Fabio C. Tucci Practical Asymmetric Synthesis of α-Branched 2-Piperazinylbenzylamines by 1,2-Additions of Organometallic Reagents to N-tert-Butanesulfinyl Imines Journal of Organic Chemistry, 2005, 70, 8924-8931 |
| 4020650 | CIF | C20 H30 Cl N3 O3 S | P 21 21 21 | 7.3109; 15.176; 20.6948 90; 90; 90 | 2296.1 | Wanlong Jiang; Chen Chen; Dragan Marinkovic; Joe A. Tran; Caroline W. Chen; L. Melissa Arellano; Nicole S. White; Fabio C. Tucci Practical Asymmetric Synthesis of α-Branched 2-Piperazinylbenzylamines by 1,2-Additions of Organometallic Reagents to N-tert-Butanesulfinyl Imines Journal of Organic Chemistry, 2005, 70, 8924-8931 |
| 4020656 | CIF | C10 H10 Br2 N2 O3 | P 21 21 21 | 5.497; 9.9352; 23.478 90; 90; 90 | 1282.2 | Jignesh Patel; Nadia Pelloux-Léon; Frédéric Minassian; Yannick Vallée Syntheses of S-Enantiomers of Hanishin, Longamide B, and Longamide B Methyl Ester from L-Aspartic Acid β-Methyl Ester: Establishment of Absolute Stereochemistry Journal of Organic Chemistry, 2005, 70, 9081-9084 |
| 4020657 | CIF | C24 H18 Fe2 O2 | P 21 21 21 | 10.3484; 12.843; 26.7241 90; 90; 90 | 3551.75 | Angelica Aguilar-Aguilar; Annette D. Allen; Eduardo Peña Cabrera; Andrei Fedorov; Nanyan Fu; Huda Henry-Riyad; Jörg Leuninger; Ulrich Schmid; Thomas T. Tidwell; Rishi Verma Ferrocenylketene and Ferrocenyl-1,2-bisketenes: Direct Observation and Reactivity Measurements Journal of Organic Chemistry, 2005, 70, 9556-9561 |
| 4020679 | CIF | C18 H29 N O3 | P 21 21 21 | 10.354; 11.028; 14.928 90; 90; 90 | 1704.5 | Rajesh Iyengar; Klaas Schildknegt; Martha Morton; Jeffrey Aubé Revisiting a Classic Approach to the Aspidosperma Alkaloids: An Intramolecular Schmidt Reaction Mediated Synthesis of (+)-Aspidospermidine Journal of Organic Chemistry, 2005, 70, 10645-10652 |
| 4020689 | CIF | C15 H22 O11 S2 | P 21 21 21 | 9.279; 9.314; 47.04 90; 90; 90 | 4065 | Elizabeth J. Grayson; Sarah J. Ward; Alison L. Hall; Phillip M. Rendle; David P. Gamblin; Andrei S. Batsanov; Benjamin G. Davis Glycosyl Disulfides: Novel Glycosylating Reagents with Flexible Aglycon Alteration Journal of Organic Chemistry, 2005, 70, 9740-9754 |
| 4020707 | CIF | C15 H20 N2 O2 | P 21 21 21 | 6.855; 10.497; 20.241 90; 90; 90 | 1456.5 | Ramón Badorrey; Carlos Cativiela; María D. Díaz-de-Villegas; Roberto Díez; Fabrizio Galbiati; José A. Gálvez Highly Diastereoselective Cyanation of Methyl Ketimines Obtained from (R)-Glyceraldehyde Journal of Organic Chemistry, 2005, 70, 10102-10105 |
| 4020708 | CIF | C18 H30 N2 O5 | P 21 21 21 | 9.808; 11.955; 17.065 90; 90; 90 | 2001 | Pijus Kumar Mandal; Kumar K. Kaluarachchi; Douglas Ogrin; Simon G. Bott; John S. McMurray An Efficient Synthesis of the Constrained Peptidomimetic 2-Oxo-3-(N-9-fluorenyloxy-carbonylamino)- 1-azabicyclo[4.3.0]nonane-9-carboxylic Acid from Pyroglutamic Acid Journal of Organic Chemistry, 2005, 70, 10128-10131 |
| 4020712 | CIF | C37 H56 Cu F3 O5 P4 S | P 21 21 21 | 13.0799; 13.5478; 23.1224 90; 90; 90 | 4097.4 | Alexandre Côté; André B. Charette Multicomponent One-Pot Procedure for the Synthesis of Free α-Chiral Amines from Aldehydes Journal of Organic Chemistry, 2005, 70, 10864-10867 |
| 4020724 | CIF | C11 H14 O6 | P 21 21 21 | 5.384; 12.0829; 17.7316 90; 90; 90 | 1153.52 | N. Nieto; P. Molas; J. Benet-Buchholz; A. Vidal-Ferran Practical Synthesis of Shi's Diester Fructose Derivative for Catalytic Asymmetric Epoxidation of Alkenes Journal of Organic Chemistry, 2005, 70, 10143-10146 |
| 4020726 | CIF | C52 H52 N4 O2 | P 21 21 21 | 8.817; 14.894; 32.741 90; 90; 90 | 4299.6 | Jacek Gawroński; Małgorzata Brzostowska; Marcin Kwit; Agnieszka Plutecka; Urszula Rychlewska Rhombimines-Cyclic Tetraimines of trans-1,2-Diaminocyclohexane Shaped by the Diaryl Ether Structural Motif Journal of Organic Chemistry, 2005, 70, 10147-10150 |
| 4020733 | CIF | C16 H17 Br O3 | P 21 21 21 | 5.0172; 11.8925; 24.7383 90; 90; 90 | 1476.06 | Huw M. L. Davies; Simon J. Hedley; Brooks R. Bohall Asymmetric Intermolecular C-H Functionalization of Benzyl Silyl Ethers Mediated by Chiral Auxiliary-Based Aryldiazoacetates and Chiral Dirhodium Catalysts Journal of Organic Chemistry, 2005, 70, 10737-10742 |
| 4020734 | CIF | C22 H21 N O6 S | P 21 21 21 | 10.1562; 10.4485; 19.7286 90; 90; 90 | 2093.5 | Gui-Ling Zhao; Min Shi Aza-Baylis-Hillman Reactions of N-Tosylated Aldimines with Activated Allenes and Alkynes in the Presence of Various Lewis Base Promoters Journal of Organic Chemistry, 2005, 70, 9975-9984 |
| 4020749 | CIF | C13 H16 O3 S | P 21 21 21 | 5.2719; 8.0229; 30.5228 90; 90; 90 | 1290.99 | M. Carmen Carreño; M. Jesús Sanz-Cuesta Conjugate Additions of Me~2~CuLi to Enantiopure γ-Hydroxy-δ-sulfinyl and Sulfonyl Pentenoates Journal of Organic Chemistry, 2005, 70, 10036-10045 |
| 4020758 | CIF | C93 H123 F9 N4 O12.5 | P 21 21 21 | 18.9165; 19.0923; 26.6298 90; 90; 90 | 9617.6 | Ulrich Darbost; Xianshun Zeng; Michel Giorgi; Ivan Jabin Optically Pure Calix[6]tris-ammoniums: Syntheses and Host-Guest Properties toward Neutral Guests Journal of Organic Chemistry, 2005, 70, 10552-10560 |
| 4020765 | CIF | C71 H52 Cl4 O10 | P 21 21 21 | 12.948; 17.7599; 28.2209 90; 90; 90 | 6489.7 | Gui Ling Ning; Xin Cheng Li; Megumu Munakata; Wei Tao Gong; Masahiko Maekawa; Tadao Kamikawa Conversion of Phenyl-Substituted Cyclopentadienes to Pyrylium Cations Journal of Organic Chemistry, 2004, 69, 1432-1434 |
| 4020770 | CIF | C14 H10 N2 S2 | P 21 21 21 | 6.656; 14.038; 40.714 90; 90; 90 | 3804.2 | Teresa Olszewska; Maria Gdaniec; Tadeusz Połoński Planar Chiral Dianthranilide and Dithiodianthranilide Molecules: Optical Resolution, Chiroptical Spectra, and Molecular Self-Assembly Journal of Organic Chemistry, 2004, 69, 1248-1255 |
| 4020772 | CIF | C16 H16 N2 O3 S | P 21 21 21 | 8.749; 9.771; 18.104 90; 90; 90 | 1547.6 | Teresa Olszewska; Maria Gdaniec; Tadeusz Połoński Planar Chiral Dianthranilide and Dithiodianthranilide Molecules: Optical Resolution, Chiroptical Spectra, and Molecular Self-Assembly Journal of Organic Chemistry, 2004, 69, 1248-1255 |
| 4020776 | CIF | C34 H34 N2 O8 | P 21 21 21 | 10.737; 14.931; 18.911 90; 90; 90 | 3031.7 | Teresa Olszewska; Maria Gdaniec; Tadeusz Połoński Planar Chiral Dianthranilide and Dithiodianthranilide Molecules: Optical Resolution, Chiroptical Spectra, and Molecular Self-Assembly Journal of Organic Chemistry, 2004, 69, 1248-1255 |
| 4020779 | CIF | C17 H23 Cl O3 | P 21 21 21 | 9.0118; 10.8258; 16.5929 90; 90; 90 | 1618.8 | Trevor C. McMorris; Michael D. Staake; Michael J. Kelner Synthesis and Biological Activity of Enantiomers of Antitumor Irofulven Journal of Organic Chemistry, 2004, 69, 619-623 |
| 4020787 | CIF | C18 H25 N2 O6 | P 21 21 21 | 7.1376; 7.597; 36.333 90; 90; 90 | 1970.2 | Huaqing Liu; Francis A. Kerdesky; Lawrence A. Black; Michael Fitzgerald; Rodger Henry; Timothy A. Esbenshade; Arthur A. Hancock; Youssef L. Bennani An Efficient Multigram Synthesis of the Potent Histamine H~3~ Antagonist GT-2331 and the Reassessment of the Absolute Configuration Journal of Organic Chemistry, 2004, 69, 192-194 |
| 4020789 | CIF | C10 H10 N10 O10 | P 21 21 21 | 7.1557; 7.5846; 36.427 90.005; 90.002; 89.94 | 1977 | Huaqing Liu; Francis A. Kerdesky; Lawrence A. Black; Michael Fitzgerald; Rodger Henry; Timothy A. Esbenshade; Arthur A. Hancock; Youssef L. Bennani An Efficient Multigram Synthesis of the Potent Histamine H~3~ Antagonist GT-2331 and the Reassessment of the Absolute Configuration Journal of Organic Chemistry, 2004, 69, 192-194 |
| 4020795 | CIF | C22 H26 N2 O3 S | P 21 21 21 | 9.6661; 9.9694; 21.165 90; 90; 90 | 2039.6 | Shawn R. Hitchcock; David M. Casper; Jeremy F. Vaughn; Jennifer M. Finefield; Gregory M. Ferrence; Joel M. Esken Intramolecular Chiral Relay at Stereogenic Nitrogen. Synthesis and Application of a New Chiral Auxiliary Derived from (1R,2S)-Norephedrine and Acetone Journal of Organic Chemistry, 2004, 69, 714-718 |
| 4020799 | CIF | C15 H16 O7 S | P 21 21 21 | 6.9869; 10.6937; 20.5161 90; 90; 90 | 1532.88 | Nigel A. Swain; Richard C. D. Brown; Gordon Bruton A Versatile Stereoselective Synthesis of endo,exo-Furofuranones: Application to the Enantioselective Synthesis of Furofuran Lignans Journal of Organic Chemistry, 2004, 69, 122-129 |
| 4020806 | CIF | C22 H30 N2 O8 | P 21 21 21 | 6.24; 13.546; 29.709 90; 90; 90 | 2511.21 | J. Marin; C. Didierjean; A. Aubry; J.-R. Casimir; J.-P. Briand; G. Guichard Synthesis of Enantiopure 4-Hydroxypipecolate and 4-Hydroxylysine Derivatives from a Common 4,6-Dioxopiperidinecarboxylate Precursor Journal of Organic Chemistry, 2004, 69, 130-141 |
| 4020817 | CIF | C18 H23 N O6 | P 21 21 21 | 5.585; 15.254; 21.048 90; 90; 90 | 1793.2 | Juhienah K. Khalaf; Apurba Datta An Efficient and Highly Stereocontrolled Route to Bulgecinine hydrochloride. Journal of Organic Chemistry, 2004, 69, 387-390 |
| 4020818 | CIF | C23 H30 N2 O4 S | P 21 21 21 | 15.952; 18.974; 7.667 90; 90; 90 | 2320.8 | Hideto Miyabe; Yousuke Yamaoka; Takeaki Naito; Yoshiji Takemoto Palladium-Indium Iodide-Mediated Allylation and Propargylation of Glyoxylic Oxime Ether and Hydrazone: The Role of Water in Directing the Diastereoselective Allylation Journal of Organic Chemistry, 2004, 69, 1415-1418 |
| 4020823 | CIF | C27 H32 O3 | P 21 21 21 | 15.5081; 21.0872; 7.0796 90; 90; 90 | 2315.18 | Ken Tsutsumi; Hiroaki Nakano; Akinori Furutani; Katsunori Endou; Abdurshit Merpuge; Takuya Shintani; Tsumoru Morimoto; Kiyomi Kakiuchi Novel Enhancement of Diastereoselectivity of [2 + 2] Photocycloaddition of Chiral Cyclohexenones to Ethylene by Adding Naphthalenes Journal of Organic Chemistry, 2004, 69, 785-789 |
| 4020824 | CIF | C29 H36 O3 | P 21 21 21 | 11.0801; 20.731; 10.85 90; 90; 90 | 2492.2 | Ken Tsutsumi; Hiroaki Nakano; Akinori Furutani; Katsunori Endou; Abdurshit Merpuge; Takuya Shintani; Tsumoru Morimoto; Kiyomi Kakiuchi Novel Enhancement of Diastereoselectivity of [2 + 2] Photocycloaddition of Chiral Cyclohexenones to Ethylene by Adding Naphthalenes Journal of Organic Chemistry, 2004, 69, 785-789 |
| 4020825 | CIF | C27 H27 Cl N2 O4 | P 21 21 21 | 6.7469; 15.7432; 23.136 90; 90; 90 | 2457.5 | James R. Burgeson; Matthew K. Renner; Ingo Hardt; Gregory M. Ferrence; Jean M. Standard; Shawn R. Hitchcock Toward the Development of a Structurally Novel Class of Chiral Auxiliaries. Conformational Properties of the Aldol Adducts of Oxadiazinones: Observation of Unusual Shielding Effects Journal of Organic Chemistry, 2004, 69, 727-734 |
| 4020826 | CIF | C15 H22 O6 | P 21 21 21 | 8.6202; 10.0407; 18.1422 90; 90; 90 | 1570.26 | Stéphane Trudeau; Pierre Deslongchamps Novel Synthesis of Highly Functionalized 14-β-Hydroxysteroids Related to Batrachotoxin and Ouabain Journal of Organic Chemistry, 2004, 69, 832-838 |
| 4020842 | CIF | C19 H21 Br N2 | P 21 21 21 | 7.871; 10.716; 20.54 90; 90; 90 | 1732.5 | M. Heiko Franz; Stefanie Röper; Rudolf Wartchow; H. M. R. Hoffmann The First and Second Cinchona Rearrangement. Two Fundamental Transformations of Alkaloid Chemistry Journal of Organic Chemistry, 2004, 69, 2983-2991 |
| 4020843 | CIF | C19 H20 N2 | P 21 21 21 | 8.641; 10.306; 17.176 90; 90; 90 | 1529.6 | M. Heiko Franz; Stefanie Röper; Rudolf Wartchow; H. M. R. Hoffmann The First and Second Cinchona Rearrangement. Two Fundamental Transformations of Alkaloid Chemistry Journal of Organic Chemistry, 2004, 69, 2983-2991 |
| 4020848 | CIF | C46 H48 B N O7 S | P 21 21 21 | 11.244; 17.11; 21.395 90; 90; 90 | 4116.2 | Ho-Kee Yim; Henry N. C. Wong Diastereoselective Addition Reactions of Furyl Sulfonylimine Using Chiral Boronates as Auxiliary: Application to the Enantioselective Synthesis of 2,3-Disubstituted Furyl Sulfonylamides Journal of Organic Chemistry, 2004, 69, 2892-2895 |
| 4020850 | CIF | C48 H50 B N O9 S | P 21 21 21 | 13.8; 16.271; 19.707 90; 90; 90 | 4424.8 | Ho-Kee Yim; Henry N. C. Wong Diastereoselective Addition Reactions of Furyl Sulfonylimine Using Chiral Boronates as Auxiliary: Application to the Enantioselective Synthesis of 2,3-Disubstituted Furyl Sulfonylamides Journal of Organic Chemistry, 2004, 69, 2892-2895 |
| 4020851 | CIF | C51 H54 B N O9 S | P 21 21 21 | 13.922; 16.261; 20.062 90; 90; 90 | 4541.6 | Ho-Kee Yim; Henry N. C. Wong Diastereoselective Addition Reactions of Furyl Sulfonylimine Using Chiral Boronates as Auxiliary: Application to the Enantioselective Synthesis of 2,3-Disubstituted Furyl Sulfonylamides Journal of Organic Chemistry, 2004, 69, 2892-2895 |
| 4020870 | CIF | C22 H28 O S3 | P 21 21 21 | 13.217; 15.6; 10.223 90; 90; 90 | 2108 | Hideaki Oshida; Akihiko Ishii; Juzo Nakayama Oxidation of cis- and trans-3,5-Di-tert-butyl-3,5-diphenyl- 1,2,4-trithiolanes: Isolation and Properties of the 1-Oxides and the 1,2-Dioxides Journal of Organic Chemistry, 2004, 69, 1695-1703 |
| 4020875 | CIF | C11 H17 N O5 | P 21 21 21 | 5.986; 10.321; 19.807 90; 90; 90 | 1223.7 | François-Xavier Felpin; Kamal Boubekeur; Jacques Lebreton First Total Synthesis of 1-O-β-D-Glucopyranosyl-5-deoxyadenophorine and Its Aglycon Congener: Determination of the Absolute Configuration Journal of Organic Chemistry, 2004, 69, 1497-1503 |
| 4020901 | CIF | C25 H30 F2 N2 O3 | P 21 21 21 | 20.228; 24.777; 5.007 90.02; 90; 90.02 | 2509 | Akira Otaka; Junko Watanabe; Akira Yukimasa; Yoshikazu Sasaki; Hideaki Watanabe; Takayoshi Kinoshita; Shinya Oishi; Hirokazu Tamamura; Nobutaka Fujii SmI~2~-Mediated Reduction of γ,γ-Difluoro-α,β-enoates with Application to the Synthesis of Functionalized (Z)-Fluoroalkene-Type Dipeptide Isosteres Journal of Organic Chemistry, 2004, 69, 1634-1645 |
| 4020904 | CIF | C18 H17 N O2 | P 21 21 21 | 10.4657; 10.8886; 12.9242 90; 90; 90 | 1472.8 | Waldemar Adam; Sara G. Bosio; Nicholas J. Turro; Barbara T. Wolff Enecarbamates as Selective Substrates in Oxidations: Chiral-Auxiliary-Controlled Mode Selectivity and Diastereoselectivity in the [2+2] Cycloaddition and Ene Reaction of Singlet Oxygen and in the Epoxidation by DMD and mCPBA Journal of Organic Chemistry, 2004, 69, 1704-1715 |
| 4020905 | CIF | C15 H14 O2 | P 21 21 21 | 8.264; 11.829; 12.102 90; 90; 90 | 1183 | Yoshiaki Nishibayashi; Masato Yoshikawa; Youichi Inada; Masanobu Hidai; Sakae Uemura Ruthenium-Catalyzed Cycloaddition between Propargylic Alcohols and Cyclic 1,3-Dicarbonyl Compounds via an Allenylidene Intermediate Journal of Organic Chemistry, 2004, 69, 3408-3412 |
| 4020907 | CIF | C12 H23 N O5 S | P 21 21 21 | 5.232; 9.09; 32.408 90; 90; 90 | 1541.4 | T. Govindaraju; Vaijayanti A. Kumar; Krishna N. Ganesh Synthesis and Evaluation of (1S,2R/1R,2S)-Aminocyclohexylglycyl PNAs as Conformationally Preorganized PNA Analogues for DNA/RNA Recognition Journal of Organic Chemistry, 2004, 69, 1858-1865 |
| 4020908 | CIF | C12 H23 N O5 S | P 21 21 21 | 5.2293; 9.0539; 32.279 90; 90; 90 | 1528.3 | T. Govindaraju; Vaijayanti A. Kumar; Krishna N. Ganesh Synthesis and Evaluation of (1S,2R/1R,2S)-Aminocyclohexylglycyl PNAs as Conformationally Preorganized PNA Analogues for DNA/RNA Recognition Journal of Organic Chemistry, 2004, 69, 1858-1865 |
| 4020918 | CIF | C19 H24 N2 O6 S | P 21 21 21 | 7.409; 14.055; 19.276 90; 90; 90 | 2007.3 | Iwona Kudyba; Jerzy Raczko; Janusz Jurczak Asymmetric Nitroaldol Reaction. Synthesis of Taxotere Side Chain and (-)-Bestatin Using (1R)-8-Phenylmenthyl Glyoxylate Journal of Organic Chemistry, 2004, 69, 2844-2850 |
| 4020919 | CIF | C25 H31 N O5 | P 21 21 21 | 10.363; 14.057; 15.488 90; 90; 90 | 2256.2 | Iwona Kudyba; Jerzy Raczko; Janusz Jurczak Asymmetric Nitroaldol Reaction. Synthesis of Taxotere Side Chain and (-)-Bestatin Using (1R)-8-Phenylmenthyl Glyoxylate Journal of Organic Chemistry, 2004, 69, 2844-2850 |
| 4020963 | CIF | C9 H17 N O2 | P 21 21 21 | 7.65; 8.493; 14.207 90; 90; 90 | 923.1 | Gavin O'Mahony; Mark Nieuwenhuyzen; Paul Armstrong; Paul J. Stevenson Rapid Stereoselective Access to Key Pumiliotoxin Precursors from a Common Intermediate Journal of Organic Chemistry, 2004, 69, 3968-3971 |
| 4020964 | CIF | C9 H13 N O2 | P 21 21 21 | 6.474; 13.389; 19.734 90; 90; 90 | 1710.6 | Gavin O'Mahony; Mark Nieuwenhuyzen; Paul Armstrong; Paul J. Stevenson Rapid Stereoselective Access to Key Pumiliotoxin Precursors from a Common Intermediate Journal of Organic Chemistry, 2004, 69, 3968-3971 |
| 4020966 | CIF | C20 H19 N3 O4 S | P 21 21 21 | 9.1528; 9.9689; 20.8724 90; 90; 90 | 1904.5 | Rosa L. Meza-León; David Crich; Sylvain Bernès; Leticia Quintero Endo-Selective Quenching of Hexahydropyrrolo[2,3-b]indole-Based N-Acyliminium Ions Journal of Organic Chemistry, 2004, 69, 3976-3978 |
| 4020967 | CIF | C21 H22 N2 O4 S | P 21 21 21 | 9.248; 20.491; 21.708 90; 90; 90 | 4113.7 | Rosa L. Meza-León; David Crich; Sylvain Bernès; Leticia Quintero Endo-Selective Quenching of Hexahydropyrrolo[2,3-b]indole-Based N-Acyliminium Ions Journal of Organic Chemistry, 2004, 69, 3976-3978 |
| 4020968 | CIF | C21 H22 N2 O4 S | P 21 21 21 | 8.509; 11.593; 20.2321 90; 90; 90 | 1995.8 | Rosa L. Meza-León; David Crich; Sylvain Bernès; Leticia Quintero Endo-Selective Quenching of Hexahydropyrrolo[2,3-b]indole-Based N-Acyliminium Ions Journal of Organic Chemistry, 2004, 69, 3976-3978 |
| 4020973 | CIF | C18 H25 N O10 | P 21 21 21 | 7.667; 11.555; 22.671 90; 90; 90 | 2008.5 | Andrew S. Davis; Stephen G. Pyne; Brian W. Skelton; Allan H. White Synthesis of Putative Uniflorine A Journal of Organic Chemistry, 2004, 69, 3139-3143 |
| 4020974 | CIF | C16 H12 O S | P 21 21 21 | 5.522; 10.7; 21.818 90; 90; 90 | 1289 | Daniele Casarini; Lodovico Lunazzi; Andrea Mazzanti; Pierluigi Mercandelli; Angelo Sironi Conformational Studies by Dynamic NMR. 99.^1^ Experimental and Computed Determination of Rotation Barriers in the Crystalline State: The Case of Naphthylphenylsulfoxide Journal of Organic Chemistry, 2004, 69, 3574-3577 |
| 4020997 | CIF | C15 H18 N O3 | P 21 21 21 | 5.681; 8.355; 28.935 90; 90; 90 | 1373 | Olivier David; Sandrine Calvet; François Chau; Corinne Vanucci-Bacqué; Marie-Claude Fargeau-Bellassoued; Gérard Lhommet Novel Routes to Chiral 2-Alkoxy-5-/6- methoxycarbonylmethylidenepyrrolidines/-piperidines Journal of Organic Chemistry, 2004, 69, 2888-2891 |
| 4021003 | CIF | C30 H32 O4 P2 | P 21 21 21 | 8.105; 8.729; 37.158 90; 90; 90 | 2628.9 | Tanasri Bunlaksananusorn; Paul Knochel t-BuOK-Mediated Hydrophosphination of Functionalized Alkenes: A Novel Synthesis of Chiral P,N- and P,P-Ligands Journal of Organic Chemistry, 2004, 69, 4595-4601 |
| 4021004 | CIF | C20 H28 N2 O6 | P 21 21 21 | 6.5307; 14.195; 22.832 90; 90; 90 | 2116.7 | Mikkel Fog Jakobsen; Liviu Ionita; Troels Skrydstrup Highly Diastereoselective Mannich-Type Reactions of Chiral N-Acylhydrazones Journal of Organic Chemistry, 2004, 69, 4792-4796 |
| 4021020 | CIF | C16 H19 N O5 | P 21 21 21 | 7.5579; 9.8711; 21.1313 90; 90; 90 | 1576.5 | Catherine Gaulon; Robert Dhal; Teddy Chapin; Vincent Maisonneuve; Gilles Dujardin N-Vinyl-2-oxazolidinones: Efficient Chiral Dienophiles for the [4 + 2]-Based de Novo Synthesis of New N-2-Deoxyglycosides Journal of Organic Chemistry, 2004, 69, 4192-4202 |
| 4021038 | CIF | C16 H22 O3 Se | P 21 21 21 | 6.28; 10.367; 24.434 90; 90; 90 | 1590.8 | Dan Yang; Qiang Gao; Bao-Fu Zheng; Nian-Yong Zhu Et~2~AlCl-Promoted Asymmetric Phenylseleno Group Transfer Radical Cyclization Reactions of Unsaturated β-Hydroxy Esters Journal of Organic Chemistry, 2004, 69, 8821-8828 |
| 4021041 | CIF | C17 H16 O7 | P 21 21 21 | 6.1515; 13.5741; 19.044 90; 90; 90 | 1590.2 | Roland Messer; Andrea Schmitz; Luzia Moesch; Robert Häner Elaboration of D-(-)-Ribose into a Tricyclic, Natural Product-like Scaffold Journal of Organic Chemistry, 2004, 69, 8558-8560 |
| 4021042 | CIF | C17 H24 O7 | P 21 21 21 | 4.8763; 12.906; 27.491 90; 90; 90 | 1730.1 | Roland Messer; Andrea Schmitz; Luzia Moesch; Robert Häner Elaboration of D-(-)-Ribose into a Tricyclic, Natural Product-like Scaffold Journal of Organic Chemistry, 2004, 69, 8558-8560 |
| 4021049 | CIF | C36 H64 N6 O11 | P 21 21 21 | 13.964; 14.014; 21.067 90; 90; 90 | 4122.6 | Danielle Skropeta; Katrina A. Jolliffe; Peter Turner Pseudoprolines as Removable Turn Inducers: Tools for the Cyclization of Small Peptides Journal of Organic Chemistry, 2004, 69, 8804-8809 |
| 4021058 | CIF | C18 H23 N O7 | P 21 21 21 | 5.5474; 16.996; 18.256 90; 90; 90 | 1721.2 | Pushpal Bhaket; Christina S. Stauffer; Apurba Datta Complex Peptidyl Nucleoside Antibiotics: Efficient Syntheses of the Glycosyl Nucleoside Amino Acid Cores Journal of Organic Chemistry, 2004, 69, 8594-8601 |
| 4021072 | CIF | C27 H30 N2 O4 | P 21 21 21 | 8.931; 9.599; 28.08 90; 90; 90 | 2407.3 | Amat, Mercedes; Pérez, Maria; Llor, Núria; Escolano, Carmen; Luque, F. Javier; Molins, Elies; Bosch, Joan Conjugate Additions to Phenylglycinol-Derived Unsaturated δ-Lactams. Enantioselective Synthesis of Uleine Alkaloids The Journal of Organic Chemistry, 2004, 69, 8681-8693 |
| 4021079 | CIF | C37 H41 N O4 Si | P 21 21 21 | 9.9182; 17.1284; 19.558 90; 90; 90 | 3322.6 | Tahar Ayad; Vanessa Faugeroux; Yves Génisson; Chantal André; Michel Baltas; Liliane Gorrichon Stereoselective Access to the Versatile 4-Aminohex-5-ene-1,2,3-triol Pattern Journal of Organic Chemistry, 2004, 69, 8775-8779 |
| 4021081 | CIF | C29 H28 Br2 Ni P2 | P 21 21 21 | 9.0346; 15.629; 19.666 90; 90; 90 | 2776.8 | Gary A. Molander; Jason P. Burke; Patrick J. Carroll Synthesis and Application of Chiral Cyclopropane-Based Ligands in Palladium-Catalyzed Allylic Alkylation Journal of Organic Chemistry, 2004, 69, 8062-8069 |
| 4021100 | CIF | C14 H22 O5 | P 21 21 21 | 5.546; 9.811; 26.178 90; 90; 90 | 1424.2 | Douglass F. Taber; Yongchun Pan; Xia Zhao A Flexible Enantioselective Synthesis of the Isofurans Journal of Organic Chemistry, 2004, 69, 7234-7240 |
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