Crystallography Open Database
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Searching space group like 'I 1 2/a 1'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2006987 | CIF Paper | C12 H6 Cl2 S2 | I 1 2/a 1 | 21.311; 3.908; 27.581 90; 97.49; 90 | 2277.4 | Chang, Ning-Leh; Thomas, Stewart N.; Lynch, Vincent M.; Simonsen, Stanley H. 2,7-Dichlorothianthrene Acta Crystallographica Section C, 1998, 54, 266-267 |
2007086 | CIF Paper | C10 H20 Br4 I2 Pd S4 | I 1 2/a 1 | 14.651; 9.3117; 16.7648 90; 93.468; 90 | 2283 | Blake, Alexander J.; Gilby, Liam M.; Gould, Robert O.; Lippolis, Vito; Parsons, Simon; Schröder, Martin Macrocyclic Thioether Complexes of Palladium with Dibromoiodide Anions Acta Crystallographica Section C, 1998, 54, 295-298 |
2007122 | CIF Paper | C5 H5 N3 O2 | I 1 2/a 1 | 18.331; 3.678; 17.052 90; 98.43; 90 | 1137.2 | Angelova, Olyana; Petrova, Rosica; Atanasov, Vladimir 2-(Nitroamino)pyridine Acta Crystallographica Section C, 1998, 54, 441-442 |
2007641 | CIF Paper | C24 H22 N3 O2 P | I 1 2/a 1 | 16.599; 13.957; 18.105 90; 95.929; 90 | 4172 | Low, John N.; Ferguson, George; Cobo, Justo; Nogueras, Manuel; Sanchez, Adolfo; Marchal, Antonio 2-Methoxy-3-methyl-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one and 3-Methyl-2-methylthio-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one Acta Crystallographica Section C, 1998, 54, 1355-1357 |
2008194 | CIF HKL Paper | C9 H15 Cu Na O12 | I 1 2/a 1 | 13.524; 11.221; 18.41 90; 96.06; 90 | 2778.2 | Chui, Stephen Sin Yin; Siu, Alvin; Williams, Ian D. Sodium copper(II) trimesate, [NaCu{C~6~H~3~(COO)~3~}(H~2~O)~4~].2H~2~O, a double-sheet coordination polymer with bridging aqua ligands Acta Crystallographica Section C, 1999, 55, 194-196 |
2008402 | CIF Paper | C8 H12 | I 1 2/a 1 | 8.916; 6.0717; 12.62 90; 95.027; 90 | 680.6 | Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja Dispiro[2.1.2.1]octane at 103K Acta Crystallographica Section C, 1999, 55, IUC9900023 |
2009006 | CIF Paper | C11 H12 N2 O | I 1 2/a 1 | 12.1685; 13.724; 13.315 90; 114.792; 90 | 2018.7 | Clark, Bernard A. J.; Evans, Matthew C.; Lloyd, Douglas; McNab, Hamish; Parsons, Simon 7-Phenyl-2,3,4,5-tetrahydro-1<i>H</i>-1,4-diazepin-5-one Acta Crystallographica Section C, 1999, 55, 1725-1727 |
2009572 | CIF Paper | C16 H26 N2 O4 | I 1 2/a 1 | 21.438; 8.161; 21.655 90; 109.98; 90 | 3560.6 | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M. Structures of the choline ion in different crystal surroundings Acta Crystallographica Section C, 1994, 50, 617-623 |
2009655 | CIF Paper | C18 H28 Cl4 Cu2 N6 O7 | I 1 2/a 1 | 27.048; 10.298; 20.3 90; 102.62; 90 | 5517.8 | Abboud, K.A.; Palenik, R.C.; Palenik, G.J. Dichloro(2,6-diacetylpyridine dioxime-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) 1.5-hydrate Acta Crystallographica Section C, 1994, 50, 525-528 |
2009860 | CIF Paper | C5 H9 N4 O Pd S4 | I 1 2/a 1 | 23.39; 3.9832; 23.8 90; 90.46; 90 | 2217 | Abboudi, M.; Mosset, A. A palladium‒dithiooxamide complex Acta Crystallographica Section C, 1994, 50, 1057-1059 |
2010213 | CIF | Dy0.028 Er0.018 Gd0.007 H4 O6 P Y0.947 | I 1 2/a 1 | 5.578; 15.006; 6.275 90; 117.83; 90 | 464.5 | Kohlmann, Monika; Sowa, Heidrun; Reithmayer, Klaus; Schulz, Heinz; Krüger, Rolf-Rüdiger; Abriel, Walter Structure of a Y~1-x~(Gd,Dy,Er)~x~PO~4~.2H~2~O Microcrystal Studied Using Synchrotron Radiation Acta Crystallographica Section C, 1994, 50, 1651-1652 |
2012118 | CIF HKL Paper | C5 H6 N2 S | I 1 2/a 1 | 9.7411; 7.5931; 17.444 90; 112.682; 90 | 1190.5 | Smith, Matt C.; Davies, Sian C.; Hughes, David L.; Evans, David J. 1<i>H</i>-Pyrrole-2-carbothioamide Acta Crystallographica Section C, 2001, 57, 987-988 |
2012133 | CIF HKL Paper | C H5 Be N O4 P | I 1 2/a 1 | 9.6165; 9.0032; 9.6231 90; 90.951; 90 | 833.05 | Harrison, William T. A. [H~3~N(CH~2~)~2~NH~3~]~0.5~[BePO~4~], a beryllophosphate analogue of aluminosilicate zeolite gismondine Acta Crystallographica Section C, 2001, 57, 891-892 |
2012195 | CIF HKL Paper | C18 H20 N2 O6 | I 1 2/a 1 | 10.2455; 12.664; 27.446 90; 97.441; 90 | 3531.1 | Zukerman-Schpector, J.; Vega, Mauricio; Caracelli, I.; Dias, Luiz C.; Fernandes, Anna M. A. P. Two intermediates in the synthesis of decahydroisoquinolines with NMDA and AMPA receptor antagonist activity Acta Crystallographica Section C, 2001, 57, 1089-1091 |
2012255 | CIF HKL Paper | C16 H15.5 Cl N4 O6.25 | I 1 2/a 1 | 19.5883; 8.0623; 22.936 90; 90.559; 90 | 3622 | Alfonso, Montserrat; Wang, Yi; Stoeckli-Evans, Helen Hydrogen bonding in the inner-salt zwitterion and in two different charged forms of 5,6-bis(2-pyridyl)pyrazine-2,3-dicarboxylic acid Acta Crystallographica Section C, 2001, 57, 1184-1188 |
2012912 | CIF HKL Paper | C26 H30 O4 | I 1 2/a 1 | 15.368; 6.22; 23.142 90; 90.44; 90 | 2212.1 | Kuźnik, Nikodem; Zawadiak, Jan; Gilner, Danuta; Wiȩckol, Angelika; Wagner, Paweł; Kubicki, Maciej 1,4-Bis[(1-methyl-1-phenylethyl)peroxymethyl]benzene Acta Crystallographica Section C, 2002, 58, o549-o550 |
2013071 | CIF HKL Paper | C18 H22 Cl N5 | I 1 2/a 1 | 24.862; 7.3778; 19.633 90; 101.823; 90 | 3524.8 | Papandreou, Nikolaos C.; Makedonopoulou, Stella; Antoniadou-Vyza, Ekaterini A.; Mavridis, Irene M.; Hamodrakas, Stavros J. 2,4-Diamino-5-(1-naphthyl)-3,5-diaza-1-azoniaspiro[5.5]undeca-1,3-diene chloride Acta Crystallographica Section C, 2002, 58, o730-o732 |
2013384 | CIF Paper | C16 H19 N7 S2 | I 1 2/a 1 | 8.0944; 13.9838; 30.482 90; 92.292; 90 | 3447.5 | Blake, Alexander J.; Hubberstey, Peter; Mackrell, Alexander D.; Wilson, Claire 3,6-Dichloro-4-[2-(4-thiamorpholino)ethanesulfanyl]pyridazine and 3,6-bis(pyrazol-1-yl)-4-[2-(4-thiamorpholino)ethanesulfanyl]pyridazine Acta Crystallographica Section C, 2003, 59, o293-o297 |
2013487 | CIF HKL Paper | C20 H26 O2 | I 1 2/a 1 | 9.415; 10.739; 15.332 90; 92.58; 90 | 1548.6 | Lakshminarasimhan Damodharan; Vasantha Pattabhi; Rallapalli Sivakumar; Sambasivarao Kotha Precursors to dodecahedrane Acta Crystallographica Section C, 2003, 59, o373-o375 |
2013694 | CIF HKL Paper | C8 H8 Br N O2 Te | I 1 2/a 1 | 14.175; 9.582; 15.433 90; 95.7; 90 | 2085.8 | Prabodhika Mallikaratchy; Richard E. Norman; Frank R. Fronczek; Thomas Junk Tribromo(3,5-dimethyl-2-nitrophenyl-κ^2^<i>C</i>^1^,<i>O</i>)tellurium(IV), bromo(3,5-dimethyl-2-nitrophenyl-κ^2^<i>C</i>^1^,<i>O</i>)tellurium(II) and bromo(3,5-dimethyl-2-nitrosophenyl-κ^2^<i>C</i>^1^,<i>O</i>)tellurium(II) Acta Crystallographica Section C, 2003, 59, o571-o574 |
2013926 | CIF HKL Paper | C2 H10 As2 N2 O4 | I 1 2/a 1 | 12.7854; 4.6647; 13.3343 90; 91.738; 90 | 794.89 | Lee, Clare; Harrison, William T. A. The <i>catena</i>-arsenite chain anion, [AsO~2~]~<i>n~</i>^<i>n^{-</i>}: (H~3~NCH~2~CH~2~NH~3~)~0.5~[AsO~2~] and NaAsO~2~ (revisited) Acta Crystallographica Section C, 2004, 60, m215-m218 |
2014024 | CIF HKL Paper | C8 H6 Ba2 O19 Zr | I 1 2/a 1 | 9.201; 29.032; 9.2079 90; 115.45; 90 | 2221 | Vertruyen, Bénédicte; Robertz, Bénédicte; Guillaume, Bernard; Rulmont, André; Spirlet, Marie-Rose Dibarium zirconium tetraoxalate trihydrate Acta Crystallographica Section C, 2004, 60, m233-m234 |
2014464 | CIF HKL Paper | C13 H13 N3 O | I 1 2/a 1 | 13.3571; 10.7473; 15.7604 90; 90.914; 90 | 2262.2 | Grzyb, Justyna A.; Lough, Alan J.; Batey, Robert A. 1<i>H</i>-Imidazol-1-yl 1,2,3,4-tetrahydroisoquinolin-2-yl ketone Acta Crystallographica Section C, 2004, 60, o730-o732 |
2014872 | CIF HKL Paper | C33 H30 F12 N8 P2 Ru S3 | I 1 2/a 1 | 23.685; 14.183; 25.264 90; 108.941; 90 | 8027 | Bruno, Giuseppe; Rotondo, Archimede; Tresoldi, Giuseppe; Nicoló, Francesco; Lanza, Santo Bis(di-2-pyridyl sulfide-κ^2^<i>N</i>,<i>N</i>')(4-methylpyrimidin-2-yl 2-pyridylmethyl sulfide-κ^2^<i>N</i>,<i>S</i>)ruthenium(II) bis(hexafluorophosphate) acetonitrile solvate Acta Crystallographica Section C, 2005, 61, m169-m172 |
2015666 | CIF HKL Paper | C10 H10 Cl4 Mn N2 | I 1 2/a 1 | 6.9781; 12.7118; 14.1568 90; 91.206; 90 | 1255.5 | Li, Ming-Xue; Li, Su-Zhi <i>catena</i>-Poly[4,4'-bipyridinium [[<i>cis</i>-dichloromanganese(II)]-di-μ-chloro]], a novel manganese(II) coordination polymer with 4,4'-bipyridinium Acta Crystallographica Section C, 2006, 62, m525-m526 |
2016260 | CIF HKL Paper | C4 H13 Cl2 N5 O2 | I 1 2/a 1 | 9.4045; 8.6089; 13.742 90; 107.742; 90 | 1059.67 | Gustavo Portalone; Marcello Colapietro Hydrogen-bonded supramolecular motifs in the 1:1 monohydrated molecular adduct of acetoguanaminium chloride with acetoguanamine and in 2,4,6-triaminopyrimidinediium dichloride dihydrate Acta Crystallographica Section C, 2007, 63, o655-o658 |
2016554 | CIF HKL Paper | C12 H20 N6 O4 | I 1 2/a 1 | 9.441; 16.347; 18.799 90; 90.045; 90 | 2901.3 | Orozco, Fabían; Insuasty, Braulio; Low, John N.; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded sheet structures in neutral, anionic and hydrated 6-amino-2-(morpholin-4-yl)-5-nitrosopyrimidines Acta Crystallographica Section C, 2008, 64, o220-o225 |
2016587 | CIF HKL Paper | C32 H33 Cl Cu N7 O4 | I 1 2/a 1 | 21.834; 12.948; 23.502 90; 97.039; 90 | 6594 | Stibrany, Robert T.; Potenza, Joseph A. An alternating copolymer containing trigonal planar homocoordinated copper(I) ions: <i>catena</i>-poly[[[bis[μ-(<i>E</i>)-1,2-bis(1-ethyl-1<i>H</i>-benzimidazol-2-yl)ethene-κ^2^<i>N</i>^3^:<i>N</i>^3'^]dicopper(I)]-μ-(<i>E</i>)-1,2-bis(1-ethyl-1<i>H</i>-benzimidazol-2-yl)ethene-κ^2^<i>N</i>^3^:<i>N</i>^3'^] bis(perchlorate) acetonitrile disolvate] Acta Crystallographica Section C, 2008, 64, m213-m216 |
2016604 | CIF HKL Paper | C20 H18 Cl2 N O1.5 | I 1 2/a 1 | 15.61; 13.2847; 17.2233 90; 91.358; 90 | 3570.7 | Prukała, Wiesław; Prukała, Dorota; Kubicki, Maciej Isomorphism in 1-(2-halidobenzyl)-4-[(<i>E</i>)-2-(3-hydroxyphenyl)ethenyl]pyridinium halide hemihydrates (halide = Cl, Br) Acta Crystallographica Section C, 2008, 64, o269-o271 |
2016605 | CIF HKL Paper | C20 H18 Br2 N O1.5 | I 1 2/a 1 | 15.6975; 13.5505; 17.2562 90; 92.879; 90 | 3665.9 | Prukała, Wiesław; Prukała, Dorota; Kubicki, Maciej Isomorphism in 1-(2-halidobenzyl)-4-[(<i>E</i>)-2-(3-hydroxyphenyl)ethenyl]pyridinium halide hemihydrates (halide = Cl, Br) Acta Crystallographica Section C, 2008, 64, o269-o271 |
2016719 | CIF HKL Paper | C4 H10 Cl2 Cu N2 O4 | I 1 2/a 1 | 15.224; 3.9694; 15.444 90; 94.73; 90 | 930.1 | Sarangarajan, Thanjavur R.; Krishnamoorthy, Belli S.; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher Three-dimensional frameworks built from piperazine-2,5-dione and simple metal salts (<i>M</i> = Co, Ni, Cu and Ag) Acta Crystallographica Section C, 2008, 64, m286-m291 |
2016834 | CIF HKL Paper | C6 H21 Eu O12 S3 | I 1 2/a 1 | 24.323; 5.4408; 27.066 90; 111.328; 90 | 3336.5 | Wallus, Sarah; Frank, Walter The first structural characterization of a rare earth ethanesulfonate Acta Crystallographica Section C, 2008, 64, m384-m386 |
2018212 | CIF HKL Paper | C52 H40 Cl4 Cu4 N4 O12 | I 1 2/a 1 | 20.326; 14.184; 36.696 90; 94.89; 90 | 10541 | Moncol, Jan; Jomova, Klaudia; Zelenicky, Lubomir; Lis, Tadeusz; Valko, Marian A tetranuclear copper(II) cluster: bis(μ-4-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')(4-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')(4-chlorobenzoato-κ<i>O</i>)tetrakis(μ~3~-2-pyridylmethanolato-κ^4^<i>N</i>,<i>O</i>:<i>O</i>:<i>O</i>)tetracopper(II) Acta Crystallographica Section C, 2011, 67, m318-m320 |
2018252 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.999; 6.7318; 21.1835 90; 101.887; 90 | 2651.2 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
2018253 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.77; 6.645; 20.8 90; 101.61; 90 | 2541 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
2018254 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.604; 6.583; 20.295 90; 101.5; 90 | 2436 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
2018255 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.501; 6.542; 20.045 90; 101.41; 90 | 2378.2 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
2018256 | CIF HKL Paper | H N O11 Rb Te4 | I 1 2/a 1 | 18.344; 6.473; 19.62 90; 101.4; 90 | 2284 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
2018603 | CIF HKL Paper | C9 H11 N O6 | I 1 2/a 1 | 17.241; 6.1519; 20.71 90; 107.96; 90 | 2089.6 | Tutughamiarso, Maya; Pisternick, Thorsten; Egert, Ernst Pseudopolymorphs of chelidamic acid and its dimethyl ester Acta Crystallographica Section C, 2012, 68, o344-o350 |
2019171 | CIF Paper | C23 H31 Cl N O3 P Si | I 1 2/a 1 | 17.3791; 14.7131; 20.019 90; 90.464; 90 | 5118.7 | Ouahrouch, Abdelaaziz; Krim, Jamal; Taourirte, Moha; Lazrek, Hassan B.; Engels, Joachim W.; Bats, Jan W. Four related diethyl [(arylamino)(4-ethynylphenyl)methyl]phosphonates Acta Crystallographica Section C, 2013, 69, 1157-1163 |
2019268 | CIF Paper | C6 H9 Cl N2 O2 | I 1 2/a 1 | 13.1489; 6.578; 17.0721 90; 90.42; 90 | 1476.59 | Lopez de Diego, Heidi; Koradia, Vishal; Bond, Andrew D. Enantiotropically related polymorphs of gaboxadol hydrochloride Acta Crystallographica Section C, 2013, 69, 1234-1237 |
2019436 | CIF HKL Paper | C2 N4 O4 S3 | I 1 2/a 1 | 11.182; 8.436; 8.609 90; 91.36; 90 | 811.9 | Jones, Ray Three trithiadiazepines and a trithiatriazepine Acta Crystallographica Section C, 2014, 70, 60-66 |
2019604 | CIF HKL Paper | H12 O14 S2 U | I 1 2/a 1 | 7.519; 13.2464; 11.5073 90; 104.388; 90 | 1110.18 | Burns, Alexander D.; Patrick, Brian O.; Lam, Anita E.; Dreisinger, David The effect of coordinated water on the connectivity of uranium(IV) sulfate <i>x</i>-hydrate: [U(SO~4~)~2~(H~2~O)~5~]·H~2~O and [U(SO~4~)~2~(H~2~O)~6~]·2H~2~O, and a comparison with other known structures Acta Crystallographica Section C, 2014, 70, 726-731 |
2020102 | CIF HKL Paper | C8 H12 Br2 F4 N2 | I 1 2/a 1 | 10.9815; 10.8697; 11.1525 90; 111.135; 90 | 1241.7 | Brisdon, Alan K.; Muneer, Abeer M. T.; Pritchard, Robin G. Halogen-bonded adduct of 1,2-dibromo-1,1,2,2-tetrafluoroethane and 1,4-diazabicyclo[2.2.2]octane Acta Crystallographica Section C, 2015, 71 |
2020392 | CIF HKL Paper | C11 H13 N3 O8 | I 1 2/a 1 | 17.8382; 10.322; 14.5599 90; 101.06; 90 | 2631.1 | Smith, Graham; Lynch, Daniel E. Cyclic heterotetrameric and low-dimensional hydrogen-bonded polymeric structures in the morpholinium salts of ring-substituted benzoic acid analogues Acta Crystallographica Section C, 2016, 72, 105-111 |
2020660 | CIF HKL Paper | C34 H50 Cl6 N2 O5 | I 1 2/a 1 | 14.8441; 13.2872; 21.0311 90; 105.191; 90 | 4003.2 | Cai, Xiao-Qing; Tian, Bei; Zhang, Jian-Nan; Jin, Zhi-Min The hydrogen-bonded complex bis(<i>tert</i>-butylammonium) 2,6-dichlorophenolate 2,4-dichlorophenol‒2,4-dichlorophenolate tetrahydrofuran disolvate containing a chiral <i>R</i>~5~^3^(10) hydrogen-bonded ring as a supramolecular synthon Acta Crystallographica Section C, 2016, 72, 720-723 |
2020856 | CIF HKL | C17 H18 Cl Fe N3 O2 | I 1 2/a 1 | 20.8783; 7.4013; 23.2605 90; 108.146; 90 | 3415.6 | Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1) Acta Crystallographica Section C, 2017, 73 |
2021391 | CIF Paper | C116 H90.67 As2 Cu8 Eu2 K2 N16 O117.5 W22 | I 1 2/a 1 | 30.5449; 14.2507; 48.6187 90; 107.836; 90 | 20145.9 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
2021392 | CIF HKL Paper | C116 H92 As2 Cu8 Gd2 K2 N16 O126 W22 | I 1 2/a 1 | 30.5038; 14.1439; 48.2029 90; 108.131; 90 | 19764.2 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
2021393 | CIF HKL Paper | C116 H92 As2 Cu8 K2 N16 O126 Tb2 W22 | I 1 2/a 1 | 30.4415; 14.0792; 48.0609 90; 108.235; 90 | 19564.1 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
2021394 | CIF HKL Paper | C116 H88 As2 Cu8 Dy2 K2 N16 O128 W22 | I 1 2/a 1 | 30.481; 14.104; 48.1783 90; 108.247; 90 | 19670.6 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
2021395 | CIF HKL Paper | C116 H94 As2 Cu8 Ho2 K2 N16 O128 W22 | I 1 2/a 1 | 30.4802; 14.113; 48.116 90; 108.169; 90 | 19665.9 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
2021396 | CIF HKL Paper | C116 H87 As2 Cu8 Er2 K2 N16 O128 W22 | I 1 2/a 1 | 30.581; 14.1638; 48.299 90; 108.273; 90 | 19865 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
2021516 | CIF HKL Paper | C12 H12 N6 O3 | I 1 2/a 1 | 12.189; 18.7185; 12.4701 90; 106.612; 90 | 2726.4 | Oliveira, Ana P. A.; Ferreira, Isabella P.; Despaigne, Angel A. Recio; da Silva, Jeferson G.; Vieira, Ana Carolina S.; Santos, Mariana S.; Alexandre-Moreira, Magna S.; Diniz, Renata; Beraldo, Heloisa Structural studies and antileishmanial activity of 2-acetylpyridine and 2-benzoylpyridine nitroimidazole-derived hydrazones Acta Crystallographica Section C, 2019, 75 |
2021716 | CIF HKL Paper | C28 H26 Cd Cl2 N12 O15 | I 1 2/a 1 | 15.146; 12.2411; 17.6555 90; 99.104; 90 | 3232.2 | Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions Acta Crystallographica Section C, 2019, 75 |
2021717 | CIF HKL Paper | C28 H24 Cl2 N12 O14 Pb | I 1 2/a 1 | 15.2909; 14.2702; 15.4064 90; 92.174; 90 | 3359.32 | Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions Acta Crystallographica Section C, 2019, 75 |
2021841 | CIF HKL Paper | C9 H8 N4 | I 1 2/a 1 | 11.4608; 5.3791; 26.74 90; 91.457; 90 | 1648 | Moreno-Fuquen, Rodolfo; Arango-Daraviña, Kevin; Garcia, Esteban; Tenorio, Juan-C.; Ellena, Javier Synthesis, spectroscopic (FT‒IR and UV‒Vis), crystallographic and theoretical studies, and amolecular docking simulation of an imatinib-like template Acta Crystallographica Section C, 2019, 75 |
2022236 | CIF HKL Paper | C15 H8 Br I O3 | I 1 2/a 1 | 26.4214; 4.76309; 46.6213 90; 106.034; 90 | 5638.9 | Cong, Nguyen Tien; Trang, Huynh Thi Xuan; Dung, Pham Duc; Phuong, Tran Hoang; Trung, Vu Quoc; Dat, Nguyen Dang; Anh, Dang Thi Tuyet; Tuyen, Nguyen Van; Van Meervelt, Luc Synthesis, structure and <i>in vitro</i> cytotoxicity testing of some 2-aroylbenzofuran-3-ols Acta Crystallographica Section C, 2020, 76 |
2022282 | CIF HKL Paper | C24 H14 F6 O4 | I 1 2/a 1 | 23.308; 7.132; 27.253 90; 112.62; 90 | 4182 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022571 | CIF HKL Paper | C21 H16 Br N6 O3 | I 1 2/a 1 | 15.5664; 15.3769; 18.4445 90; 109.359; 90 | 4165.3 | Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C, 2021, 77, 698-706 |
2022772 | CIF HKL Paper | C65 H60 N12 O10 | I 1 2/a 1 | 16.82625; 16.73298; 26.7833 90; 105.216; 90 | 7276.56 | Palacios Rodríguez, José Carlos; Mendoza, Angel; Sosa Rivadeneyra, Martha; Bernès, Sylvain 2-[3-(1<i>H</i>-Benzimidazol-2-yl)prop-yl]-1<i>H</i>-benzimidazol-3-ium 3,4,5-tri-hydroxy-benzoate-1,3-bis-(1<i>H</i>-benzimidazol-2-yl)propane-ethyl acetate (2/1/2.94): co-crystallization between a salt, a neutral mol-ecule and a solvent. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 562-566 |
2022833 | CIF HKL Paper | C16 H35 Br N2 O4 | I 1 2/a 1 | 12.6692; 7.0967; 22.3413 90; 103.022; 90 | 1957.04 | Carlson, Faith M.; Staples, Richard J.; Biros, Shannon M. Crystal structure of a (carboxymethyl)triethylazanium bromide–2-(triethylazaniumyl)acetate (1/1) hydrogen-bonded dimer Acta Crystallographica Section E Crystallographic Communications, 2023, 79 |
2022939 | CIF HKL Paper | C15 H16 N2 O3 | I 1 2/a 1 | 13.742; 8.8912; 23.114 90; 94.742; 90 | 2814.5 | Safarova, Ayten S.; Khalilov, Ali N.; Akkurt, Mehmet; Brito, Ivan; Bhattarai, Ajaya; Naghiyev, Farid N.; Mamedov, Ibrahim G. Crystal structure and Hirshfeld surface analysis of (2Z)-3-oxo-N-phenyl-2-[(1H-pyrrol-2-yl)methylidene]butanamide monohydrate Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1142-1146 |
2022951 | CIF HKL Paper | C15 H15 F3 N2 O3 S | I 1 2/a 1 | 21.9709; 5.1271; 27.022 90; 93.633; 90 | 3037.8 | Richter, Adrian; Goddard, Richard; Imming, Peter; Seidel, Rüdiger W. Crystal structure and antimycobacterial evaluation of 2-(cyclohexylmethyl)-7-nitro-5-(trifluoromethyl)benzo[d]isothiazol-3(2H)-one Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1194-1198 |
2023018 | CIF HKL Paper | C23 H19 N O16 Pr2 | I 1 2/a 1 | 27.4898; 5.9436; 32.0473 90; 93.854; 90 | 5224.32 | Yotnoi, Bunlawee; Rujiwatra, Apinpus Crystal structure and characterization of a new lanthanide coordination polymer, [Pr<sub>2</sub>(pydc)(phth)<sub>2</sub>(H<sub>2</sub>O)<sub>3</sub>]·H<sub>2</sub>O. Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 228-231 |
2100457 | CIF Paper | C2 H6 O4 S | I 1 2/a 1 | 8.9007; 5.8099; 10.2451 90; 101.69; 90 | 518.81 | Acta Crystallographica, Section B, 2006, 62, 280-286 |
2100510 | CIF Paper | C2 Ba F6 O6 S2 | I 1 2/a 1 | 21.7505; 4.90797; 9.6949 90; 100.379; 90 | 1018.01 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
2100599 | CIF Paper | C12 D17 K3 N12 O16 | I 1 2/a 1 | 12.824; 16.332; 23.713 90; 97.514; 90 | 4923.8 | G. S. Nichol; W. Clegg; M. J. Gutmann; D. M. Tooke Stoichiometry-dependent structures: an X-ray and neutron single-crystal diffraction study of the effect of reaction stoichiometry on the crystalline products formed in the potassium‒cyanurate system Acta Crystallographica Section B, 2006, 62, 798-807 |
2101051 | CIF Paper | C12 H8 Cl2 O2 S | I 1 2/a 1 | 20.2; 4.91; 12.054 90; 90.02; 90 | 1195.5 | Zúñiga, F. J.; Pérez-Mato, J. M.; Breczewski, T. Structure of the incommensurate phase of 4,4'-dichlorobiphenyl sulfone at 90 K Acta Crystallographica Section B, 1993, 49, 1060-1068 |
2101114 | CIF Paper | C14 H19 Br N4 O2 | I 1 2/a 1 | 16.359; 10.469; 18.339 90; 90.9; 90 | 3140 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
2102509 | CIF Paper | C10 H12 Cu N2 O6 S | I 1 2/a 1 | 6.963; 12.4686; 14.854 90; 101.01; 90 | 1265.9 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
2102512 | CIF Paper | C20 H30 O2 | I 1 2/a 1 | 27.869; 5.771; 11.758 90; 91.43; 90 | 1890.5 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
2102513 | CIF Paper | C23 H34 Cl2 Cu N4 O | I 1 2/a 1 | 18.63; 16.61; 16.972 90; 108.02; 90 | 4994.3 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
2102520 | CIF Paper | C10 H24 F6 N4 O2 P Re | I 1 2/a 1 | 17.257; 5.533; 18.053 90; 98.14; 90 | 1706.4 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
2102523 | CIF Paper | C19 H22 Cl2 Cu N6 O5 S4 | I 1 2/a 1 | 30.123; 7.564; 11.044 90; 91.27; 90 | 2516 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
2103796 | CIF Paper | C26 H43 F3 O3 P2 Pd | I 1 2/a 1 | 20.244; 10.714; 27.238 90; 102.76; 90 | 5762 | Clemente, Dore Augusto; Marzotto, Armando 22 Space-group changes Acta Crystallographica Section B, 2003, 59, 43-50 |
2103797 | CIF Paper | C47 H63 N O6 Si | I 1 2/a 1 | 33.99; 9.5179; 29.467 90; 114.65; 90 | 8664 | Clemente, Dore Augusto; Marzotto, Armando 22 Space-group changes Acta Crystallographica Section B, 2003, 59, 43-50 |
2103865 | CIF Paper | C10 Mn2 O10 | I 1 2/a 1 | 14.1257; 6.8799; 14.3121 90; 105.078; 90 | 1343.01 | Farrugia, Louis J.; Mallinson, Paul R.; Stewart, Brian Experimental charge density in the transition metal complex Mn~2~(CO)~10~: a comparative study Acta Crystallographica Section B, 2003, 59, 234-247 |
2103866 | CIF HKL Paper | C10 Mn2 O10 | I 1 2/a 1 | 14.1257; 6.8799; 14.3121 90; 105.078; 90 | 1343.01 | Farrugia, Louis J.; Mallinson, Paul R.; Stewart, Brian Experimental charge density in the transition metal complex Mn~2~(CO)~10~: a comparative study Acta Crystallographica Section B, 2003, 59, 234-247 |
2105557 | CIF Paper | N O P | I 1 2/a 1 | 8.5194; 4.7448; 10.397 90; 90.013; 90 | 420.276 | Haines, J.; Chateau, C.; Léger, J. M.; Le Sauze, A.; Diot, N.; Marchand, R.; Hull, S. Crystal structure of moganite-type phosphorus oxynitride: relationship to other twinned-quartz-based structures Acta Crystallographica Section B, 1999, 55, 677-682 |
2105578 | CIF Paper | C16 H10 O5 | I 1 2/a 1 | 15.31; 6.111; 28.3 90; 101.61; 90 | 2594 | Valente, E. J.; Martin, S. B.; Sullivan, L. D. Pseudoacids. II. 2-Acylbenzoic Acid Derivatives Acta Crystallographica Section B, 1998, 54, 264-276 |
2106073 | CIF | Bi0.868 O2 Sr | I 1 2/a 1 | 4.905; 5.112; 29.857 90; 93.45; 90 | 747.288 | Leligny, H.; Grebille, D.; Perez, O.; Masset, A.C.; Hervieu, M.; Raveau, B. A five-dimensional structural investigation of the misfit layer compound (Bi0.87 Sr O2)2 (Co O2)1.82 Acta Crystallographica B (39,1983-), 2000, 56, 173-182 |
2106621 | CIF HKL Paper | C8 H10 N2 O5 | I 1 2/a 1 | 13.3114; 6.0032; 24.1094 90; 101.854; 90 | 1885.5 | Direm, Amani; Altomare, Angela; Moliterni, Anna; Benali-Cherif, Nourredine Intermolecular interactions of proton transfer compounds: synthesis, crystal structure and Hirshfeld surface analysis Acta Crystallographica Section B, 2015, 71 |
2107268 | CIF HKL | C10 H10 I4 N2 Pb | I 1 2/a 1 | 7.7839; 14.1821; 15.3644 90; 90.434; 90 | 1696.06 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
2107336 | CIF | Co4.36 Li1.4 Mg28.25 O112 Sc3.81 Si36.49 | I 1 2/a 1 | 9.432; 8.756; 48.792 90; 92.25; 90 | 4026.46 | Takeuchi, Y.; Ito, J.; Kudoh, Y. New Series of Superstructures Based on Clinopyroxene. I. The Structure of the 'Enstatite-IV' Series, (Mg(x-12)/3 Sc4) (Li4/3 Si(x-4)/3) Ox, with x = 100, 112 or 124 Acta Crystallographica B (39,1983-), 1984, 40, 115-125 |
2108055 | CIF HKL Paper | C14 H14 N2 O4 | I 1 2/a 1 | 20.333; 5.1356; 24.966 90; 90.909; 90 | 2606.7 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108056 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.332; 5.1318; 25.024 90; 90.917; 90 | 2610.7 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108057 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.296; 5.1263; 25.005 90; 90.95; 90 | 2601.2 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108058 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.088; 5.2242; 25.033 90; 92.308; 90 | 2624.9 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108059 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.084; 5.2206; 25.04 90; 92.375; 90 | 2623.2 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108060 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.126; 5.2212; 25.134 90; 92.401; 90 | 2638.8 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108061 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.161; 5.218; 25.234 90; 92.559; 90 | 2652 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108062 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.246; 5.2132; 25.372 90; 92.557; 90 | 2675.3 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
2108402 | CIF HKL | C24 H22 Cl2 N2 O2 | I 1 2/a 1 | 18.1075; 14.16642; 18.5436 90; 117.163; 90 | 4232.16 | So, Hee-Soo; Matsumoto, Shinya Three differently coloured polymorphs of 3,6-bis(4-chlorophenyl)-2,5-dipropyl-2,5-dihydropyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 2019, 75 |
2108423 | CIF HKL | C20 H16 Co N6 S2 | I 1 2/a 1 | 17.5108; 13.8088; 18.915 90; 114.745; 90 | 4153.7 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
2108514 | CIF HKL | C18 H12 N6 | I 1 2/a 1 | 21.3047; 3.7345; 35.1825 90; 93.364; 90 | 2794.4 | Yuan, Liangqian; Xing, Mengyao; Pan, Fangfang Polymorphs of 2,4,6-tris(4-pyridyl)-1,3,5-triazine and their mechanical properties Acta Crystallographica Section B, 2019, 75 |
2108553 | CIF HKL Paper | B Cs H2 O8 P2 | I 1 2/a 1 | 13.4002; 7.4869; 14.5329 90; 90.059; 90 | 1458.03 | Shvanskaya, Larisa; Yakubovich, Olga; Krikunova, Polina; Ovchenkov, Evgeny; Vasiliev, Alexander Chain caesium borophosphates with B:P ratio 1:2: synthesis, structure relationships and low-temperature thermodynamic properties Acta Crystallographica Section B, 2019, 75 |
2109073 | CIF HKL Paper | C3 H7 N3 O5 | I 1 2/a 1 | 8.6385; 6.6817; 11.6069 90; 107.466; 90 | 639.061 | Bojarowski, Sławomir Antonii; Gruza, Barbara; Trzybiński, Damian; Kamiński, Radosław; Hoser, Anna Agnieszka; Kumar, Prashant; Woźniak, Krzysztof; Dominiak, Paulina Maria New refinement strategies for a pseudoatom databank – toward rapid electrostatic interaction energy estimations Acta Crystallographica Section B, 2022, 78 |
2200613 | CIF HKL Paper | C5 H15 Cl2 N2 O0.5 Pd | I 1 2/a 1 | 16.435; 7.562; 16.527 90; 90.28; 90 | 2054 | Farrugia, Louis J.; Cross, Ronald J.; Barley, Helen R. L. <i>cis</i>-(2-Amino-1,1-dimethylethylamine)dichloropalladium(II) ethanol hemisolvate Acta Crystallographica Section E, 2001, 57, m494-m495 |
2200646 | CIF Paper | C17 H18 Cl2 N8 O4 | I 1 2/a 1 | 19.929; 4.3417; 22.788 90; 91.4; 90 | 1971.2 | Maulik, Prakas R.; Avasthi, Kamlakar; Sarkhel, Sanjay; Sharon, Ashoke; Rawat, Diwan S.; Bal, Chandralata 1,3-Bis(8-chlorotheophyllin-7-yl)propane: a molecule with no intramolecular stacking Acta Crystallographica Section E, 2001, 57, o1163-o1165 |
2200844 | CIF HKL Paper | C7 H9 N | I 1 2/a 1 | 9.7236; 6.2851; 10.517 90; 95.691; 90 | 639.57 | Bond, Andrew D.; Davies, John E. 3,5-Lutidine Acta Crystallographica Section E, 2002, 58, o5-o7 |
2200856 | CIF HKL Paper | C12 H28 Cl4 N4 O4 Zn2 | I 1 2/a 1 | 16.4925; 7.2697; 19.2129 90; 109.412; 90 | 2172.59 | Kuksa, Vladimir A.; Wardell, Solange M. S. V; Lin, Paul Kong Thoo; Howie, R. Alan Rerefinement of (μ-1,7,11,17-tetraoxa-2,6,12,16-tetraazacycloeicosane-κ^4^<i>N</i>^1^,<i>N</i>^17^:<i>N</i>^7^,<i>N</i>^11^)bis[dichlorozinc(II)] Acta Crystallographica Section E, 2002, 58, m68-m69 |
2200975 | CIF HKL Paper | C14.5 H7 N2 O10 Ru3 | I 1 2/a 1 | 14.2248; 9.167; 59.834 90; 90.38; 90 | 7802.1 | Lozano Diz, Enrique; Neels, Antonia; Therrien, Bruno; Stoeckli-Evans, Helen; Süss-Fink, Georg A cluster containing a pyrazole ligand: [Ru~3~(μ-H)(μ-N~2~C~3~H~3~)(CO)~10~] Acta Crystallographica Section E, 2002, 58, m110-m112 |
2201150 | CIF HKL Paper | C16 H8 F4 I2 N2 | I 1 2/a 1 | 14.2535; 33.714; 14.3511 90; 100.831; 90 | 6773.5 | Rosalba Liantonio; Pierangelo Metrangolo; Tullio Pilati; Giuseppe Resnati 4,4'-Bipyridine 1,2-diiodo-3,4,5,6-tetrafluorobenzene Acta Crystallographica Section E, 2002, 58, o575-o577 |
2201234 | CIF HKL Paper | C33 H31 F3 N4 O3 S | I 1 2/a 1 | 14.383; 14.217; 15.252 90; 92.85; 90 | 3114.9 | Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza κ^2^<i>N</i>^13^,<i>N</i>^13'^-Hydro-<i>rac</i>-2,2'-bis[2-(1-propylbenzimidazol-2yl)]biphenyl trifluoromethanesulfonate, the salt of a novel proton sponge Acta Crystallographica Section E, 2002, 58, o1142-o1144 |
2201719 | CIF | Cl4 Pb | I 1 2/a 1 | 10.542; 5.359; 11.958 90; 115.83; 90 | 608 | Iain J. Maley; Simon Parsons; Colin R. Pulham Lead(IV) chloride at 150 K Acta Crystallographica, Section E, 2002, 58, i79-i81 |
2201773 | CIF HKL Paper | B3 O6 Tb | I 1 2/a 1 | 6.2147; 8.0225; 7.8111 90; 93.44; 90 | 388.74 | Goriounova, Alexandra; Held, Peter; Becker, Petra; Bohatý, Ladislav Monoclinic modification of polymorphic TbB~3~O~6~ Acta Crystallographica Section E, 2003, 59, i83-i85 |
2204580 | CIF Paper | B3 Eu O6 | I 1 2/a 1 | 6.283; 8.0331; 7.8406 90; 93.7; 90 | 394.91 | Goriounova, Alexandra; Held, Peter; Becker, Petra; Bohatý, Ladislav Europium triborate, EuB~3~O~6~ Acta Crystallographica, Section E, 2004, 60, i131-i133 |
2204581 | CIF Paper | B3 Ce O6 | I 1 2/a 1 | 6.4468; 8.1266; 7.93 90; 93.639; 90 | 414.62 | Goriounova, Alexandra; Held, Peter; Becker, Petra; Bohatý, Ladislav Cerium triborate, CeB~3~O~6~ Acta Crystallographica, Section E, 2004, 60, i134-i135 |
2205398 | CIF HKL Paper | C20 H13 Mn N3 O7 | I 1 2/a 1 | 18.515; 9.927; 20.948 90; 94.659; 90 | 3837.5 | Zhu, Long-Guan; Xiao, Hong-Ping Poly[[[(1,10-phenanthroline)manganese(II)]-μ~3~-2-nitrobenzene-1,4-dicarboxylato] monohydrate] Acta Crystallographica Section E, 2005, 61, m769-m771 |
2205625 | CIF HKL Paper | C5 H11 N O2 S | I 1 2/a 1 | 9.877; 4.6915; 32.603 90; 106.25; 90 | 1450.4 | M. Alagar; R. V. Krishnakumar; A. Mostad; S. Natarajan β-<small>DL</small>-Methionine at 105 K Acta Crystallographica Section E, 2005, 61, o1165-o1167 |
2206234 | CIF HKL Paper | C3 H16 As2 N2 O8 | I 1 2/a 1 | 15.5563; 4.6549; 15.0454 90; 103.399; 90 | 1059.83 | Wilkinson, Hazel S.; Harrison, William T. A. Propane-1,3-diaminium bis(dihydrogenarsenate) Acta Crystallographica Section E, 2005, 61, m1289-m1291 |
2207982 | CIF HKL Paper | C6 H24 Cd N8 O6 | I 1 2/a 1 | 15.2574; 11.0441; 19.155 90; 90.246; 90 | 3227.7 | Timothy J. Prior Tris(ethylenediamine-κ^2^<i>N,N</i>')cadmium(II) dinitrate Acta Crystallographica Section E, 2006, 62, m352-m354 |
2208129 | CIF HKL Paper | C5 H5 Cd Cl2 N O | I 1 2/a 1 | 7.51; 15.531; 6.6809 90; 98.057; 90 | 771.6 | Englert, Ulli; Schiffers, Stefanie <i>catena</i>-Poly[cadmium(II)-di-μ-chloro-μ-4-1<i>H</i>-pyridone-κ<i>O</i>:κ<i>O</i>] Acta Crystallographica Section E, 2006, 62, m194-m195 |
2210613 | CIF HKL Paper | C18 H18 N O5 P | I 1 2/a 1 | 19.178; 9.8913; 19.1983 90; 114.513; 90 | 3313.6 | Małecka, Magdalena; Budzisz, Elżbieta 3-[α-(2-Hydroxyethylamino)benzylidene]-2-methoxy-2,3-dihydro-1,2λ^5^-benzoxaphosphinine-2,4-dione Acta Crystallographica Section E, 2006, 62, o4560-o4562 |
2212531 | CIF HKL Paper | C29 H31 N O3 S | I 1 2/a 1 | 12.7293; 10.4916; 39.6468 90; 96.99; 90 | 5255.5 | J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan (2<i>RS</i>,5<i>RS</i>,6<i>RS</i>)-Ethyl 4-hydroxy-2,6-di-<i>p</i>-tolyl-5-<i>p</i>-tolylsulfanyl-1,2,5,6-tetrahydropyridine-3-carboxylate Acta Crystallographica Section E, 2007, 63, o1375-o1376 |
2212534 | CIF HKL Paper | C22 H38.5 N4 O6.25 | I 1 2/a 1 | 20.4798; 10.5692; 23.072 90; 92.79; 90 | 4988 | A. Elangovan; A. Thamaraichelvan; A. Ramu; S. Athimoolam; S. Natarajan <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylbutane-1,4-diammonium bis(<i>p</i>-aminobenzoate) 2.25-hydrate Acta Crystallographica Section E, 2007, 63, o1418-o1420 |
2214085 | CIF HKL Paper | C26 H22 O4 | I 1 2/a 1 | 13.0715; 5.8535; 26.377 90; 90.339; 90 | 2018.2 | Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash (2<i>E</i>,2'<i>E</i>)-3,3'-(1,4-Phenylene)bis[1-(4-methoxyphenyl)prop-2-en-1-one] Acta Crystallographica Section E, 2007, 63, o3067-o3067 |
2214795 | CIF HKL Paper | C15 H12 N2 O | I 1 2/a 1 | 23.64; 5.084; 19.2139 90; 93.974; 90 | 2303.7 | A. Thiruvalluvar; A. Thomas Gunaseelan; A. Ebenezer Martin; K. J. Rajendra Prasad; R. J. Butcher 3,9-Dimethyl-10<i>H</i>-isoxazolo[5,4-<i>a</i>]carbazole Acta Crystallographica Section E, 2007, 63, o3631-o3631 |
2215534 | CIF HKL Paper | C16 H42 Cl4 N4 O Ti2 | I 1 2/a 1 | 13.204; 10.131; 20.795 90; 99.973; 90 | 2739.7 | Straessler, Nicholas A.; Caudle, M. Tyler; Groy, Thomas L. μ-Oxido-bis[dichlorido(diethylamido-κ<i>N</i>)(diethylamine-κ<i>N</i>)titanium(IV)] Acta Crystallographica Section E, 2007, 63, m2563-m2563 |
2216839 | CIF HKL Paper | C15 H14 O2 S | I 1 2/a 1 | 21.94; 5.0674; 23.314 90; 96.598; 90 | 2574.9 | Sarojini, B. K.; Yathirajan, H. S.; Narayana, B.; Swamy, M. T.; Kubicki, Maciej (2<i>E</i>)-3-(4-Methoxyphenyl)-1-(3-methyl-2-thienyl)prop-2-en-1-one Acta Crystallographica Section E, 2007, 63, o4688-o4688 |
2219734 | CIF HKL Paper | C16 H15 Cl O4 | I 1 2/a 1 | 19.255; 4.6454; 31.109 90; 90.519; 90 | 2782.5 | Botting, Nigel P.; Slawin, Alexandra M. Z.; Zhang, Qingzhi 1-(5-Chloro-2,4-dihydroxyphenyl)-2-(4-ethoxyphenyl)ethanone Acta Crystallographica Section E, 2008, 64, o2030 |
2219979 | CIF HKL Paper | C22 H17 Cl N2 O2 | I 1 2/a 1 | 20.2021; 8.05; 24.0238 90; 105.29; 90 | 3768.6 | Benzerka, Saida; Bouraiou, Abdelmalek; Bouacida, Sofiane; Debache, Abdelmadjid; Belfaitah, Ali Ethyl 4-(2-chloroquinolin-3-yl)-1-phenyl-1<i>H</i>-pyrrole-3-carboxylate Acta Crystallographica Section E, 2008, 64, o2115-o2116 |
2220325 | CIF HKL Paper | C24 H32.68 N4 Ni O11.34 | I 1 2/a 1 | 20.7108; 17.4754; 15.646 90; 97.767; 90 | 5610.8 | Pavlová, Anna; Černák, Juraj; Harms, Klaus Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(maleato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)nickel(II) 7.34-hydrate Acta Crystallographica Section E, 2008, 64, m1536-m1537 |
2222568 | CIF Paper | Ge O5 Y2 | I 1 2/a 1 | 10.4706; 6.8292; 12.8795 90; 101.75; 90 | 901.66 | Rivera-Muñoz, Eric M.; Bucio, Lauro Rietveld refinement of Y~2~GeO~5~ Acta Crystallographica Section E, 2009, 65, i60 |
2223827 | CIF HKL Paper | C13.5 H15 F N4 O3.5 | I 1 2/a 1 | 14.3088; 10.79; 18.1286 90; 107.676; 90 | 2666.77 | Penthala, Narsimha Reddy; Reddy, Thirupathi Reddy Yerram; Parkin, Sean; Crooks, Peter A. 3-(2-Amino-1-methyl-4-oxo-4,5-dihydro-1<i>H</i>-imidazol-5-yl)-5-fluoro-3-hydroxy-1-methylindolin-2-one methanol hemisolvate Acta Crystallographica Section E, 2009, 65, o2909-o2910 |
2226134 | CIF HKL Paper | C43 H40 Au2 N4 O6 P2 S2 | I 1 2/a 1 | 24.4; 16.1419; 24.594 90; 110.252; 90 | 9087.8 | Ho, Soo Yei; Tiekink, Edward R. T. [μ-1,2-Bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']bis{[(<i>Z</i>)-<i>O</i>-ethyl <i>N</i>-(4-nitrophenyl)thiocarbamato-κ<i>S</i>]gold(I)} Acta Crystallographica Section E, 2010, 66, m622-m623 |
2227414 | CIF HKL Paper | C12 H8 Cl4 N2 | I 1 2/a 1 | 17.2346; 3.8767; 18.1573 90; 94.872; 90 | 1208.77 | Ugono, Onome; Douglas Jr, Marcel; Rath, Nigam P.; Beatty, Alicia M. 2,2',5,5'-Tetrachlorobenzidine Acta Crystallographica Section E, 2010, 66, o2285 |
2227863 | CIF HKL Paper | C14 H10 Cl4 O4 S | I 1 2/a 1 | 21.19; 5.8543; 26.6803 90; 98.304; 90 | 3275.06 | Li, Xueshu; Parkin, Sean; Duffel, Michael W.; Robertson, Larry W.; Lehmler, Hans-Joachim 4'-Chlorobiphenyl-3-yl 2,2,2-trichloroethyl sulfate Acta Crystallographica Section E, 2010, 66, o2306 |
2228785 | CIF HKL Paper | C20 H32 N6 O9 | I 1 2/a 1 | 11.288; 15.965; 14.449 90; 101.296; 90 | 2553.5 | Gao, Zhu-Qing; Gu, Jin-Zhong Piperazine-1,4-diium bis(hydrogen 2-propyl-1<i>H</i>-imidazole-4,5-dicarboxylate) monohydrate Acta Crystallographica Section E, 2011, 67, o31 |
2229769 | CIF HKL Paper | C11 H10 Br2 N4 | I 1 2/a 1 | 11.9075; 4.0523; 25.8065 90; 98.326; 90 | 1232.11 | Nichol, Gary S.; Sharma, Anuj; Li, Hong-Yu <i>N</i>,<i>N</i>'-Bis(5-bromopyridin-2-yl)methanediamine Acta Crystallographica Section E, 2011, 67, o833 |
2230649 | CIF HKL Paper | C7 H3 N2 O6 Rb | I 1 2/a 1 | 7.2789; 18.072; 7.3652 90; 91.7; 90 | 968.4 | Miao, Yanqing; Zhang, Xiaoqing; Liu, Chunye Poly[(μ~5~-3,5-dinitrobenzoato)rubidium] Acta Crystallographica Section E, 2011, 67, m1002 |
2235246 | CIF Paper | C32 H38 Co N12 O6 | I 1 2/a 1 | 17.7; 10.965; 18.37 90; 90.431; 90 | 3565 | Xiao, Chao-Hu; Song, Xue-Yan; Sun, Zan; Cao, Ping; Pang, Ting Bis{2-[bis(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl-κ<i>N</i>^2^)methyl]pyridine-κ<i>N</i>}cobalt(II) dinitrate Acta Crystallographica Section E, 2012, 68, m857 |
2238629 | CIF Paper | C10 H14 Cr N3 O11 | I 1 2/a 1 | 7.6456; 21.4096; 9.7404 90; 100.278; 90 | 1568.8 | Bebga, Gouet; Signé, Martin; Nenwa, Justin; Mbarki, Mohammed; Fokwa, Boniface P. T. Pyridinium <i>trans</i>-diaquabis[oxalato(2{-})-κ^2^<i>O</i>^1^,<i>O</i>^2^]chromate(III) urea monosolvate Acta Crystallographica Section E, 2013, 69, m567 |
2239296 | CIF HKL | C10 H16 Co O4 | I 1 2/a 1 | 9.276; 4.764; 50.154 90; 95.02; 90 | 2207.8 | Giuseppe, Bruno; Francesco, Nicolò; Giovanni, Grassi; Alessandro, Saccà; Mollica Nardo, Viviana Poly[(μ4-decanedioato)cobalt(II)] Acta Crystallographica Section E Structure Reports Online, 2014, 70, m159 |
2239700 | CIF HKL Paper | C24 H34 K O6 Sb | I 1 2/a 1 | 15.6933; 9.2655; 19.1321 90; 112.654; 90 | 2567.3 | Kaas, Marina; Friedrich, Ute; Korber, Nikolaus (18-Crown-6)potassium(I) diphenylstibate({-}1) Acta Crystallographica Section E, 2014, 70, m260 |
2239874 | CIF HKL | C18 H16 Cl6 N4 | I 1 2/a 1 | 16.4498; 6.0691; 21.605 90; 93.885; 90 | 2152 | Schmitt, Laurette; Stoeckli-Evans, Helen Crystal structure of 2,5-bis(4-methylpyridin-2-yl)pyrazine chloroform disolvate Acta Crystallographica Section E, 2014, 70, o893-o894 |
2239963 | CIF HKL | C41.5 H36 Cl N3 P2 Ru | I 1 2/a 1 | 20.1817; 12.4559; 28.6781 90; 94.213; 90 | 7189.7 | Hernández-Calva, Adriana; Meléndez-Balbuena, Lidia; Arroyo, Maribel; Ramírez-Monroy, Armando Crystal structure of azido(η^5^-cyclopentadienyl)bis(triphenylphosphane-κ<i>P</i>)ruthenium(II) dichloromethane hemisolvate Acta Crystallographica Section E, 2014, 70, m345-m346 |
2240074 | CIF HKL Paper | C5 H11 N O2 S | I 1 2/a 1 | 9.877; 4.6915; 32.603 90; 106.25; 90 | 1450.4 | Görbitz, Carl Henrik Redetermined structure of β-<small>DL</small>-methionine at 105K: an example of the importance of freely refining the positions of the amino-group H atoms Acta Crystallographica Section E, 2014, 70, 341-343 |
2240930 | CIF HKL Paper | C11 H16 Fe N2 O10.5 | I 1 2/a 1 | 14.796; 10.4422; 21.7751 90; 108.352; 90 | 3193.2 | Djomo, Edith Dimitri; Capet, Frédéric; Nenwa, Justin; Bélombé, Michel M.; Foulon, Michel Crystal structure of 4-(dimethylamino)pyridinium <i>cis</i>-diaquabis(oxalato-κ^2^<i>O</i>,<i>O</i>')ferrate(III) hemihydrate Acta Crystallographica Section E, 2015, 71, 934-936 |
2240947 | CIF HKL | C17 H23 Cl N4 O2 | I 1 2/a 1 | 20.5012; 7.4565; 23.1414 90; 90.639; 90 | 3537.34 | Al-Alshaikh, Monirah A.; El-Emam, Ali A.; Al-Deeb, Omar A.; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago Crystal structures of 4-phenylpiperazin-1-ium 6-chloro-5-ethyl-2,4-dioxopyrimidin-1-ide and 4-phenylpiperazin-1-ium 6-chloro-5-isopropyl-2,4-dioxopyrimidin-1-ide Acta Crystallographica Section E, 2015, 71, 956-959 |
2240959 | CIF HKL | C15 H13 Br O3 S | I 1 2/a 1 | 13.4748; 8.3853; 25.0214 90; 93.957; 90 | 2820.4 | Naik, Vasant S.; Shettigar, Venkataraya; Berglin, Tyler S.; Coburn, Jillian S.; Jasinski, Jerry P.; Yathirajan, Hemmige S. Crystal structures of (2<i>E</i>)-1-(3-bromothiophen-2-yl)-3-(2-methoxyphenyl)prop-2-en-1-one and (2<i>E</i>)-1-(3-bromothiophen-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one Acta Crystallographica Section E, 2015, 71, 966-972 |
2241665 | CIF HKL Paper | C13 H12.5 Br6 Cl1.5 O2 Re2 S8 | I 1 2/a 1 | 27.1825; 8.53737; 26.0667 90; 100.844; 90 | 5941.2 | Golichenko, Alexander A.; Kravchenko, Andrey V.; Omelchenko, Irina V.; Chudak, Denis M.; Starodub, Vladimir A.; Barszcz, Boleslaw; Shtemenko, Alexander V. Crystal structure of bis(ethylenedithio)tetrathiafulvalenium μ~2~-acetato-bis[tribromidorhenate(III)] 1,1,2-trichloroethane hemisolvate Acta Crystallographica Section E, 2016, 72, 712-715 |
2241793 | CIF HKL Paper | C2 H9 Br N2 | I 1 2/a 1 | 13.2423; 5.1239; 16.1839 90; 94.838; 90 | 1094.2 | Katinaitė, Judita; Harrison, William T. A. Different cation-protonation patterns in molecular salts of unsymmetrical dimethyhydrazine: C~2~H~9~N~2~·Br and C~2~H~9~N~2~·H~2~PO~3~ Acta Crystallographica Section E, 2016, 72, 1206-1210 |
2241803 | CIF HKL Paper | C48 H42 N14 O5 | I 1 2/a 1 | 18.1861; 7.1187; 35.707 90; 100.448; 90 | 4546.03 | Setifi, Fatima; Valkonen, Arto; Setifi, Zouaoui; Nummelin, Sami; Touzani, Rachid; Glidewell, Christopher Crystal structure of [tris(4,4'-bipyridine)]diium bis(1,1,3,3-tetracyano-2-ethoxypropenide) trihydrate Acta Crystallographica Section E, 2016, 72, 1246-1250 |
2242066 | CIF HKL Paper | C14 H33 N3 O16 Tb | I 1 2/a 1 | 20.1864; 10.2997; 23.832 90; 108.004; 90 | 4712.4 | Gregório, Thaiane; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L. Crystal structures of two mononuclear complexes of terbium(III) nitrate with the tripodal alcohol 1,1,1-tris(hydroxymethyl)propane Acta Crystallographica Section E, 2017, 73, 278-285 |
2242347 | CIF HKL Paper | C9 H11 N O2 S2 | I 1 2/a 1 | 15.826; 8.0772; 18.431 90; 111.83; 90 | 2187.1 | Boukhedena, Wafia; Fiala, Abdelali; Brahim Ladouani, Hayet; Lemallem, Salah Eddine; Hamdouni, Noudjoud; Boudjada, Ali Crystal structure of ethyl 2-cyano-2-(1,3-dithian-2-ylidene)acetate Acta Crystallographica Section E, 2018, 74, 65-68 |
2242392 | CIF HKL Paper | C24 H42 Cu N10 O7 | I 1 2/a 1 | 20.107; 7.8939; 20.472 90; 102.651; 90 | 3170.5 | Vincent, Collin J.; Giles, Ian D.; Deschamps, Jeffrey R. Two Cu^II^ complexes of 3,4,5-trimethyl-1<i>H</i>-pyrazole Acta Crystallographica Section E, 2018, 74, 357-362 |
2242734 | CIF HKL | C12 H13 N O2 S | I 1 2/a 1 | 9.6424; 11.4059; 21.6672 90; 94.711; 90 | 2374.91 | Frampton, Christopher S.; Frampton, Eleanor S.; Thomson, Paul A. Two polymorphic forms of the oxathiin systemic fungicide active carboxine Acta Crystallographica Section E, 2018, 74, 1741-1745 |
2243162 | CIF HKL Paper | C24 H24 N2 O6 | I 1 2/a 1 | 16.9368; 15.413; 18.4562 90; 109.254; 90 | 4548.4 | Filali Baba, Yassir; Hayani, Sonia; Hökelek, Tuncer; Kaur, Manpreet; Jasinski, Jerry; Sebbar, Nada Kheira; Kandri Rodi, Youssef Crystal structure, Hirshfeld surface analysis and DFT studies of ethyl 2-{4-[(2-ethoxy-2-oxoethyl)(phenyl)carbamoyl]-2-oxo-1,2-dihydroquinolin-1-yl}acetate Acta Crystallographica Section E, 2019, 75, 1753-1758 |
2243289 | CIF HKL Paper | C36 H40 Cd I2 N6 | I 1 2/a 1 | 12.837; 20.1241; 15.2568 90; 110.871; 90 | 3682.7 | Tesouro Vallina, Ana; Stoeckli-Evans, Helen The crystal structures and Hirshfeld surface analyses of a cadmium(II) and a zinc(II) mononuclear complex of the new tetrakis-substituted pyrazine ligand <i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''-[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(<i>N</i>-methylaniline) Acta Crystallographica Section E, 2020, 76, 410-416 |
2243592 | CIF HKL Paper | C22 H45 Br2 Cu3 N6 O7.5 | I 1 2/a 1 | 14.493; 8.8855; 26.6017 90; 103.998; 90 | 3324 | Vynohradov, Oleksandr S.; Pavlenko, Vadim A.; Naumova, Dina D.; Partsevska, Sofiia V.; Shova, Sergiu; Safarmamadov, Safarmamad M. Crystal structure of bis{μ-2-[bis(2-hydroxyethyl)amino]ethanolato}bis(μ-3,5-dimethylpyrazolato)tricopper(II) dibromide sesquihydrate Acta Crystallographica Section E, 2020, 76, 1641-1644 |
2243906 | CIF Paper | C12 H7 F2 N3 O2 | I 1 2/a 1 | 6.7062; 14.119; 11.2074 90; 97.14; 90 | 1052.94 | Xu, Xiaowen; Hoogenboom, Richard; Van Hecke, Kristof Crystal structures of three <i>N</i>-(pyridine-2-carbonyl)pyridine-2-carboxamides as potential ligands for supramolecular chemistry Acta Crystallographica Section E, 2021, 77 |
2244065 | CIF HKL Paper | C18 H19 Cl2 N3 O3 | I 1 2/a 1 | 19.6562; 7.5587; 26.4903 90; 109.762; 90 | 3704 | Daoui, Said; Çınar, Emine Berrin; Dege, Necmi; Benchat, Noureddine; Saif, Eiad; Karrouchi, Khalid Crystal structure of (<i>E</i>)-3-({6-[2-(4-chlorophenyl)ethenyl]-3-oxo-2,3-dihydropyridazin-4-yl}methyl)pyridin-1-ium chloride dihydrate Acta Crystallographica Section E, 2022, 78, 458-462 |
2244149 | CIF HKL Paper | C24 H19 N O | I 1 2/a 1 | 18.6588; 5.4739; 35.5689 90; 100.729; 90 | 3569.37 | Cheng, Dong; Meng, Xiang-Zhen; Tian, Fuyu; Yan, Dong; Wang, Xiaofei; Qian, Xueli; Wang, Junnan Crystal structure and Hirshfeld surface analysis of 4-(3-methoxyphenyl)-2,6-diphenylpyridine Acta Crystallographica Section E, 2022, 78 |
2300211 | CIF Paper | Lu2 O5 Si | I 1 2/a 1 | 10.255; 6.6465; 12.3626 90; 102.422; 90 | 822.91 | Cong, Hengjiang; Zhang, Huaijin; Wang, Jiyang; Yu, Wentao; Fan, Jiandong; Cheng, Xiufeng; Sun, Shangqian; Zhang, Jian; Lu, Qingming; Jiang, Chunjian; Boughton, Robert I. Structural and thermal properties of the monoclinic Lu~2~SiO~5~ single crystal: evaluation as a new laser matrix Journal of Applied Crystallography, 2009, 42, 284-294 |
2310526 | CIF | Ca H5 O6 P | I 1 2/a 1 | 5.812; 15.18; 6.239 90; 116.43; 90 | 492.91 | Beevers, C.A. The crystal structure of dicalcium phosphate dihydrate, Ca H P O4 (H2 O)2 Acta Crystallographica (1,1948-23,1967), 1958, 11, 273-277 |
2311277 | CIF | C21 H35 Cl N O2 P2 Re | I 1 2/a 1 | 18.6854; 10.7708; 25.599 90; 107.48; 90 | 4914.1 | Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Non-order-disorder allotwinning of the rhenium pincer complex cis-Re[(PNP<sup>CH<sub>2</sub></sup>-iPr)(CO)<sub>2</sub>Cl]. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 941-949 |
2311285 | CIF Paper | C21 H16 N2 O2 | I 1 2/a 1 | 20.6017; 6.1461; 25.9689 90; 94.332; 90 | 3278.8 | Mohamed, Shaaban K.; Horton, Peter N.; Akkurt, Mehmet; Younes, Sabry H. H.; Albayati, Mustafa R. Crystal structure of 3-amino-1-(4-meth-oxy-phen-yl)-1H-benzo[f]chromene-2-carbo-nitrile. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o468-9 |
2311865 | CIF Paper | C12 H20 As2 N2 O9 Sr | I 1 2/a 1 | 9.8935; 7.5844; 23.6669 90; 97.866; 90 | 1759.17 | Smith, Graham; Wermuth, Urs D. The coordination complex structures and hydrogen bonding in the three-dimensional alkaline earth metal salts (Mg, Ca, Sr and Ba) of (4-aminophenyl)arsonic acid. Acta crystallographica. Section C, Structural chemistry, 2017, 73, 61-67 |
2311866 | CIF Paper | C12 H20 As2 Ba N2 O9 | I 1 2/a 1 | 9.9997; 7.7305; 23.979 90; 98.214; 90 | 1834.6 | Smith, Graham; Wermuth, Urs D. The coordination complex structures and hydrogen bonding in the three-dimensional alkaline earth metal salts (Mg, Ca, Sr and Ba) of (4-aminophenyl)arsonic acid. Acta crystallographica. Section C, Structural chemistry, 2017, 73, 61-67 |
2311879 | CIF Paper | C28 H26 N8 Ni O2 | I 1 2/a 1 | 26.778; 7.4858; 12.472 90; 92.91; 90 | 2496.8 | Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole. Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392 |
2312404 | CIF Paper | Cd2 H O5 P | I 1 2/a 1 | 12.4307; 6.691; 10.7087 90; 107.506; 90 | 849.43 | 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 |
2312433 | CIF HKL Paper | C20 H13 K O4 | I 1 2/a 1 | 6.0126; 6.9783; 34.941 90; 93.359; 90 | 1463.53 | Osipov, Artyom A.; Nayfert, Sergey A.; Sobalev, Sergey A.; Rajakumar, Kanthapazham; Zherebtsov, Dmitry A.; Spiridonova, Dar'ya V.; Vinnik, Denis A. Effect of a halogen bond on the crystal structure of terphenyldicarboxylic acid derivatives. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
2312518 | CIF Paper | C41 H54 Cu2 O20 | I 1 2/a 1 | 19.4801; 13.0774; 34.5443 90; 97.702; 90 | 8720.7 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
3000421 | On hold until 2023-04-02 | C9 H8 Li N O3 | I 1 2/a 1 | 11.6482; 5.0003; 30.317 90; 96.865; 90 | 1753.1 | Nikodem KUŹNIK; Kusz, Joachim; Książek, Maria To be published |
3500071 | CIF HKL | C7 H3 N3 | I 1 2/a 1 | 7.4485; 6.1845; 13.4791 90; 95.757; 90 | 617.79 | Thierry Maris Personal communication to COD, 2017 |
4000112 | CIF | C39 H46 Cl2 Cu N6 O2 | I 1 2/a 1 | 17.1905; 16.242; 26.8593 90; 91.593; 90 | 7496.4 | Chemistry of Materials, 2002 |
4002267 | CIF | Al Ge H2 K O5 | I 1 2/a 1 | 10.311; 9.749; 10.225 90; 90; 90 | 1027.84 | Tripathi, A.; Parise, J.B.; Kim, S.-J.; Johnson, G.M.; Lee, Y.-J.; Uh, Y.S. Structural changes and cation site ordering in Na and K forms of aluminogermanates with the zeolite gismondine topology Chemistry of Materials (1,1989-), 2000, 12, 3760-3769 |
4002269 | CIF | Al Ge H2 K0.5 Na0.5 O5 | I 1 2/a 1 | 10.323; 9.754; 10.238 90; 90.01; 90 | 1030.87 | Tripathi, A.; Parise, J.B.; Kim, S.-J.; Uh, Y.S.; Johnson, G.M.; Lee, Y.-J. Structural changes and cation site ordering in Na and K forms of aluminogermanates with the zeolite gismondine topology Chemistry of Materials (1,1989-), 2000, 12, 3760-3769 |
4002395 | CIF | La5.84 Mg4 O24 Ta2 W2 | I 1 2/a 1 | 7.8711; 31.9057; 7.8762 90; 90.08; 90 | 1977.97 | Khalyavin, D.D.; Lopes, A.B.; Mantas, P.Q.; Senos, A.M.R. Crystal structure of La6 Mg4 Ta2 W2 O24 oxide: A representative of a novel A(3n) B'(2n) B''(2n) O(12n) homologous series with n = 2 Chemistry of Materials (1,1989-), 2007, 18, 3843-3849 |
4020294 | CIF | C22 H22 Cl2 N2 O2 | I 1 2/a 1 | 17.2719; 7.3616; 17.7619 90; 115.421; 90 | 2039.74 | William W. Porter, III; Thomas P. Vaid Journal of Organic Chemistry, 2005, 70, 5028-5035 |
4021279 | CIF | C13 H12 Br2 O3 | I 1 2/a 1 | 9.788; 11.371; 24.734 90; 95.939; 90 | 2738.1 | Khan, Faiz Ahmed; Satapathy, Rashmirekha; Dash, Jyotirmayee; Savitha, G. A Rapid and Stereoselective Route to thetrans-Hydrindane Ring System Journal of Organic Chemistry, 2004, 69, 5295-5301 |
4021994 | CIF | C18 H17 F | I 1 2/a 1 | 24.7067; 7.5782; 28.9751 90; 101.974; 90 | 5307 | Yi Wang; Jianjun Xu; Donald J. Burton A Simple, Two-Step, Site-Specific Preparation of Fluorinated Naphthalene and Phenanthrene Derivatives from Fluorobromo-Substituted Alkenes Journal of Organic Chemistry, 2006, 71, 7780-7784 |
4022222 | CIF | C36 H25 F7 O2 | I 1 2/a 1 | 15.57; 15.58; 24.91 90; 91.65; 90 | 6045 | Anastasia Detsi; Maria Koufaki; Theodora Calogeropoulou Synthesis of (Z)-4-Hydroxytamoxifen and (Z)-2-[4-[1-(p-Hydroxyphenyl)-2-phenyl]-1butenyl]phenoxyacetic Acid Journal of Organic Chemistry, 2002, 67, 4608-4611 |
4022400 | CIF | C24.5 H31 N2 O4.5 | I 1 2/a 1 | 11.3788; 14.1391; 28.7671 90; 93.657; 90 | 4618.8 | Françisco M. Raymo; Silvia Giordani; Andrew J. P. White; David J. Williams Digital Processing with a Three-State Molecular Switch Journal of Organic Chemistry, 2003, 68, 4158-4169 |
4022433 | CIF | C19 H26 O5 | I 1 2/a 1 | 17.11; 7.807; 27.288 90; 104.952; 90 | 3522 | Benoit Guay; Pierre Deslongchamps Cascade Polycyclization: Exploration of a Convergent Route to Access Various Tricyclic and Tetracyclic Products Related to Sterols Journal of Organic Chemistry, 2003, 68, 6140-6148 |
4023008 | CIF | C22 H32 N8 O2 | I 1 2/a 1 | 25.546; 9.3143; 21.518 90; 106.528; 90 | 4908.6 | Joe B. Gilroy; Steve D. J. McKinnon; Pierre Kennepohl; Mark S. Zsombor; Michael J. Ferguson; Laurence K. Thompson; Robin G. Hicks Probing Electronic Communication in Stable Benzene-Bridged Verdazyl Diradicals Journal of Organic Chemistry, 2007, 72, 8062-8069 |
4023591 | CIF | C20 H36 N12 O4.5 Ti | I 1 2/a 1 | 14.0304; 14.6037; 25.6883 90; 92.926; 90 | 5256.6 | Tal Hermon; Edit Y. Tshuva Synthesis and Conformational Analysis of Constrained Ethylene-Bridged Bis(hydroxylamino-1,3,5-triazine) Compounds as Tetradentate Ligands; Structure of Rigid Dinuclear Ti(IV) Complex Journal of Organic Chemistry, 2008, 73, 5953-5958 |
4023711 | CIF | C10 H14 B N O2 Si | I 1 2/a 1 | 23.951; 8.5113; 23.986 90; 91.92; 90 | 4887 | Sergiusz Luliński; Katarzyna Zajac Selective Generation of Lithiated Benzonitriles: the Importance of Reaction Conditions Journal of Organic Chemistry, 2008, 73, 7785-7788 |
4024260 | CIF | C24 H10 F8 Ge | I 1 2/a 1 | 22.677; 8.009; 22.944 90; 101.146; 90 | 4089 | Katharine Geramita; Jennifer McBee; T. Don Tilley 2,7-Substituted Hexafluoroheterofluorenes as Potential Building Blocks for Electron Transporting Materials Journal of Organic Chemistry, 2009, 74, 820-829 |
4024722 | CIF | C26.5 H30 Cl3 N2 O10 Os | I 1 2/a 1 | 13.0556; 17.6768; 29.0774 90; 94.934; 90 | 6685.7 | Yunhui Lang; Fabio E. S. Souza; Xinshe Xu; Nicholas J. Taylor; Abdeljalil Assoud; Russell Rodrigo Pentacyclic Furanosteroids: The Synthesis of Potential Kinase Inhibitors Related to Viridin and Wortmannolone Journal of Organic Chemistry, 2009, 74, 5429-5439 |
4025579 | CIF | C12 H14 N2 O2 | I 1 2/a 1 | 16.015; 5.4583; 25.143 90; 99.848; 90 | 2165.5 | Anthony W. Hill; Mark R. J. Elsegood; Marc C. Kimber An Intermolecular Hydroamination of Allenamides with Arylamines Catalyzed by Cationic Au(I) Salts Journal of Organic Chemistry, 2010, 75, 5406-5409 |
4026332 | CIF | C65.5 H78 Cl1.5 O6 | I 1 2/a 1 | 19.1205; 33.057; 19.4205 90; 106.776; 90 | 11752.6 | Lev Kuno; Silvio E. Biali Calix[4]arenes with Two Different Chemical Modifications at the Bridges Journal of Organic Chemistry, 2011, 76, 3664-3675 |
4027817 | CIF | Ag2 As4 Cl6 Hg6 | I 1 2/a 1 | 14.69; 9.1851; 20.285 90; 93.17; 90 | 2732.85 | Olenev, A.V.; Shevelkov, A.V.; Dikarev, E.V.; Oleneva, O.S. From Discrete to Extended Guests: Novel Supramolecular Assembly [Hg6As4](AgCl3)2 Featuring (AgCl32- Helical Anions. European Journal of Inorganic Chemistry, 2004, 2004, 4006-4010 |
4029384 | CIF | C34 H38 N2 O | I 1 2/a 1 | 45.341; 6.3267; 19.1637 90; 94.165; 90 | 5482.8 | Hong, Fong-Jiao; Low, Yun-Yee; Chong, Kam-Weng; Thomas, Noel F.; Kam, Toh-Seok Biomimetic oxidative dimerization of anodically generated stilbene radical cations: effect of aromatic substitution on product distribution and reaction pathways. The Journal of organic chemistry, 2014, 79, 4528-4543 |
4030345 | CIF | H148 Mo36 Na8 O186 | I 1 2/a 1 | 32.971; 19.662; 25.288 90; 95.73; 90 | 16312 | Krebs, B.; Stiller, S.; Tytko, K. H.; Mehmke, J. Structure and bonding in the high molecular weight isopolymolybdate ion, [Mo36O112(H2O)16]8-. The crystal structure of Na8[Mo36O112(H2O)16].58H2O European Journal of Solid State and Inorganic Chemistry, 1991, 28, 883-903 |
4030968 | CIF | C22 H19 N O4 | I 1 2/a 1 | 22.0146; 6.9363; 24.0365 90; 95.483; 90 | 3653.6 | Yin, Haijing; Zhang, Buchang; Yu, Haizhu; Zhu, Lin; Feng, Yan; Zhu, Manzhou; Guo, Qingxiang; Meng, Xiangming Two-photon fluorescent probes for biological mg(2+) detection based on 7-substituted coumarin. The Journal of organic chemistry, 2015, 80, 4306-4312 |
4031011 | CIF | C34 H28 Br4 Cu S8 | I 1 2/a 1 | 13.9096; 14.1046; 21.077 90; 107.985; 90 | 3933 | Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties. Beilstein journal of organic chemistry, 2015, 11, 850-859 |
4031502 | CIF | B10 H8 N4 | I 1 2/a 1 | 11.411; 6.658; 13.058 90; 90; 90 | 992.074 | Whelan, T.; Brint, P.; Spalding, T.R.; Lloyd, D.R.; McDonald, W.S. Bonding in clusters. Part 5. The electronic, molecular, and crystal structure of 1,10- B10 H8 (N2)2. A combined theoretical, photoelectron and X-ray crystallographic study Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1982, 1982, 2469-2473 |
4031609 | CIF | D I | I 1 2/a 1 | 8.8435; 11.8832; 8.8303 90; 85.435; 90 | 925.024 | Cockcroft, J.K.; Simon, A.; Borrmann, H.; Obermeyer, A. The crystal structures of the low-temperature modifications of deuterium iodide - a neutron study European Journal of Solid State Inorganic Chemistry, 1988, 25, 471-481 |
4032174 | CIF | C16 H10 N2 O2 | I 1 2/a 1 | 17.3587; 5.2827; 26.4239 90; 93.815; 90 | 2417.7 | Liu, Xing-Xing; Luo, Xin-Liang; Wu, Zhao-Yang; Cui, Xin-Feng; Zhou, Xiao-Qiang; He, Yong-Qin; Huang, Guo-Sheng Oxidative Recyclization of 1H-Indoles for Synthesis of 2-Indolylbenzoxazinones via Cleavage of the C2-C3 Bond with AIBN under Air. The Journal of organic chemistry, 2017, 82, 2107-2113 |
4032389 | CIF | C34 H32 N4 O4 | I 1 2/a 1 | 19.1282; 12.24; 25.3264 90; 97.9603; 90 | 5872.5 | Naidu, Gonna Somu; Singh, Rekha; Kumar, Mukesh; Ghosh, Sunil K. Tuning the Stability and the Reactivity of Substituted [3]Dendralenes for Quick Access to Diverse Copiously Functionalized Fused Polycycles with Step and Atom Economy. The Journal of organic chemistry, 2017, 82, 3648-3658 |
4032647 | CIF | C21 H15 N3 O | I 1 2/a 1 | 13.8956; 15.1725; 18.2472 90; 102.099; 90 | 3761.6 | Cheng, Bin; Zu, Bing; Bao, Bian; Li, Yun; Wang, Renqi; Zhai, Hongbin Synthesis of Spiro[indazole-3,3'-indolin]-2'-ones via [3 + 2] Dipolar Cycloaddition of Arynes with 3-Diazoindolin-2-ones and Indazolo[2,3-c]quinazolin-6(5H)-ones by Subsequent Thermal Isomerization. The Journal of organic chemistry, 2017, 82, 8228-8233 |
4032719 | CIF | C13 H14 N O4 | I 1 2/a 1 | 7.9578; 14.6936; 24.4705 90; 97.184; 90 | 2838.84 | Yu, Yunliang; Kuai, Changsheng; Chauvin, Remi; Tian, Nian; Ma, Shuangshuang; Cui, Xiuling Rh-Catalyzed Regioselective ortho-C-H Carbenoid Insertion of Diarylazines. The Journal of organic chemistry, 2017, 82, 8611-8616 |
4032772 | CIF | C53 H33 B Cl6 F2 N2 | I 1 2/a 1 | 28.2486; 9.3345; 35.1839 90; 103.793; 90 | 9010 | Zhao, Ning; Xuan, Sunting; Zhou, Zehua; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M Graça H Synthesis and Spectroscopic and Cellular Properties of Near-IR [a]Phenanthrene-Fused 4,4-Difluoro-4-bora-3a,4a-diaza-s-indacenes. The Journal of organic chemistry, 2017, 82, 9744-9750 |
4033718 | CIF | C16 H17 Fe N O | I 1 2/a 1 | 10.9629; 21.9497; 11.2186 90; 109.088; 90 | 2551.1 | Li, Hongjie; Jia, Peijing; Qian, Naixin; Li, Shasha; Jiao, Peng Simultaneous Construction of Planar and Central Chiralities as Well as Unprecedented Axial Chirality on and around a Ferrocene Backbone. The Journal of organic chemistry, 2019, 84, 2817-2828 |
4033798 | CIF | C48 H38 N4 O2 | I 1 2/a 1 | 24.08; 8.0155; 20.6822 90; 117.408; 90 | 3543.8 | Guy, Laure; Mosser, Maëlle; Pitrat, Delphine; Mulatier, Jean-Christophe; Kukułka, Mercedes; Srebro-Hooper, Monika; Jeanneau, Erwann; Bensalah-Ledoux, Amina; Baguenard, Bruno; Guy, Stéphan Modulation of Chiroptical Properties in a Series of Helicene-like Compounds. The Journal of organic chemistry, 2019, 84, 10870-10876 |
4034468 | CIF | C17 H20 N2 O4 | I 1 2/a 1 | 10.566; 17.6181; 17.1644 90; 99.086; 90 | 3155.11 | Mondal, Mukulesh; Panda, Manashi; McKee, Vickie; Kerrigan, Nessan J. Asymmetric Synthesis of Tetrahydrofurans through Palladium(0)-Catalyzed [3 + 2]-Cycloaddition of Vinylcyclopropanes with Ketenes. The Journal of organic chemistry, 2019, 84, 11983-11991 |
4034755 | CIF | C34 H40 O13 | I 1 2/a 1 | 24.0009; 8.5212; 31.56 90; 93.151; 90 | 6444.8 | Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Triptycene 1,2-Quinones and Quinols: Permeable Crystalline Redox-Active Molecular Solids. The Journal of organic chemistry, 2018, 83, 15426-15437 |
4034817 | CIF | C19 H20 N3 O8.5 S | I 1 2/a 1 | 26.451; 7.526; 20.2835 90; 99.598; 90 | 3981.3 | Usmanova, Liliia; Dar'in, Dmitry; Novikov, Mikhail S.; Gureev, Maxim; Krasavin, Mikhail Bicyclic Piperazine Mimetics of the Peptide β-Turn Assembled via the Castagnoli-Cushman Reaction. The Journal of organic chemistry, 2018, 83, 5859-5868 |
4035002 | CIF | C20 H15 N O3 S | I 1 2/a 1 | 10.2333; 11.2199; 29.166 90; 99.33; 90 | 3304.44 | Witalewska, Marzena; Wrona-Piotrowicz, Anna; Makal, Anna; Zakrzewski, Janusz Polycyclic Aromatic N-Ethoxycarbonyl Thioamide S-Oxides and Their Triflic Acid Promoted Cyclization to Fluorescent Thiophene Imine-Fused Arenes. The Journal of organic chemistry, 2018, 83, 1933-1939 |
4035214 | CIF | C16 H22 Se2 Si2 | I 1 2/a 1 | 22.138; 6.7644; 27.623 90; 99.718; 90 | 4077.2 | Xu, Wan; Wang, Mengjie; Ma, Zhiying; Shan, Zhen; Li, Chunli; Wang, Hua Selenophene-Based Heteroacenes: Synthesis, Structures, and Physicochemical Behaviors. The Journal of organic chemistry, 2018, 83, 12154-12163 |
4035417 | CIF | C40 H27 N3 | I 1 2/a 1 | 40.424; 6.9876; 44.765 90; 110.991; 90 | 11805 | Panda, Kamakshya Nath; Thorat, Kishor G.; Ravikanth, Mangalampalli Synthesis of meso-Tetraaryl Triphyrins(2.1.1). The Journal of organic chemistry, 2018, 83, 12945-12950 |
4035536 | CIF | C30 H19 N | I 1 2/a 1 | 15.0047; 12.1799; 21.4763 90; 95.513; 90 | 3906.76 | Ogawa, Naoki; Yamaoka, Yousuke; Takikawa, Hiroshi; Tsubaki, Kazunori; Takasu, Kiyosei Synthesis and Properties of Tribenzocarbazoles via an Acid-Promoted Retro (2+2)-Cycloaddition of Azapropellanes. The Journal of organic chemistry, 2018, 83, 7994-8002 |
4035617 | CIF | C23 H19 N O2 S | I 1 2/a 1 | 18.8922; 6.28593; 32.1626 90; 96.756; 90 | 3792.9 | Qi, Zhenjie; Jiang, Yong; Wang, Yanyan; Yan, Rulong tert-Butyl Nitrite Promoted Oxidative Intermolecular Sulfonamination of Alkynes to Synthesize Substituted Sulfonyl Pyrroles from the Alkynylamines and Sulfinic Acids. The Journal of organic chemistry, 2018, 83, 8636-8644 |
4035966 | CIF | C27 H27 N3 O6 S | I 1 2/a 1 | 18.795; 6.7049; 43.048 90; 101.359; 90 | 5318.6 | Srinivasulu, Vunnam; Shehadeh, Ihsan; Khanfar, Monther A.; Malik, Omar G.; Tarazi, Hamadeh; Abu-Yousef, Imad A; Sebastian, Anusha; Baniowda, Nabil; O'Connor, Matthew John; Al-Tel, Taleb H One-Pot Synthesis of Diverse Collections of Benzoxazepine and Indolopyrazine Fused to Heterocyclic Systems. The Journal of organic chemistry, 2019, 84, 934-948 |
4036809 | CIF | C32 H34 Fe2 P2 S6 | I 1 2/a 1 | 23.798; 7.4405; 37.885 90; 90.297; 90 | 6708.2 | Hua, Guoxiong; Du, Junyi; Cordes, David B.; Slawin, Alexandra M. Z.; Woollins, J. Derek One-Pot Three-Component Condensation Synthesis and Structural Features of Organophosphorus-Sulfur Macrocycles. The Journal of organic chemistry, 2016, 81, 4210-4225 |
4037481 | CIF | C22 H22 O4 | I 1 2/a 1 | 24.5382; 5.9207; 25.8385 90; 104.266; 90 | 3638.1 | Liu, Yongjun; Tian, Guang; Li, Jingjing; Qi, Yan; Wen, Yonghong; Du, Feng Reductive Bis-addition of Aromatic Aldehydes to α,β-Unsaturated Esters via the Use of Sm/Cu(I) in Air: A Route to the Construction of Furofuran Lignans. The Journal of organic chemistry, 2017, 82, 5932-5939 |
4037796 | CIF | C19 H17 N3 O4 | I 1 2/a 1 | 16.7548; 7.45702; 27.245 90; 104.133; 90 | 3300.98 | Leas, Derek Andrew; Dong, Yuxiang; Garrison, Jered C.; Wang, Xiaofang; Ezell, Edward L.; Stack, Douglas Edward; Vennerstrom, Jonathan L. Tricyclic Imidazolidin-4-ones by Witkop Oxidation of Tetrahydro-β-carbolines. The Journal of organic chemistry, 2020 |
4037988 | CIF | C21 H19 N O3 | I 1 2/a 1 | 22.887; 5.21437; 29.1121 90; 98.91; 90 | 3432.35 | Arupula, Sanjeeva K.; Qureshi, Asif Ali; Swamy, K. C. Kumara Lewis Base Switched [3+3] and [4+2] Annulation Reaction of δ-Acetoxy Allenoates with Cyclic N-Sulfonyl Imines: Divergent Synthesis of Functionalized α-Pyridyl Acetates and Teraryl Scaffolds. The Journal of organic chemistry, 2020 |
4038377 | CIF | C27 H21.13 F9 N6 O9 P S3 | I 1 2/a 1 | 30.88; 7.96591; 29.4064 90; 110.09; 90 | 6793.45 | Schoemaker, Robin; Schwedtmann, Kai; Hennersdorf, Felix; Bauzá, Antonio; Frontera, Antonio; Weigand, Jan J. Toward N,P-Doped π-Extended PAHs: A One-Pot Synthesis to Diannulated 1,4,2-Diazaphospholium Triflate Salts. The Journal of organic chemistry, 2020 |
4038395 | CIF | C32 H28 N3 Ni O2 P | I 1 2/a 1 | 18.6894; 12.8738; 25.594 90; 105.831; 90 | 5924.4 | Balamurugan, Gunasekaran; Ramesh, Rengan; Malecki, Jan Grzegorz Nickel(II) - NɅNɅO Pincer Type Complexes Catalyzed N-alkylation of Amines with Alcohols via Hydrogen Auto Transfer Reaction. The Journal of organic chemistry, 2020 |
4038396 | CIF | C33 H32 N3 Ni O2 P | I 1 2/a 1 | 18.6292; 12.8456; 25.5273 90; 106.687; 90 | 5851.5 | Balamurugan, Gunasekaran; Ramesh, Rengan; Malecki, Jan Grzegorz Nickel(II) - NɅNɅO Pincer Type Complexes Catalyzed N-alkylation of Amines with Alcohols via Hydrogen Auto Transfer Reaction. The Journal of organic chemistry, 2020 |
4038521 | CIF | C17 H16 O6 | I 1 2/a 1 | 13.718; 8.7102; 25.568 90; 95.537; 90 | 3040.8 | Wang, Yu-Jiao; Wang, Tong-Tong; Yao, Lan; Wang, Qian-Long; Zhao, Li-Ming Access to 4-Alkenylated Coumarins via Ruthenium-Catalyzed Olefinic C-H Alkenylation of Coumarins with Modifiable and Removable Directing Groups. The Journal of organic chemistry, 2020 |
4038557 | CIF | C14 H16 Cl F3 N O4 P | I 1 2/a 1 | 11.7704; 15.69; 18.6268 90; 105.599; 90 | 3313.25 | Mitrofanov, Alexander; Bychkova, Valentina A.; Nefedov, Sergey E.; Beletskaya, Irina P. Selective Metal-Controlled Synthesis of Trifluoromethylated (Indolin-2-ylidene)methyl- and Quinolin-3-ylphosphonates. The Journal of organic chemistry, 2020 |
4038934 | CIF | C44 H34 N2 O4 S3 | I 1 2/a 1 | 13.751; 12.365; 20.967 90; 104.142; 90 | 3457 | Hempe, Matthias; Harrison, Alastair K.; Ward, Jonathan S.; Batsanov, Andrei S.; Fox, Mark A.; Dias, Fernando B.; Bryce, Martin R. Cyclophane Molecules Exhibiting Thermally Activated Delayed Fluorescence: Linking Donor Units to Influence Molecular Conformation The Journal of Organic Chemistry, 2020 |
4060686 | CIF | C30 H78 Cl Li N3 O3 Si6 Yb | I 1 2/a 1 | 25.0333; 16.3725; 27.4177 90; 90.829; 90 | 11236.2 | Toshiyuki Oshiki Preparation, Structural Characterization, and Reactions of Tantalum-Alkyne Complexes Organometallics, 2003 |
4060807 | CIF | C64.5 H69 Br Ge Mo P4 | I 1 2/a 1 | 24.715; 13.2501; 34.527 90; 97.68; 90 | 11205 | Filippou, Alexander C.; Portius, Peter; Philippopoulos, Athanassios I. Molybdenum and Tungsten Germylyne Complexes of the general formula trans-[X(dppe)~2~M≡Ge-(η^1^-Cp^*^)] (X = Cl, Br, I; dppe = Ph~2~PCH~2~CH~2~PPh~2~; Cp^*^ = C~5~Me~5~); Syntheses, Molecular Structures and Bonding Features of the Germylyne Ligand Organometallics, 2002 |
4060808 | CIF | C64.5 H69 Cl Ge Mo P4 | I 1 2/a 1 | 24.664; 13.346; 34.453 90; 97.322; 90 | 11248 | Filippou, Alexander C.; Portius, Peter; Philippopoulos, Athanassios I. Molybdenum and Tungsten Germylyne Complexes of the general formula trans-[X(dppe)~2~M≡Ge-(η^1^-Cp^*^)] (X = Cl, Br, I; dppe = Ph~2~PCH~2~CH~2~PPh~2~; Cp^*^ = C~5~Me~5~); Syntheses, Molecular Structures and Bonding Features of the Germylyne Ligand Organometallics, 2002 |
4061214 | CIF | C76 H108 Br4 Fe2 N20 O4 S4 | I 1 2/a 1 | 21.2278; 9.8455; 21.7664 90; 100.37; 90 | 4474.83 | Organometallics, 2004 |
4061301 | CIF | C25 H22 Cl2 N P Pd | I 1 2/a 1 | 21.587; 8.979; 26.183 90; 104.844; 90 | 4906 | Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes. Organometallics, 2004, 23, 6191-6201 |
4061604 | CIF | C19 H18 Fe Mn O2 P | I 1 2/a 1 | 18.6315; 9.6162; 19.3704 90; 99.633; 90 | 3421.6 | Organometallics, 2005 |
4061605 | CIF | C19 H18 Fe O2 P Re | I 1 2/a 1 | 18.8039; 9.5428; 19.6102 90; 99.243; 90 | 3473.2 | Organometallics, 2005 |
4062279 | CIF | C47 H74 F2 Li O2 P Si2 | I 1 2/a 1 | 35.59; 11.096; 25.75 90; 96.492; 90 | 10104 | Ionkin, Alex S.; Marshall, William J. Synthesis and Unusual Thermal Behavior of (Lithium phosphino/amino) Difluorosilanes Organometallics, 2003, 22, 4136-4144 |
4062401 | CIF | C53 H70 Li2 P2 Rh2 | I 1 2/a 1 | 18.8574; 17.4958; 14.0506 90; 97.5269; 90 | 4595.7 | Organometallics, 2003 |
4062507 | CIF | C94 H118 B2 Cl12 F8 O5 P4 Rh2 | I 1 2/a 1 | 23.097; 14.5217; 28.715 90; 94.639; 90 | 9599.7 | Holliday, Bradley J.; Ulmann, Pirmin A.; Mirkin, Chad A.; Stern, Charlotte L.; Zakharov, Lev N.; Rheingold, Arnold L. A Systematic Study of the Role of Ligand Structure in the Formation of Homobinuclear Rhodium Macrocycles Formed via the Weak-Link Approach Organometallics, 2004 |
4062576 | CIF | C18 H32 O12 Rh2 S2 | I 1 2/a 1 | 17.622; 8.535; 18.667 90; 106.32; 90 | 2694.5 | Basato, Marino; Biffis, Andrea; Martinati, Gianluca; Zecca, Marco; Ganis, Paolo; Benetollo, Franco; Aronica, Laura A.; Caporusso, Anna M. Cationic Carboxylato Complexes of Dirhodium(II) with Oxo Thioethers: Promising Catalysts with Unusual Coordination Modes Organometallics, 2004, 23, 1947-1952 |
4062773 | CIF | C66.5 H67 Ge N P4 W | I 1 2/a 1 | 24.601; 13.466; 34.549 90; 97.563; 90 | 11346 | Filippou, Alexander C.; Philippopoulos, Athanassios I.; Portius, Peter; Schnakenburg, Gregor Organometallics, 2004 |
4062796 | CIF | C50 H53 O2 P2 Rh | I 1 2/a 1 | 20.919; 10.106; 40.156 90; 97.01; 90 | 8426 | Krug, Christopher; Hartwig, John F. Reactions of an Arylrhodium Complex with Aldehydes, Imines, Ketones, and Alkynones. New Classes of Insertion Reactions Organometallics, 2004, 23, 4594-4607 |
4062934 | CIF | C40 H44 Cu2 F4 Fe2 O4 P2 S4 | I 1 2/a 1 | 22.0029; 24.9608; 33.2717 90; 97.202; 90 | 18129 | Organometallics, 2004 |
4063209 | CIF | C38 H31 Fe O3 Rh | I 1 2/a 1 | 20.834; 12.455; 25.752 90; 97.09; 90 | 6631.2 | Hari K. Gupta; Nicole Rampersad; Mark Stradiotto; Michael J. McGlinchey Rhodium Acetylacetonate and Iron Tricarbonyl Complexes of Tetracyclone and 3-Ferrocenyl-2,4,5-triphenylcyclopentadienone: An X-ray Crystallographic and NMR Study Organometallics, 2000, 19, 184-191 |
4064435 | CIF | C32.25 H38.5 Cl4.5 N2 O Ru2 | I 1 2/a 1 | 18.424; 14.331; 27.579 90; 109.228; 90 | 6875.6 | Borguet, Yannick; Sauvage, Xavier; Zaragoza, Guillermo; Demonceau, Albert; Delaude, Lionel Synthesis and Catalytic Evaluation in Olefin Metathesis of a Second-Generation Homobimetallic Ruthenium‒Arene Complex Bearing a Vinylidene Ligand Organometallics, 2011, 30, 2730 |
4064976 | CIF | C42 H46 Cl2 N2 P2 Ru | I 1 2/a 1 | 18.1126; 10.0116; 41.749 90; 93.3068; 90 | 7558 | Schley, Nathan D.; Dobereiner, Graham E.; Crabtree, Robert H. Oxidative Synthesis of Amides and Pyrroles via Dehydrogenative Alcohol Oxidation by Ruthenium Diphosphine Diamine Complexes Organometallics, 2011, 30, 4174 |
4065284 | CIF | C51 H39 Cl5 Os P2 | I 1 2/a 1 | 25.295; 12.8976; 29.254 90; 112.843; 90 | 8795.5 | Chen, Jiangxi; Sung, Herman Ho-Yung; Williams, Ian Duncan; Jia, Guochen Hydrolysis of Osmium and Ruthenium Carbyne Complexes Organometallics, 2011, 30, 6159 |
4066161 | CIF | C50 H142 Cr2 K2 N10 Si10 | I 1 2/a 1 | 23.2373; 17.7035; 21.5073 90; 108.206; 90 | 8404.8 | Carrella, Luca M.; Förster, Christoph; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.; Rentschler, Eva Synthesis and Structure of a Potassium Potassiochromate: A Bis-Chromium(II) Molecule Held Together by Near-Square-Planar Potassium−Ligand Bridges† Organometallics, 2010, 29, 4756 |
4066531 | CIF | C45 H43 Cl Os P2 | I 1 2/a 1 | 20.66; 10.6445; 34.0135 90; 102.777; 90 | 7294.87 | Tse, Sunny Kai San; Bai, Wei; Sung, Herman Ho-Yung; Williams, Ian Duncan; Jia, Guochen Substituted Cyclopentadienyl Osmium Complexes from the Reactions of OsH3Cl(PPh3)3with Fulvenes and Cyclopentadienes Organometallics, 2010, 29, 3571 |
4066709 | CIF | C28 H30 Cl F6 N4 P Pd2 | I 1 2/a 1 | 10.868; 16.494; 16.664 90; 93.66; 90 | 2981 | D’Amora, Angela; Fanfoni, Lidia; Cozzula, Daniela; Guidolin, Nicol; Zangrando, Ennio; Felluga, Fulvia; Gladiali, Serafino; Benedetti, Fabio; Milani, Barbara Addressing the Poly- to Oligo-ketone Selectivity in Styrene Carbonylation Catalyzed by Palladium/bpy Complexes. Effect of the 6-Alkyl Substitution Organometallics, 2010, 29, 4472 |
4066943 | CIF | C66 H68 O4 Zr2 | I 1 2/a 1 | 12.9165; 26.63; 18.979 90; 94.48; 90 | 6508.2 | Kuppuswamy, Subramaniam; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Activation of an Aryl C−H Bond Converts Chelating Diphenolate Ligands Bound to Zirconium into Trianionic Pincer Ligands: σ-Donor Ligand Effects versus Thermolysis Organometallics, 2010, 29, 6711 |
4067273 | CIF | C156 H228 Mn2 N2 | I 1 2/a 1 | 25.0687; 27.979; 25.2421 90; 118.513; 90 | 15557 | Ni, Chengbao; Fettinger, James C.; Power, Philip P. Intramolecular C−H Activation by Putative Terminal Two-Coordinate Manganese(III) Imido Intermediates: Hydrogen Abstraction from a Phenyl Group Organometallics, 2010, 29, 269 |
4067674 | CIF | C36 H26 N2 O8 Pd2 | I 1 2/a 1 | 14.642; 10.676; 20.021 90; 92.61; 90 | 3126.4 | Roiban, Gheorghe-Doru; Serrano, Elena; Soler, Tatiana; Contel, Maria; Grosu, Ion; Cativiela, Carlos; Urriolabeitia, Esteban P. Ortho-Palladation of (Z)-2-Aryl-4-Arylidene-5(4H)-Oxazolones. Structure and Functionalization Organometallics, 2010, 29, 1428 |
4067784 | CIF | C23 H12 Fe S2 | I 1 2/a 1 | 16.8995; 9.7167; 20.6494 90; 90.286; 90 | 3390.74 | Rose-Munch, Françoise; Li, Ming; Rose, Eric; Daran, Jean Claude; Bossi, Alberto; Licandro, Emanuela; Mussini, Patrizia Romana Tetrathia[7]helicene-Based Complexes of Ferrocene and (η5-Cyclohexadienyl)tricarbonylmanganese: Synthesis and Electrochemical Studies Organometallics, 2012, 31, 92 |
4068167 | CIF | C60 H82 N4 Ni2 | I 1 2/a 1 | 19.25; 12.261; 24.132 90; 108.004; 90 | 5416.8 | Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J. Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers Organometallics, 2012, 31, 470 |
4068638 | CIF | C65.54 H58.09 Cl6.09 N2 P4 Pd Ru | I 1 2/a 1 | 16.9892; 13.3623; 54.955 90; 95.187; 90 | 12424.5 | Koutsantonis, George A.; Jenkins, Gareth I.; Schauer, Phil A.; Szczepaniak, Barbara; Skelton, Brian W.; Tan, Colin; White, Allan H. Coordinating Tectons: Bipyridyl-Terminated Group 8 Alkynyl Complexes Organometallics, 2009, 28, 2195 |
4068891 | CIF | C102 H98 Ag2 B2 N10 | I 1 2/a 1 | 24.0034; 17.3322; 20.4685 90; 104.162; 90 | 8256.7 | Brown, David H.; Nealon, Gareth L.; Simpson, Peter V.; Skelton, Brian W.; Wang, Zhisen Silver and Palladium Complexes of a Bis(benzimidazolin-2-ylidene)pyridine Pincer Ligand Organometallics, 2009, 28, 1965 |
4069171 | CIF | C38 H60 B Ir O0.5 P4 | I 1 2/a 1 | 19.795; 19.114; 21.176 90; 102.14; 90 | 7833 | Crestani, Marco G.; Steffen, Andreas; Kenwright, Alan M.; Batsanov, Andrei S.; Howard, Judith A. K.; Marder, Todd B. Oxidative Addition of X−H (X = C, N, O) Bonds to [Ir(PMe3)4]Cl and Catalytic Hydration of Acetonitrile Using its Peroxo Derivative, [Ir(O2)(PMe3)4]Cl, as Catalyst Precursor Organometallics, 2009, 28, 2904 |
4069538 | CIF | C32 H16 Br6 N4 O2 Ru | I 1 2/a 1 | 23.0841; 6.9214; 23.5613 90; 112.317; 90 | 3482.5 | Leung, Chi-Fai; Ng, Siu-Mui; Xiang, Jing; Wong, Wai-Yeung; Lam, Michael Hon-Wah; Ko, Chi-Chiu; Lau, Tai-Chu Synthesis and Photophysical Properties of Ruthenium(II) Isocyanide Complexes Containing 8-Quinolinolate Ligands Organometallics, 2009, 28, 5709 |
4069555 | CIF | C26 H25 Br2 Fe N3 S | I 1 2/a 1 | 15.844; 8.5836; 18.715 90; 94.205; 90 | 2538.4 | Tenza, Kenny; Hanton, Martin J.; Slawin, Alexandra M. Z. Ethylene Oligomerization Using First-Row Transition Metal Complexes Featuring Heterocyclic Variants of Bis(imino)pyridine Ligands Organometallics, 2009, 28, 4852 |
4069660 | CIF | C12 H28 Mg2 O2 | I 1 2/a 1 | 12.953; 10.0259; 13.5302 90; 114.142; 90 | 1603.42 | Michel, Olaf; Meermann, Christian; Törnroos, Karl W.; Anwander, Reiner Alkaline-Earth Metal Alkylaluminate Chemistry Revisited Organometallics, 2009, 28, 4783 |
4070962 | CIF | C28 H48 Cl2 Fe2 N6 Si2 | I 1 2/a 1 | 18.514; 8.132; 23.124 90; 91.58; 90 | 3480.1 | Sciarone, Timo J. J.; Nijhuis, Christian A.; Meetsma, Auke; Hessen, Bart Neutral and Cationic Paramagnetic Amino-amidinate Iron(II) Complexes:19F NMR Evidence for Interactions with Weakly Coordinating Anions Organometallics, 2008, 27, 2058 |
4071014 | CIF | C24 H23 Cl4 F2 Fe N3 | I 1 2/a 1 | 15.867; 15.22; 21.709 90; 93.565; 90 | 5232 | Ionkin, Alex S.; Marshall, William J.; Adelman, Douglas J.; Bobik Fones, Barbara; Fish, Brian M.; Schiffhauer, Matthew F.; Spence, Rupert E.; Xie, Tuyu High-Temperature Catalysts for the Production of α-Olefins Based on Iron(II) and Cobalt(II) Tridentate Bis(imino)pyridine Complexes with a Double Pattern of Substitution:o-Methyl pluso-Fluorine in the Same Imino Arm† Organometallics, 2008, 27, 1147 |
4071023 | CIF | C37.75 H46.5 Cl3.5 N P2 Ru | I 1 2/a 1 | 20.306; 12.791; 30.984 90; 90.238; 90 | 8048 | Mothes, Emmanuelle; Sentets, Stephane; Luquin, Maria Asuncion; Mathieu, René; Lugan, Noël; Lavigne, Guy New Insight into the Reactivity of Pyridine-Functionalized Phosphine Complexes of Ruthenium(II) with Respect to Olefin Metathesis and Transfer Hydrogenation Organometallics, 2008, 27, 1193 |
4071027 | CIF | C94 H110 N2 Ni O8 P4 | I 1 2/a 1 | 26.3678; 15.4778; 23.088 90; 116.328; 90 | 8445.2 | Lavanant, Laurent; Rodrigues, Anne-Sophie; Kirillov, Evgueni; Carpentier, Jean-François; Jordan, Richard F. Synthesis, Structures, Dynamics, and Ethylene Polymerization Activity of Nickel Complexes Containing anortho-Methoxy-aryl Diphosphine Ligand Organometallics, 2008, 27, 2107 |
4072025 | CIF | C45 H65 P3 S4 | I 1 2/a 1 | 38.65; 11.962; 39.259 90; 92.036; 90 | 18139 | Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Marchione, Alexander A.; Howe, Laurie A.; Davidson, Fredric; McEwen, Charles N. Dual Supermesityl Stabilization: 1-Alkyl-1H-[1,2,4]triphospholes, with Among the Most Planar and Least Sterically Hindered σ3,λ3-Phosphorus Atoms, and Novel C2P3S4Folded Heterocycles† Organometallics, 2008, 27, 5118 |
4072570 | CIF | C15 H20 Au Cl N2 O | I 1 2/a 1 | 16.5313; 11.2567; 17.275 90; 99.65; 90 | 3169.2 | Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit Palladium(II) and Gold(I) Complexes of a New O-Functionalized N-Heterocyclic Carbene Ligand: Synthesis, Structures, and Catalytic Application Organometallics, 2007, 26, 958 |
4072692 | CIF | C16 H24 Cl4 N6 Pd | I 1 2/a 1 | 14.3813; 10.8029; 14.5861 90; 100.679; 90 | 2226.8 | Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J. Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts Organometallics, 2007, 26, 1588 |
4073074 | CIF | C50 H56 Co N6 O4 | I 1 2/a 1 | 12.128; 31.999; 12.13 90; 98.012; 90 | 4661.5 | Mandal, Debaprasad; Bhuyan, Mouchumi; Laskar, Moitree; Gupta, B. D. Co−C Bond Homolysis: Reactivity Difference between Alkyl- and Benzylcobaloximes Organometallics, 2007, 26, 2795 |
4073186 | CIF | C7 H19 B Na O P | I 1 2/a 1 | 12.534; 14.6996; 13.079 90; 102.279; 90 | 2354.6 | Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W. Metalation of Trimethylphosphine−Borane. Unexpected Reactivity of a Simple Phosphine−Borane-Stabilized Carbanion toward Siloxanes Organometallics, 2007, 26, 2861 |
4073603 | CIF | C30 H26 F6 N4 O8 Pd2 S2 | I 1 2/a 1 | 18.364; 8.892; 22.191 90; 115.099; 90 | 3281 | Conley, Nicholas R.; Labios, Liezel A.; Pearson, David M.; McCrory, Charles C. L.; Waymouth, Robert M. Aerobic Alcohol Oxidation with Cationic Palladium Complexes: Insights into Catalyst Design and Decomposition Organometallics, 2007, 26, 5447 |
4073666 | CIF | C126 H110 Fe O6 P4 Ru2 S2 | I 1 2/a 1 | 24.287; 13.5739; 34.451 90; 95.559; 90 | 11304 | Cowley, Andrew R.; Hector, Andrew L.; Hill, Anthony F.; White, Andrew J. P.; Williams, David J.; Wilton-Ely, James D. E. T. Synthesis and Reactions of Five-Coordinate Mono- and Binuclear Thiocarbonyl−Alkenyl and Thioacyl Complexes of Ruthenium(II) Organometallics, 2007, 26, 6114 |
4073885 | CIF | C33 H34 Cl4 N P Pd | I 1 2/a 1 | 19.369; 12.15; 27.89 90; 103.74; 90 | 6376 | Aguilar, David; Aznárez, Francisco; Bielsa, Raquel; Falvello, Larry R.; Navarro, Rafael; Urriolabeitia, Esteban P. Versatility of Iminophosphoranes and Noninnocent Behavior of the 1,5-Cyclooctadiene Ligand in Palladium(II) Complexes. Synthesis of σ-Allyl Derivatives Organometallics, 2007, 26, 6397 |
4076001 | CIF | C33 H38 Cr N2 O2.5 | I 1 2/a 1 | 42.1994; 8.4552; 37.1949 90; 115.834; 90 | 11945 | Norman, David W.; McDonald, Robert; Stryker, Jeffrey M. Thermally Stable Chromium(III)η3-Allyl Complexes. Direct Structural Comparison of Neutral Chromium(II) and Cationic Chromium(III)η3-Allyl Redox Isomers Organometallics, 2005, 24, 4461 |
4076228 | CIF | C22 H36 F6 P2 Ru | I 1 2/a 1 | 18.584; 7.9942; 32.5174 90; 101.994; 90 | 4725.5 | Umezawa-Vizzini, Kayo; Lee, T. Randall Reversible Olefin−Hydride Insertion in the Cationic Ruthenium Complexes [(η6-C6H5CH2CH2PR2)RuH(CH2CH2)]+ Organometallics, 2004, 23, 1448 |
4076427 | CIF | C57.5 H47 Cl F3 Ir O7 P4 Ru S | I 1 2/a 1 | 17.5797; 23.6325; 26.428 90; 95.2753; 90 | 10933.1 | MacDougall, Tiffany J.; Samant, Rahul G.; Trepanier, Steven J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin Geminal Carbon‒Hydrogen Bond Activation in Cumulenes Promoted by Adjacent Iridium/Ruthenium Centers Organometallics, 2012, 31, 1857 |
4076509 | CIF | C48 H54 Br2 N6 O | I 1 2/a 1 | 19.862; 8.3618; 27.6873 90; 95.56; 90 | 4576.7 | Makhloufi, Abdelaziz; Frank, Walter; Ganter, Christian Diamino- and Mixed Amino‒Amido-N-Heterocyclic Carbenes Based on Triazine Backbones Organometallics, 2012, 31, 2001 |
4076842 | CIF | C55 H46 B F4 O4 P4 Rh Ru | I 1 2/a 1 | 42.754; 10.2403; 23.59 90; 90.455; 90 | 10328 | Rowsell, Bryan D.; Trepanier, Steven J.; Lam, Robert; McDonald, Robert; Cowie, Martin Methylene-Bridged Complexes of Rhodium/Ruthenium as Models for Bimetallic Fischer−Tropsch Catalysts: Comparisons with the Rh/Os and Ir/Ru Analogues Organometallics, 2002, 21, 3228 |
4077256 | CIF | C39 H55 N2 Na O2 P2 Si2 | I 1 2/a 1 | 20.412; 10.276; 19.489 90; 96.104; 90 | 4065 | Kamalesh Babu, Ruppa P.; Aparna, Kasani; McDonald, Robert; Cavell, Ronald G. Monomeric Alkali Metal (Li, Na, K) Complexes of Bis(iminophosphorano)methanides Organometallics, 2001, 20, 1451 |
4077439 | CIF | C45.5 H78 F6 N3 O6.5 P2 Ru S2 | I 1 2/a 1 | 26.353; 9.7122; 43.792 90; 94.792; 90 | 11169 | Chaumonnot, Alexandra; Donnadieu, Bruno; Sabo-Etienne, Sylviane; Chaudret, Bruno; Buron, Christophe; Bertrand, Guy; Metivier, Pascal Ruthenium Carbene Complexes Containing a Triazolidene Cationic Ligand Organometallics, 2001, 20, 5614 |
4077492 | CIF | C42 H62 Li2 N2 O4 | I 1 2/a 1 | 14.356; 14.888; 19.76 90; 99; 90 | 4171.4 | Nückel, Stefan; Burger, Peter Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine† Organometallics, 2000, 19, 3305 |
4077510 | CIF | C26 H27 Br3 Hg1.5 O2 P Pt | I 1 2/a 1 | 21.787; 8.178; 32.205 90; 97.23; 90 | 5692 | Ara, Irene; Falvello, Larry R.; Forniés, Juan; Sicilia, Violeta; Villarroya, Pablo Reactivity of [M(C∧P)(acac-O,O‘)] [M = Pt, Pd; C∧P = CH2-C6H4-P(o-tolyl)2-κC,P; acac = 2,4-pentanedionato] toward HgX2(X = Br, I, CH3COO, CF3COO). New Polynuclear Complexes Containing Pt−Hg Bonds. Molecular Structures of [{Pt(C∧P)(acac-O,O‘)- HgBr(μ-Br)}2(μ-HgBr2)], an Unprecedented Square-Planar Bromomercurate Complex, and [{Pt(C∧P)(μ-O2CCH3)2Hg(μ3-acac2‒κC3,O)Hg(O2CCH3-κO)}· CHCl3]2, the First Complex Containing Asymmetric Dimercurated Acetylacetone Organometallics, 2000, 19, 3091 |
4077798 | CIF | C32 H60 Si4 Ti | I 1 2/a 1 | 18.807; 18.927; 21.214 90; 97.18; 90 | 7492.1 | Horáček, Michal; Kupfer, Volkmar; Thewalt, Ulf; Štěpnička, Petr; Polášek, Miroslav; Mach, Karel Bis[η5-tetramethyl(trimethylsilyl)cyclopentadienyl]titanium(II) and Its π-Complexes with Bis(trimethylsilyl)acetylene and Ethylene Organometallics, 1999, 18, 3572 |
4077911 | CIF | C8 H24 Au2 F12 S4 Sb2 | I 1 2/a 1 | 44.765; 7.8085; 21.6181 90; 93.833; 90 | 7539.6 | Savjani, Nicky; Bew, Sean P.; Hughes, David L.; Lancaster, Simon J.; Bochmann, Manfred Reactivity of “Ligand-Free” Au+: C‒H and C‒C Activation versus π Coordination Organometallics, 2012, 31, 2534 |
4078668 | CIF | C49 H54 Ir O4 P2 Rh Si3 | I 1 2/a 1 | 20.6418; 10.9486; 20.9305 90; 92.867; 90 | 4724.3 | Mobarok, Md Hosnay; Ferguson, Michael J.; Cowie, Martin Multiple Si‒H Bond Activations in a Bis(diethylphosphino)methane-Bridged Complex of Rhodium and Iridium: Synthesis of an Unusual Bis(silyl)/μ-Silylene Complex Organometallics, 2012, 31, 4722 |
4079309 | CIF | C68 H74 Li2 O8 P4 | I 1 2/a 1 | 22.474; 11.8708; 23.1806 90; 92.239; 90 | 6179.5 | Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity Organometallics, 2012, 31, 6438 |
4080815 | CIF | C24 H46 Br2 O10 Sn | I 1 2/a 1 | 16.1335; 11.5894; 16.415 90; 100.304; 90 | 3019.7 | Arens, Verena; Dietz, Christina; Schollmeyer, Dieter; Jurkschat, Klaus Intramolecularly Coordinated Bis(crown ether)-Substituted Organotin Halides as Ditopic Salt Receptors Organometallics, 2013, 32, 2775 |
4080816 | CIF | C24 H46 Cl2 O10 Sn | I 1 2/a 1 | 15.948; 11.4212; 16.389 90; 100.19; 90 | 2938.1 | Arens, Verena; Dietz, Christina; Schollmeyer, Dieter; Jurkschat, Klaus Intramolecularly Coordinated Bis(crown ether)-Substituted Organotin Halides as Ditopic Salt Receptors Organometallics, 2013, 32, 2775 |
4080817 | CIF | C24 H46 F2 O10 Sn | I 1 2/a 1 | 14.586; 12.2579; 16.169 90; 102.09; 90 | 2826.8 | Arens, Verena; Dietz, Christina; Schollmeyer, Dieter; Jurkschat, Klaus Intramolecularly Coordinated Bis(crown ether)-Substituted Organotin Halides as Ditopic Salt Receptors Organometallics, 2013, 32, 2775 |
4080818 | CIF | C20 H38 I2 O8 Sn | I 1 2/a 1 | 14.02; 11.6934; 17.38 90; 101.2; 90 | 2795 | Arens, Verena; Dietz, Christina; Schollmeyer, Dieter; Jurkschat, Klaus Intramolecularly Coordinated Bis(crown ether)-Substituted Organotin Halides as Ditopic Salt Receptors Organometallics, 2013, 32, 2775 |
4080819 | CIF | C20 H20 Br2 O8 Sn | I 1 2/a 1 | 13.743; 11.334; 17.683 90; 97.82; 90 | 2728.7 | Arens, Verena; Dietz, Christina; Schollmeyer, Dieter; Jurkschat, Klaus Intramolecularly Coordinated Bis(crown ether)-Substituted Organotin Halides as Ditopic Salt Receptors Organometallics, 2013, 32, 2775 |
4081047 | CIF | C54 H37 B F24 N2 O Pt | I 1 2/a 1 | 25.455; 16.5463; 29.806 90; 115.22; 90 | 11357 | McKeown, Bradley A.; Gonzalez, Hector Emanuel; Michaelos, Thoe; Gunnoe, T. Brent; Cundari, Thomas R.; Crabtree, Robert H.; Sabat, Michal Control of Olefin Hydroarylation Catalysis via a Sterically and Electronically Flexible Platinum(II) Catalyst Scaffold Organometallics, 2013, 32, 3903 |
4081374 | CIF | C113 H99 Ag2 Au2 Cl2 N3 O12 P6 | I 1 2/a 1 | 26.039; 15.445; 26.79 90; 100.79; 90 | 10584 | Jiang, Yi; Wang, Yong-Tao; Ma, Zheng-Gen; Li, Zhi-Hong; Wei, Qiao-Hua; Chen, Guo-Nan New Luminescent Ag2Au2Heteronuclear Alkynyl‒Phosphine Complexes and Recognition of Homocysteine and Cysteine Organometallics, 2013, 32, 4919 |
4081922 | CIF | C59 H88 Cl12 Ir4 N8 | I 1 2/a 1 | 15.1391; 15.5045; 31.8334 90; 98.9181; 90 | 7381.7 | Valdés, Hugo; Poyatos, Macarena; Peris, Eduardo A Tetracyclic Bis(imidazolindiylidene) Ligand and Its Diiridium and Dipalladium Complexes Organometallics, 2013, 32, 6445 |
4083776 | CIF | C44 H80 B2 Fe I2 Li2 N8 O4 | I 1 2/a 1 | 17.7045; 17.6048; 17.7357 90; 100.713; 90 | 5431.6 | Lee, Wei-Tsung; Jeon, Ie-Rang; Xu, Song; Dickie, Diane A.; Smith, Jeremy M. Low-Coordinate Iron(II) Complexes of a Bulky Bis(carbene)borate Ligand Organometallics, 2014, 33, 5654 |
4083888 | CIF | C21 H26 Au Cl N2 Se | I 1 2/a 1 | 13.3275; 7.9823; 41.362 90; 97.754; 90 | 4360 | Nelson, David J.; Nahra, Fady; Patrick, Scott R.; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P. Exploring the Coordination of Cyclic Selenoureas to Gold(I) Organometallics, 2014, 140702161847002 |
4084006 | CIF | C42 H45 Cr N2 | I 1 2/a 1 | 17.3318; 14.6278; 28.754 90; 105.182; 90 | 7035.5 | Ronellenfitsch, Mathias; Wadepohl, Hubert; Enders, Markus Chromium Aryl Complexes with N-Donor Ligands as Catalyst Precursors for Selective Ethylene Trimerization Organometallics, 2014, 33, 5758 |
4084764 | CIF | C31 H34 Cl N Ti | I 1 2/a 1 | 16.4824; 8.1061; 39.8669 90; 100.262; 90 | 5241.3 | Loose, Florian; Plettenberg, Inka; Haase, Detlev; Saak, Wolfgang; Schmidtmann, Marc; Schäfer, André; Müller, Thomas; Beckhaus, Rüdiger Aromatic Imines in the Titanocene Coordination Sphere—Titanaaziridine vs 1-Aza-2-titanacyclopent-4-ene Structures Organometallics, 2014, 33, 6785 |
4084994 | CIF | C12 H9 O7 Re | I 1 2/a 1 | 19.9825; 5.9251; 21.5944 90; 93.703; 90 | 2551.4 | Ursillo, Samer; Can, Daniel; N’Dongo, Harmel W. Peindy; Schmutz, Paul; Spingler, Bernhard; Alberto, Roger Cyclopentadienyl Chemistry in Water: Synthesis and Properties of Bifunctionalized [(η5-C5H3{COOR}2)M(CO)3] (M = Re and99mTc) Complexes Organometallics, 2014, 33, 6945 |
4085067 | CIF | C60 H78 Au2 N4 O2 | I 1 2/a 1 | 15.3438; 19.525; 19.6769 90; 92.122; 90 | 5890.9 | Roşca, Dragoş-Adrian; Fernandez-Cestau, Julio; Hughes, David L.; Bochmann, Manfred Reactivity of Gold Hydrides: O2 Insertion into the Au-H Bond. Organometallics, 2015, 34, 2098-2101 |
4085147 | CIF | C26 H23 O8 Re | I 1 2/a 1 | 21.2127; 8.8364; 27.3229 90; 106.562; 90 | 4909 | Lin, Ran; Lee, Ka-Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen Rhenabenzenes and Unexpected Coupling Products from the Reactions of Rhenacyclobutadienes with Ethoxyethyne Organometallics, 2015, 34, 167 |
4085189 | CIF | C67.5 H64 Cl3 N O5 P2 Ru S2 | I 1 2/a 1 | 21.8965; 17.9869; 31.6196 90; 98.962; 90 | 12301.4 | Toscani, Anita; Heliövaara, Eeva K.; Hena, Jubeda B.; White, Andrew J. P.; Wilton-Ely, James D. E. T. Multimetallic Alkenyl Complexes Bearing Macrocyclic Dithiocarbamate Ligands Organometallics, 2015, 34, 494 |
4085280 | CIF | C50 H100 Fe2 I2 P8 | I 1 2/a 1 | 16.1604; 13.9634; 27.1193 90; 100.184; 90 | 6023.17 | Lissel, Franziska; Blacque, Olivier; Venkatesan, Koushik; Berke, Heinz Structural and Electronic Variations of sp/sp2Carbon-Based Bridges in Di- and Trinuclear Redox-Active Iron Complexes Bearing Fe(diphosphine)2X (X = I, NCS) Moieties Organometallics, 2015, 34, 408 |
4085322 | CIF | C29 H38 Cl0.5 N2.5 Pd | I 1 2/a 1 | 19.7597; 11.8025; 24.259 90; 108.371; 90 | 5369.2 | Hruszkewycz, Damian P.; Guard, Louise M.; Balcells, David; Feldman, Nicola; Hazari, Nilay; Tilset, Mats Effect of 2-Substituents on Allyl-Supported Precatalysts for the Suzuki‒Miyaura Reaction: Relating Catalytic Efficiency to the Stability of Palladium(I) Bridging Allyl Dimers Organometallics, 2015, 34, 381 |
4085437 | CIF | C52 H96 Al2 Fe Li2 N2 O2 | I 1 2/a 1 | 16.3217; 14.7125; 22.5707 90; 98.785; 90 | 5356.4 | Clegg, William; Crosbie, Elaine; Dale-Black, Sophie H.; Hevia, Eva; Honeyman, Gordon W.; Kennedy, Alan R.; Mulvey, Robert E.; Ramsay, Donna L.; Robertson, Stuart D. Structurally Defined Zincated and Aluminated Complexes of Ferrocene Made by Alkali-Metal Synergistic Syntheses Organometallics, 2015, 34, 2580 |
4085532 | CIF | C26 H20 Cl2 N2 Zn | I 1 2/a 1 | 17.6901; 11.7401; 23.2316 90; 104.191; 90 | 4677.6 | Evans, Daniel A.; Lee, Lucia Myongwon; Vargas-Baca, Ignacio; Cowley, Alan H. Aggregation-Induced Emission of Bis(imino)acenaphthene Zinc Complexes: Photophysical Tuning via Methylation of the Flanking Aryl Substituents Organometallics, 2015, 34, 2422 |
4085921 | CIF | C100 H96 B2 F48 Fe O9 | I 1 2/a 1 | 25.7267; 17.4831; 24.6865 90; 109.256; 90 | 10482.4 | Lichtenberg, Crispin; Adelhardt, Mario; Wörle, Michael; Büttner, Torsten; Meyer, Karsten; Grützmacher, Hansjörg Mono- and Dinuclear Neutral and Cationic Iron(II) Compounds Supported by an Amidinato-diolefin Ligand: Characterization and Catalytic Application Organometallics, 2015, 34, 3079 |
4086028 | CIF | C37 H52.13 Cl0.87 N5 O Pt | I 1 2/a 1 | 27.0831; 9.1351; 29.5853 90; 100.023; 90 | 7207.9 | Seyboldt, Alexander; Wucher, Barbara; Hohnstein, Silvia; Eichele, Klaus; Rominger, Frank; Törnroos, Karl W.; Kunz, Doris Evidence for the Formation of Anionic Zerovalent Group 10 Complexes as Highly Reactive Intermediates Organometallics, 2015, 34, 2717 |
4086439 | CIF | C25 H37 O4 P Pd S2 | I 1 2/a 1 | 21.5627; 12.9662; 19.8892 90; 103.413; 90 | 5409.1 | Wu, Zixia; Chen, Min; Chen, Changle Ethylene Polymerization and Copolymerization by Palladium and Nickel Catalysts Containing Naphthalene-Bridged Phosphine‒Sulfonate Ligands Organometallics, 2016, 35, 1472 |
4086448 | CIF | C34 H57 Cl2 N P2 Pt | I 1 2/a 1 | 17.151; 15.554; 28.094 90; 103.916; 90 | 7274.6 | Magnuson, Kevin W.; Oshiro, Shelly M.; Gurr, Joshua R.; Yoshida, Wesley Y.; Gembicky, Milan; Rheingold, Arnold L.; Hughes, Russell P.; Cain, Matthew F. Streamlined Preparation and Coordination Chemistry of Hybrid Phosphine‒Phosphaalkene Ligands Organometallics, 2016, 35, 855-859 |
4086716 | CIF | C74 H112 N2 Ni2 P4 Si2 | I 1 2/a 1 | 35.107; 14.1275; 40.221 90; 104.697; 90 | 19296 | Charboneau, David J.; Balcells, David; Hazari, Nilay; Lant, Hannah M. C.; Mayer, James M.; Melvin, Patrick R.; Mercado, Brandon Q.; Morris, Wesley D.; Repisky, Michal; Suh, Hee-Won Dinitrogen-Facilitated Reversible Formation of a Si‒H Bond in a Pincer-Supported Ni Complex Organometallics, 2016, 35, 3154 |
4088054 | CIF | C59 H97 N3 P4 Yb | I 1 2/a 1 | 16.994; 34.291; 27.1533 90; 96.486; 90 | 15722.1 | Cheisson, Thibault; Auffrant, Audrey; Nocton, Grégory η5‒η1Switch in Divalent Phosphaytterbocene Complexes with Neutral Iminophosphoranyl Pincer Ligands: Solid-State Structures and Solution NMR1JYb‒PCoupling Constants Organometallics, 2015, 34, 5470 |
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