Crystallography Open Database

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7151583 CIFC10 H10 Cl F5 OP 1 c 18.7576; 13.7337; 9.8743
90; 106.53; 90		1138.54DiMartino, Gianluca; Hursthouse, Michael B.; Light, Mark E.; Percy, Jonathan M.; Spencer, Neil S.; Tolley, Malcolm
Syntheses of selectively fluorinated cyclodecenones: the first deployment of the neutral oxy-Cope rearrangement in organofluorine chemistry
Organic & Biomolecular Chemistry, 2003, 1, 4423
7151584 CIFC10 H10 Cl F5 OP 21 21 217.979; 9.742; 14.053
90; 90; 90		1092.4DiMartino, Gianluca; Hursthouse, Michael B.; Light, Mark E.; Percy, Jonathan M.; Spencer, Neil S.; Tolley, Malcolm
Syntheses of selectively fluorinated cyclodecenones: the first deployment of the neutral oxy-Cope rearrangement in organofluorine chemistry
Organic & Biomolecular Chemistry, 2003, 1, 4423
7151585 CIFC10 H10 F6 OP -15.996; 8.007; 11.386
80.9; 87.03; 78.66		529.1DiMartino, Gianluca; Hursthouse, Michael B.; Light, Mark E.; Percy, Jonathan M.; Spencer, Neil S.; Tolley, Malcolm
Syntheses of selectively fluorinated cyclodecenones: the first deployment of the neutral oxy-Cope rearrangement in organofluorine chemistry
Organic & Biomolecular Chemistry, 2003, 1, 4423
7150481 CIFC10 H12 N4 O4P -15.9847; 7.3833; 12.375
94.29; 95.28; 91.8		542.6Crampton, Michael R.; Emokpae, Thomas A.; Howard, Judith A. K.; Isanbor, Chukwuemeka; Mondal, Raju
Kinetic and equilibrium studies of σ-adduct formation and nucleophilic substitution in the reactions of 2-phenoxy-3,5-dinitropyridine and 2-ethoxy-3,5-dinitropyridine with aliphatic amines in dipolar aprotic solventsElectronic supplementary information (ESI) available: Tables 10‒15. See http://www.rsc.org/suppdata/ob/b2/b211639c/
Organic & Biomolecular Chemistry, 2003, 1, 1004
7151469 CIFC10 H15 Br Cl N O4P 21 21 216.9448; 20.84; 30.325
90; 90; 90		4388.9Paul J. Dransfield; Paul M. Gore; Ivan Prokeš; Michael Shipman; Alexandra M. Z. Slawin
Preparation and reactivity of imino glycals: stereocontrolled, divergent approach to imino sugars
Org. Biomol. Chem., 2003, 1, 2723-2733
7150455 CIFC10 H16 OP 21 21 215.9714; 20.5466; 22.5632
90; 90; 90		2768.32Amelia García Fraile; David G. Morris; Antonio García Martínez; Santiago de la Moya Cerero; Kenneth W. Muir; Karl S. Ryder; Enrique Teso Vilar
Self-recognition and hydrogen bonding by polycyclic bridgehead monoalcohols
Org. Biomol. Chem., 2003, 1, 700-704
7150456 CIFC10 H16 OP 41 21 210.7633; 10.7633; 31.3398
90; 90; 90		3630.67Amelia García Fraile; David G. Morris; Antonio García Martínez; Santiago de la Moya Cerero; Kenneth W. Muir; Karl S. Ryder; Enrique Teso Vilar
Self-recognition and hydrogen bonding by polycyclic bridgehead monoalcohols
Org. Biomol. Chem., 2003, 1, 700-704
7151408 CIFC10 H22 N4 O4 S2P 1 21/c 118.475; 18.445; 9.443
90; 90; 90		3217.9Simonov, Yurii A.; Fonari, Marina S.; Zaworotko, Michael J.; Abourahma, Heba; Lipkowski, Janusz; Ganin, Edward V.; Yavolovskii, Arkadii A.
From 1D strands to extended molecular assemblies in the binary compounds of dithiooxamide and dithiobiurea with crown ethers
Organic & Biomolecular Chemistry, 2003, 1, 2922
7151489 CIFC10 H7 Br N2P 1 21/c 16.271; 21.359; 6.932
90; 108.27; 90		881.7Hughes, Gregory; Wang, Changsheng; Batsanov, Andrei S.; Fern, Michael; Frank, Stephen; Bryce, Martin R.; Perepichka, Igor F.; Monkman, Andrew P.; Lyons, Benjamin P.
New pyrimidine- and fluorene-containing oligo(arylene)s: synthesis, crystal structures, optoelectronic properties and a theoretical study Electronic supplementary information (ESI) available: experimental synthetic procedures for compounds 4, 9 and 10; HF/6?31G(d,p) and B3LYP/6?31G(d,p) calculated geometries and frontier orbitals for compounds 13E, 14E and 16E?21E. See http://www.rsc.org/suppdata/ob/b3/b305870k/
Organic & Biomolecular Chemistry, 2003, 1, 3069
7151530 CIFC108 H86 Cl16 N6 O12P 1 21/n 118.487; 15.093; 19.312
90; 94.823; 90		5369.4Uno, Hidemitsu; Inoue, Kentarou; Inoue, Takashi; Ono, Noboru
Oligocyclization of 2-(hydroxymethyl)pyrroles with electron-withdrawing groups at ?-positions: formation and structural elucidation of porphyrinogens and hexaphyrinogensElectronic Supporting Information Available: Ortep drawings of 3d�2EtOH, 3d�2DMF, 3e, 3e�2H2O, 3g�2(i-PrOH), 3g�2DMF�2CHCl3, 4a�4CHCl3, 4a�4PhCl, 5a�2PhCl, 5d, 5d��PhCl, and 5e; packing diagrams of 5d and 5d��PhCl; and their X-ray analyses data in CIF format. See http://www.rsc.org/suppdata/ob/b3/b307132d/
Organic & Biomolecular Chemistry, 2003, 1, 3857
7151531 CIFC108 H86 Cl16 N6 O12P 1 21/n 118.487; 15.093; 19.312
90; 94.823; 90		5369.4Uno, Hidemitsu; Inoue, Kentarou; Inoue, Takashi; Ono, Noboru
Oligocyclization of 2-(hydroxymethyl)pyrroles with electron-withdrawing groups at ?-positions: formation and structural elucidation of porphyrinogens and hexaphyrinogensElectronic Supporting Information Available: Ortep drawings of 3d�2EtOH, 3d�2DMF, 3e, 3e�2H2O, 3g�2(i-PrOH), 3g�2DMF�2CHCl3, 4a�4CHCl3, 4a�4PhCl, 5a�2PhCl, 5d, 5d��PhCl, and 5e; packing diagrams of 5d and 5d��PhCl; and their X-ray analyses data in CIF format. See http://www.rsc.org/suppdata/ob/b3/b307132d/
Organic & Biomolecular Chemistry, 2003, 1, 3857
7151384 CIFC109 H114 Br4 O7C 1 2/c 132.85; 13.692; 47.55
90; 98.546; 90		21150Matthews, Susan E.; Felix, Vitor; Drew, Michael G. B.; Beer, Paul D.
Halo-Derivatised Calix[4]tubes
Organic & Biomolecular Chemistry, 2003, 1, 1232
7151471 CIFC11 H13 Cl N2 OP -17.348; 8.642; 9.832
103.7; 109.61; 97.53		556.1Ebner, Sieglinde; Wallfisch, Bianca; Andraos, John; Aitbaev, Ilyas; Kiselewsky, Michael; Bernhardt, Paul V.; Kollenz, Gert; Wentrup, Curt
N-Aminopyrroledione?hydrazonoketene?pyrazolium oxide?pyrazolone rearrangements and pyrazolone tautomerismElectronic supplementary information (ESI) available: calculated and observed IR spectra of 8a and X-ray structure, packing diagram, bond lengths and angles for compound 14. See http://www.rsc.org/suppdata/ob/b3/b304070d
Organic & Biomolecular Chemistry, 2003, 1, 2550
7151456 CIFC11 H14 S2P 1 21/c 113.5954; 9.5961; 9.123
90; 108.318; 90		1129.9Schulte, J. Hilko; Werz, Daniel B.; Rominger, Frank; Gleiter, Rolf
Syntheses and solid state structures of cyclic diynes with two chalcogen centres ? a competition between weak interactions
Organic & Biomolecular Chemistry, 2003, 1, 2788
7151457 CIFC11 H14 S2I -420.021; 20.021; 5.685
90; 90; 90		2278.8Schulte, J. Hilko; Werz, Daniel B.; Rominger, Frank; Gleiter, Rolf
Syntheses and solid state structures of cyclic diynes with two chalcogen centres ? a competition between weak interactions
Organic & Biomolecular Chemistry, 2003, 1, 2788
7151463 CIFC11 H14 Se2P -415.4224; 15.4224; 4.8824
90; 90; 90		1161.3Schulte, J. Hilko; Werz, Daniel B.; Rominger, Frank; Gleiter, Rolf
Syntheses and solid state structures of cyclic diynes with two chalcogen centres ? a competition between weak interactions
Organic & Biomolecular Chemistry, 2003, 1, 2788
7151497 CIFC11 H16 N4 OP 1 21/a 110.483; 9.356; 12.297
90; 101.14; 90		1183.4Blake, Alexander J.; Clarke, David; Mares, Richard W.; McNab, Hamish
Synthesis and chemistry of 3-tert-butyl-1,5-diaminopyrazole.
Organic & biomolecular chemistry, 2003, 1, 4268-4274
7151588 CIFC11 H16 O2P 1 21/n 17.0166; 10.5703; 13.7222
90; 102.88; 90		992.13Hue, Bui T. B.; Dijkink, Jan; Kuiper, Sanne; Larson, Kimberly K.; Guziec, Jr, Frank S; Goubitz, Kees; Fraanje, Jan; Schenk, Henk; van Maarseveen, Jan H.; Hiemstra, Henk
Synthesis of the cyclobutanone core of solanoeclepin A intramolecular allene butenolide photocycloaddition.
Organic & biomolecular chemistry, 2003, 1, 4364-4366
7151454 CIFC11 H18 O3 SP b c a9; 9.594; 26.225
90; 90; 90		2264.4Spiniello, Marisa; White, Jonathan M.
Low-temperature X-ray structural studies of the ester and ether derivatives of cis- and trans-4-tert-butyl cyclohexanol and 2-adamantanol: application of the variable oxygen probe to determine the relative ?-donor ability of C?H and C?C bonds
Organic & Biomolecular Chemistry, 2003, 1, 3094
7151507 CIFC112 H111 Cl3 N6 Si3P 1 21/a 132.9322; 8.629; 36.665
90; 99.019; 90		10290.3Krivokapic, Alexander; Anderson, Harry L.
Synthesis and crystal structure of a meso-trialkynyl-[28]hexaphyrinThis is one of a number of contributions from the current members of the Dyson Perrins Laboratory to mark the end of almost 90 years of organic chemistry research in that building, as all its current academic staff move across South Parks Road to a new purpose-built laboratory.
Organic & Biomolecular Chemistry, 2003, 1, 3639

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