Crystallography Open Database
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Searching space group like 'P 21 21 21'
| COD ID: 1000001 | |
| CIF file | Formula: - C107 H142 N14 O26 - Comments: Bachet, Bernard; Soyer, Alain; Billy, Isabelle; Mornon, Jean-Paul Pristinamycin complex solved using Shake-and-Bake () Space group: P 21 21 21 Cell volume: 11309.1 Cell parameters: 48.48; 21.72; 10.74; 90; 90; 90; |
| COD ID: 1000006 | |
| CIF file | Formula: - C22 H25 Cl N2 O8 - Comments: Armel Le Bail Personal Communication to COD () Space group: P 21 21 21 Cell volume: 2183.3 Cell parameters: 10.93; 12.7162; 15.7085; 90; 90; 90; |
| COD ID: 1000129 | |
| CIF file | Formula: - Al Ba F5 - Comments: Le Bail, A.; Ferey, G.; Mercier, A.-M.; de Kozak, A.; Samouel, M. Structure determination of β- and γ-BaAlF~5~ by X-ray and neutron powder diffraction: a model for the α→ β ←→ γ transitions Journal of Solid State Chemistry 89 (1990) 282-291 Space group: P 21 21 21 Cell volume: 379.3 Cell parameters: 13.7168; 5.6054; 4.9329; 90; 90; 90; |
| COD ID: 1000136 | |
| CIF file | Formula: - H2 K2 O10 Si3 Ti - Comments: Dadachov, M S; Le Bail, A Structure of zeolitic K2 Ti Si3 O9 . (H2 O) determined ab initio from powder diffraction data European Journal of Solid State Inorganic Chemistry 34 (1997) 381-390 Space group: P 21 21 21 Cell volume: 915.1 Cell parameters: 7.1362; 9.9084; 12.9414; 90; 90; 90; |
| COD ID: 1000306 | |
| CIF file | Formula: - F6 Fe Na Sr - Comments: Hemon, A.; Courbion, G. Synthesis and crystal structures of β-NaSrCrF~6~ and NaSrFeF~6~. Structural correlations with A~2~MF~6~ compounds European Journal of Solid State and Inorganic Chemistry 29 (1992) 519-531 Space group: P 21 21 21 Cell volume: 522.5 Cell parameters: 5.4053; 9.3103; 10.3823; 90; 90; 90; |
| COD ID: 1000349 | |
| CIF file | Formula: - F0.5 Ga H4.43 N0.93 O4.57 P - Comments: Ferey, G; Loiseau, T; Lacorre, P; Taulelle, F Oxyfluorinated microporous compounds. I. Crystal structure of (NH~4~)~0.93~(H~3~O)~0.07~GaPO~4~(OH)~0.5~ F~0.5~: reexamination of the structure of AlPO~4~-CJ2 Journal of Solid State Chemistry 105 (1993) 179-190 Space group: P 21 21 21 Cell volume: 932.8 Cell parameters: 9.593; 9.742; 9.981; 90; 90; 90; |
| COD ID: 1000350 | |
| CIF file | Formula: - Al F0.675 H4.205 N0.88 O4.445 P - Comments: Ferey, G; Loiseau, T; Lacorre, P; Taulelle, F Oxyfluorinated microporous compounds. I. Crystal structure of (NH~4~)~0.93~(H~3~O)~0.07~GaPO~4~(OH)~0.5~ F~0.5~: reexamination of the structure of AlPO~4~-CJ2 Journal of Solid State Chemistry 105 (1993) 179-190 Space group: P 21 21 21 Cell volume: 894.4 Cell parameters: 9.416; 9.563; 9.933; 90; 90; 90; |
| COD ID: 1000488 | |
| CIF file | Formula: - Al2 F2 O8 P2 Sr - Comments: Le Meins, J.-M.; Courbion, G. Hydrothermal synthesis and crystal structure of SrAl~2~(PO~4~)~2~F~2~: a new three-dimensional framework with channels delimited by a helical anionic border European Journal of Solid State and Inorganic Chemistry 35(10-11) (1998) 639-653 Space group: P 21 21 21 Cell volume: 684.5 Cell parameters: 12.026; 12.199; 4.666; 90; 90; 90; |
| COD ID: 1001209 | |
| CIF file | Formula: - O32 P4 W8 - Comments: Giroult, J P; Goreaud, M; Labbe, P H; Raveau, B P~4~ W~8~ O~32~: A mixed-valence tunnel structure built up of Re O~3~ - type slabs connected through P O~4~ tetrahedra Acta Crystallographica B (24,1968-38,1982) 37 (1981) 2139-2142 Space group: P 21 21 21 Cell volume: 602.4 Cell parameters: 5.285; 6.569; 17.351; 90; 90; 90; |
| COD ID: 1001335 | |
| CIF file | Formula: - O11 P W3 - Comments: Labbe, P; Goreaud, M; Raveau, B Monophosphate tungsten bronzes with pentagonal tunnels (P O~2~)~4~ (W O~3~)~2m~: Structure of two even-m members P~4~ W~12~ O~44~ (m=6) and P~4~ W~16~ O~56~ (m=8) Journal of Solid State Chemistry 61 (1986) 324-331 Space group: P 21 21 21 Cell volume: 817.7 Cell parameters: 5.2927; 6.5604; 23.549; 90; 90; 90; |
| COD ID: 1001336 | |
| CIF file | Formula: - O14 P W4 - Comments: Labbe, P; Goreaud, M; Raveau, B Monophosphate tungsten bronzes with pentagonal tunnels (P O~2~)~4~ (W O~3~)~2m~: Structure of two even-m members P~4~ W~12~ O~44~ (m=6) and P~4~ W~16~ O~56~ (m=8) Journal of Solid State Chemistry 61 (1986) 324-331 Space group: P 21 21 21 Cell volume: 1030.5 Cell parameters: 5.2943; 6.5534; 29.7; 90; 90; 90; |
| COD ID: 1001593 | |
| CIF file | Formula: - K O17 P4 V3 - Comments: Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B A new mixed-valence vanadium phosphate with an intersecting tunnel structure: KV~3~P~4~O~17~ Journal of Solid State Chemistry 97 (1992) 131-140 Space group: P 21 21 21 Cell volume: 1281.1 Cell parameters: 7.8654; 10.0104; 16.2715; 90; 90; 90; |
| COD ID: 1001821 | |
| CIF file | Formula: - O80 P4 W24 - Comments: Roussel, P; Mather, G; Domenges, B; Groult, D; Labbe, P Structural investigation of P4 W24 O80: A new monophosphate tungsten bronze Acta Crystallographica B (39,1983-) 54 (1998) 365-375 Space group: P 21 21 21 Cell volume: 1469.4 Cell parameters: 5.312; 6.5557; 42.196; 90; 90; 90; |
| COD ID: 1004030 | |
| CIF file | Formula: - C5 H17 N O10 P2 Zn - Comments: Simon, A.; Josien, L.; Gramlich, V.; Patarin, J. Synthesis and characterization of Mu-19, a new zincophosphate with a three dimensional 12-membered ring channel system Microporous and Mesoporous Materials 47(2-3) (2001) 135-146 Space group: P 21 21 21 Cell volume: 1341.4 Cell parameters: 9.976; 10.359; 12.98; 90; 90; 90; |
| COD ID: 1004043 | |
| CIF file | Formula: - Al Cl4 Na - Comments: Mairesse, G; Barbier, P; Wignacourt, J P Comparison of the crystal structures of alkaline (M = Li, Na, K, Rb, Cs) and Pseudo-alkaline (M = N O, N H~4~) Tetrachloroaluminates, M Al Cl~4~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1573-1580 Space group: P 21 21 21 Cell volume: 675.2 Cell parameters: 9.886; 6.617; 10.322; 90; 90; 90; |
| COD ID: 1004059 | |
| CIF file | Formula: - Al Cl4 Na - Comments: Wallart, F; Lorriaux-Rubbens, A; Mairesse, G; Barbier, P; Wignacourt, J P Etude Structurale du Tetrachloroaluminate de Sodium: Comparaison des Spectres de Diffusion Raman de la Famille des M Al Cl~4~ (M= Li, Na, K, Rb, Cs, NO, NH~4~) a l'Etat Solide Journal of Raman Spectroscopy 9 (1980) 55-61 Space group: P 21 21 21 Cell volume: 629.3 Cell parameters: 10.322; 9.886; 6.167; 90; 90; 90; |
| COD ID: 1004069 | |
| CIF file | Formula: - Al Cl4 Na - Comments: Wallart, F; Lorriaux-Rubbens, A; Mairesse, G; Barbier, P; Wignacourt, J P Etude structurale du tetrachloroaluminate de sodium. Comparaison des spectres de diffusion raman de la famille des M Al Cl~4~ (M=Li, Na, K, Rb, Cs, No, Nh~4~,) a l'etat solide Journal of Raman Spectroscopy 9 (1980) 55-61 Space group: P 21 21 21 Cell volume: 629.3 Cell parameters: 10.322; 9.886; 6.167; 90; 90; 90; |
| COD ID: 1004124 | |
| CIF file | Formula: - B3 O5 Tl - Comments: Touboul, M; Betourne, E; Nowogrocki, G Crystal structure of thallium triborate, Tl B3 O5 Journal of Solid State Chemistry 131 (1997) 370-373 Space group: P 21 21 21 Cell volume: 438.6 Cell parameters: 5.2099; 8.248; 10.206; 90; 90; 90; |
| COD ID: 1005021 | |
| CIF file | Formula: - Ba5 N6 Si2 - Comments: Yamane, H; DiSalvo, F J Preparation and crystal structure of a new barium silicon nitride, Ba5 Si2 N6 Journal of Alloys Compd. 240 (1996) 33-36 Space group: P 21 21 21 Cell volume: 970.6 Cell parameters: 6.159; 10.305; 15.292; 90; 90; 90; |
| COD ID: 1007050 | |
| CIF file | Formula: - Ba O6 P2 - Comments: Grenier, J C; Martin, C; Durif, A; Tranqui, D; Guitel, J C Une nouvelle forme du metaphosphate de baryum Ba (P O~3~)~2~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 90 (1967) 24-31 Space group: P 21 21 21 Cell volume: 506.7 Cell parameters: 4.51; 13.44; 8.36; 90; 90; 90; |
| COD ID: 1007151 | |
| CIF file | Formula: - Hg K O9 P3 - Comments: Averbuch-Pouchot, M T; Durif, A Structure of mercury potassium trimetaphosphate Acta Crystallographica C (39,1983-) 42 (1986) 930-931 Space group: P 21 21 21 Cell volume: 782 Cell parameters: 11.164; 12.46; 5.622; 90; 90; 90; |
| COD ID: 1007221 | |
| CIF file | Formula: - C4 H28 Cl N12 O6 P - Comments: Averbuch-Pouchot, M.-T.; Durif, A. Synthesis and crystal structure of an adduct between guanidinium monophosphate and guanidinium chloride: [C(NH2)3]3PO4 · [C(NH2)3]Cl · 2H2O Comptes Rendus de l'Academie des Sciences, Serie II: Mecanique, Physique, Chimie, Sciences de la Terre et de l'Univers 317(9) (1993) 1179-1184 Space group: P 21 21 21 Cell volume: 1944.5 Cell parameters: 14.038; 13.906; 9.961; 90; 90; 90; |
| COD ID: 1007241 | |
| CIF file | Formula: - Cu Li O9 P3 - Comments: Laugt, M; Durif, A Etude systematique des phosphates condenses Seminaire de Chimie de l'Etat Solide 1971-72 1972 (1972) 157-175 Space group: P 21 21 21 Cell volume: 614.4 Cell parameters: 8.703; 8.197; 8.613; 90; 90; 90; |
| COD ID: 1007263 | |
| CIF file | Formula: - Be K O9 P3 - Comments: Durif, A; Averbuch-Pouchot, M T; Guitel, J C Crystal structure of a beryllium-potassium polyphosphate: Be K (P O3)3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 177 (1986) 139-142 Space group: P 21 21 21 Cell volume: 770.9 Cell parameters: 7.855; 8.61; 11.399; 90; 90; 90; |
| COD ID: 1008047 | |
| CIF file | Formula: - Fe H0.5 O6 V2 - Comments: Muller, J; Joubert, J C; Marezio, M Synthese et structure cristalline d'un nouvel oxyde mixte Fe V~2~ O~6~ H~0.5~. Relation avec la structure type Diaspore Journal of Solid State Chemistry 27 (1979) 367-382 Space group: P 21 21 21 Cell volume: 410.5 Cell parameters: 4.891; 9.553; 8.786; 90; 90; 90; |
| COD ID: 1008552 | |
| CIF file | Formula: - Cs2 O8 P2 Ti - Comments: Protas, J; Menaert, B; Marnier, G; Boulanger, B Structure cristalline de Cs~2~TiO(P~2~O~7~) Acta Crystallographica C (39,1983-) 47 (1991) 698-701 Space group: P 21 21 21 Cell volume: 933 Cell parameters: 7.275; 9.452; 13.569; 90; 90; 90; |
| COD ID: 1010147 | |
| CIF file | Formula: - As Br3 - Comments: Braekken, H Die Kristallstruktur von Arsen- und Antimontribromid Kongelige Norske Videnskapers Selskab, Forhandlinger 8 (1935) 3-3 Space group: P 21 21 21 Cell volume: 528 Cell parameters: 10.15; 12.07; 4.31; 90; 90; 90; |
| COD ID: 1010763 | |
| CIF file | Formula: - As2 Pb S4 - Comments: Peacock, M A; Berry, L G Roentgenographic observations on ore minerals University of Toronto Studies, Geological Series 44 (1940) 47-69 Space group: P 21 21 21 Cell volume: 635.4 Cell parameters: 19.48; 4.15; 7.86; 90; 90; 90; |
| COD ID: 1011223 | |
| CIF file | Formula: - H2 O2 Zn - Comments: Corey, R B; Wyckoff, R W G The crystal structure of zinc hydroxide Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 86 (1933) 8-18 Space group: P 21 21 21 Cell volume: 216.6 Cell parameters: 5.16; 8.53; 4.92; 90; 90; 90; |
| COD ID: 1011297 | |
| CIF file | Formula: - H14 Ni O11 S - Comments: Beevers, C A; Schwartz, C M The crystal structure of nickel sulphate heptahydrate Ni S O4 (H2 O)7 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 91 (1935) 157-169 Space group: P 21 21 21 Cell volume: 975.7 Cell parameters: 11.86; 12.08; 6.81; 90; 90; 90; |
| COD ID: 1100089 | |
| CIF file | Formula: - H14 Mg O11 S - Comments: Ferraris, Giovanni; Jones, Derry W.; Yerkess, Jack Refinement of the crystal structure of magnesium sulphate heptahydrate (epsomite) by neutron diffraction Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999) 1973(8) (1973) 816-821 Space group: P 21 21 21 Cell volume: 976.2 Cell parameters: 11.868; 11.996; 6.857; 90; 90; 90; |
| COD ID: 1100091 | |
| CIF file | Formula: - H14 Mg O11 S - Comments: Baur, W H On the Crystal Chemistry of Salt Hydrates. IV. The Refinement of the Crystal Structure of Mg S O4 (H2 O)7 (Epsomite) Acta Crystallographica (1,1948-23,1967) 17 (1964) 1361-1369 Space group: P 21 21 21 Cell volume: 976.2 Cell parameters: 11.868; 11.996; 6.857; 90; 90; 90; |
| COD ID: 1100101 | |
| CIF file | Formula: - H14 Mg O11 S - Comments: Calleri, M.; Gavetti, A.; Ivaldi, G.; Rubbo, M. Synthetic epsomite, MgSO~4~ . 7H~2~O: absolute configuration and surface features of the complementary {111} forms Acta Crystallographica Section B 40(3) (1984) 218-222 Space group: P 21 21 21 Cell volume: 979.7 Cell parameters: 11.887; 12.013; 6.861; 90; 90; 90; |
| COD ID: 1100173 | |
| CIF file | Formula: - C15 H22 N2 O4 - Comments: Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone European Journal of Organic Chemistry 1999(11) (1999) 2977-2990 Space group: P 21 21 21 Cell volume: 1561.53 Cell parameters: 9.3531; 10.5002; 15.9; 90; 90; 90; |
| COD ID: 1100183 | |
| CIF file | Formula: - C23 H39 Cl2 N O3 - Comments: T.Bach; H.Bergmann; K.Harms Angew.Chem.,Int.Ed.Engl. 39 (2000) 2302 Space group: P 21 21 21 Cell volume: 2489.76 Cell parameters: 8.52; 12.123; 24.105; 90; 90; 90; |
| COD ID: 1100189 | |
| CIF file | Formula: - C22 H28.66 N2 O2.33 - Comments: Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405 Space group: P 21 21 21 Cell volume: 1994.28 Cell parameters: 7.6041; 15.9342; 16.4592; 90; 90; 90; |
| COD ID: 1100190 | |
| CIF file | Formula: - C22 H28.66 N2 O2.33 - Comments: Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405 Space group: P 21 21 21 Cell volume: 2021.41 Cell parameters: 7.6183; 16.092; 16.4887; 90; 90; 90; |
| COD ID: 1100208 | |
| CIF file | Formula: - C6 H17 I N P - Comments: Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allgemeine Chemie 626(3) (2000) 775-783 Space group: P 21 21 21 Cell volume: 1104.03 Cell parameters: 7.121; 12.333; 12.571; 90; 90; 90; |
| COD ID: 1100249 | |
| CIF file | Formula: - C21 H29 N O3 - Comments: Bach, Thorsten; Bergmann, Hermann; Harms, Klaus Enantioselective Photochemical Reactions of 2-Pyridones in Solution Organic Letters 3(4) (2001) 601-603 Space group: P 21 21 21 Cell volume: 1889.88 Cell parameters: 7.2624; 8.541; 30.4681; 90; 90; 90; |
| COD ID: 1100250 | |
| CIF file | Formula: - C28 H50 O8 - Comments: K.Harms Private Communication (2002) Space group: P 21 21 21 Cell volume: 2932.32 Cell parameters: 10.0153; 16.3832; 17.871; 90; 90; 90; |
| COD ID: 1100264 | |
| CIF file | Formula: - C13 H13 N O S - Comments: Reichardt, Christian; Erfurt, Hans-Peter; Harms, Klaus; Schäfer, Gerhard Syntheses, Absolute Configurations, and UV/Vis Spectroscopic Properties of New Chiral Tri- and Pentamethinium Streptocyanine Dyes with 4-Aminophenyl 4-Methylphenyl Sulfoxide Endgroups European Journal of Organic Chemistry 2002(3) (2002) 439-452 Space group: P 21 21 21 Cell volume: 1197.99 Cell parameters: 5.753; 8.297; 25.098; 90; 90; 90; |
| COD ID: 1100277 | |
| CIF file | Formula: - C19 H24 O8 - Comments: Harms, K.; Sheldrick, G. M.; Glüsenkamp, K.-H.; Tietze, L.-F. An enantiospecific hetero Diels-Alder product Acta Crystallographica, Section C: Crystal Structure Communications 42(9) (1986) 1268-1269 Space group: P 21 21 21 Cell volume: 1861.71 Cell parameters: 6.056; 14.434; 21.298; 90; 90; 90; |
| COD ID: 1100282 | |
| CIF file | Formula: - C31 H32 O7 - Comments: Harms, K.; Sheldrick, G. M.; Glüsenkamp, K. H.; Tietze, L. F. Structure of a photolysis product Acta Crystallographica, Section C: Crystal Structure Communications 42(9) (1986) 1269-1271 Space group: P 21 21 21 Cell volume: 2758.38 Cell parameters: 8.424; 14.773; 22.165; 90; 90; 90; |
| COD ID: 1100284 | |
| CIF file | Formula: - C16 H16 N2 O4 - Comments: Harms, K.; Sheldrick, G. M.; Tietze, L.-F. Stereochemistry of a hetero-Diels-Alder product Acta Crystallographica, Section C: Crystal Structure Communications 42(11) (1986) 1664-1665 Space group: P 21 21 21 Cell volume: 1424.8 Cell parameters: 7.779; 9.332; 19.627; 90; 90; 90; |
| COD ID: 1100292 | |
| CIF file | Formula: - C11 H14 O5 - Comments: Harms, K.; Jones, P. G.; Sheldrick, G. M.; Tietze, L. F.; Uzar, H. C. Methyl (1S,5S,6S,7R)-6-formyl-7-methyl-2,8-dioxabicyclo[3.3.1]non-3-ene-4-carboxylate Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry 36(12) (1980) 3156-3157 Space group: P 21 21 21 Cell volume: 1100.18 Cell parameters: 8.116; 9.684; 13.998; 90; 90; 90; |
| COD ID: 1100309 | |
| CIF file | Formula: - C9 H20 Cl N O - Comments: Harms, K.; Sheldrick, G. M.; Fischer, R.; Tietze, L. F. [(1RS,2RS,3SR)-3-Hydroxy-2-methylcyclopentyl]trimethylammonium chloride Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry 36(12) (1980) 3206-3208 Space group: P 21 21 21 Cell volume: 1061.93 Cell parameters: 7.44; 11.609; 12.295; 90; 90; 90; |
| COD ID: 1100312 | |
| CIF file | Formula: - C56 H64 Li2 N2 O2 - Comments: Ahlbrecht, Hubertus; Boche, Gernot; Harms, Klaus; Marsch, Michael; Sommer, Horst Chirale Homoenolat-Äquivalente, IV. Kristallstruktur einer chiralen 1-Aminoallyllithium-Verbindung: dimeres, intramolekular chelatisiertes (3S)-3-Lithio-1-[(S)-2-(methoxymethyl)pyrrolidino]-1,3-diphenylpropen Chemische Berichte 123(9) (1990) 1853-1858 Space group: P 21 21 21 Cell volume: 4836.71 Cell parameters: 15.141; 15.338; 20.827; 90; 90; 90; |
| COD ID: 1100314 | |
| CIF file | Formula: - C20 H28 N2 O4 - Comments: Priepke, Henning; Brückner, Reinhard; Harms, Klaus Asymmetric Induction in the Wittig-Still Rearrangement of Ethers Containing an Allylic Stereocenter ‒ Diastereocontrol by Allylic Nitrogen Chemische Berichte 123(3) (1990) 555-563 Space group: P 21 21 21 Cell volume: 2004.72 Cell parameters: 9.939; 8.52; 23.674; 90; 90; 90; |
| COD ID: 1100319 | |
| CIF file | Formula: - C12 H16 Cl4 O2 Sn - Comments: Reetz, M. T.; Harms, K.; Reif, W. An X-ray structural analysis of a chiral α-alkoxy-ketone/SnCl~4~ chelate Tetrahedron Letters 29(46) (1988) 5881-5884 Space group: P 21 21 21 Cell volume: 1702.14 Cell parameters: 9.695; 12.819; 13.696; 90; 90; 90; |
| COD ID: 1100324 | |
| CIF file | Formula: - C53 H71 Co N6 O14 - Comments: Battersby, A. R.; Grgurina, I.; Raithby, P. R.; Egert, E.; Harms, K.; Sheldrick, G. M. Structure of dicyano-15-norcobyrinic acid heptamethyl ester Acta Crystallographica, Section C: Crystal Structure Communications 45(10) (1989) 1589-1593 Space group: P 21 21 21 Cell volume: 5539.3 Cell parameters: 15.595; 18.672; 19.023; 90; 90; 90; |
| COD ID: 1100329 | |
| CIF file | Formula: - C28 H44 Li N3 O - Comments: Boche, Gernot; Marsch, Michael; Harbach, Jürgen; Harms, Klaus; Ledig, Burkhard; Schubert, Frank; Lohrenz, John C. W.; Ahlbrecht, Hubertus [α-(Dimethylamino)benzyllithium‒Diethyl Ether]~2~, (S)-α-(Methylpivaloylamino)benzyllithium ‒ (‒)-Sparteine, and [3-Iodo-2-lithio-1-methylindole ‒ 2 Tetrahydrofuran]~2~: Crystal Structure Investigations of α-Lithiated Amines Chemische Berichte 126(8) (1993) 1887-1894 Space group: P 21 21 21 Cell volume: 2598.47 Cell parameters: 9.466; 12.907; 21.268; 90; 90; 90; |
| COD ID: 1100341 | |
| CIF file | Formula: - C26 H46 N5 Na O - Comments: Hiller, Wolfgang; Frey, Stephanie; Strähle, Joachim; Boche, Gernot; Zarges, Wolfgang; Harms, Klaus; Marsch, Michael; Wollert, René; Dehnicke, Kurt Die Kristallstrukturen von {Li~3~(12-Krone-4)~2~[HC(CN)~2~]~3~}, {Na(15-Krone-5)-[HC(CN)~2~]} und {Na[N(nBu)~4~][HC(CN)~2~]~2~ · THF} Chemische Berichte 125(1) (1992) 87-92 Space group: P 21 21 21 Cell volume: 2902.78 Cell parameters: 13.312; 13.874; 15.717; 90; 90; 90; |
| COD ID: 1100352 | |
| CIF file | Formula: - C22 H26 N2 O3 - Comments: Reetz, Manfred T.; Kayser, Frank; Harms, Klaus Cycloaddition reactions of λ-amino α,β-didehydro amino acid esters: a test case for the principle of 1,3-allylic strain Tetrahedron Letters 33(24) (1992) 3453-3456 Space group: P 21 21 21 Cell volume: 2071.62 Cell parameters: 9.095; 10.164; 22.41; 90; 90; 90; |
| COD ID: 1100353 | |
| CIF file | Formula: - C20 H38 N2 O5 - Comments: Reetz, Manfred T.; Kanand, Jürgen; Griebenow, Nils; Harms, Klaus Stereoselective Nucleophilic Addition Reactions of Reactive Pseudopeptides Angewandte Chemie, International Edition in English 31(12) (1992) 1626-1629 Space group: P 21 21 21 Cell volume: 2338.26 Cell parameters: 11.137; 11.26; 18.646; 90; 90; 90; |
| COD ID: 1100357 | |
| CIF file | Formula: - C28 H51 Li N3 O2 Si - Comments: Marsch, Michael; Harms, Klaus; Zschage, Oliver; Hoppe, Dieter; Boche, Gernot η^1^-(1S, 2E)-1-(N,N-diisopropylcarbamoyloxy)-3-trimethylsilylallyllithium(—)-Sparteine: Structure of a Chiral, Carbamoyloxy-substituted Allyllithium Compound Angewandte Chemie, International Edition in English 30(3) (1991) 321-323 Space group: P 21 21 21 Cell volume: 3055.39 Cell parameters: 11.886; 13.827; 18.591; 90; 90; 90; |
| COD ID: 1100379 | |
| CIF file | Formula: - C26 H28 N2 O2 - Comments: Reetz, Manfred T.; Röhrig, Dirk; Harms, Klaus; Frenking, Gernot Stereoselective synthesis of β-amino hydroxylamines Tetrahedron Letters 35(47) (1994) 8765-8768 Space group: P 21 21 21 Cell volume: 4543.77 Cell parameters: 10.31; 18.718; 23.545; 90; 90; 90; |
| COD ID: 1100382 | |
| CIF file | Formula: - C28 H41 Li N2 - Comments: Hoppe, Inga; Marsch, Michael; Harms, Klaus; Boche, Gernot; Hoppe, Dieter Generation of Enantiomerically Enriched Lithium Indenides by Means of(‒)-Sparteine: Structure, Stereoselective Substitution, and Solvent Effects Angewandte Chemie, International Edition in English 34(19) (1995) 2158-2160 Space group: P 21 21 21 Cell volume: 2418.19 Cell parameters: 10.966; 11.597; 19.015; 90; 90; 90; |
| COD ID: 1100388 | |
| CIF file | Formula: - C8 H4 Cl N O2 - Comments: Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt; Magull, Jörg μ~2~-Chlorokomplexe von Succinimid und N-Chlorsuccinimid. Die Kristallstrukturen von PPh~4~[Cl(Succinimid)~2~], PPh~4~[[Cl(N-Cl-Succinimid)~2~] und N-Chlorphthalimid / μ~2~-Chloro Complexes of Succinimide and N-Chlorosuccinimide. The Crystal Structures of PPh~4~[Cl(Succinimide)~2~], PPh~4~[Cl(N-Cl-Succinimide)~2~] and N-Chlorophthalimide} Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 49(4) (1994) 506-512 Space group: P 21 21 21 Cell volume: 744.92 Cell parameters: 5.728; 6.275; 20.725; 90; 90; 90; |
| COD ID: 1100403 | |
| CIF file | Formula: - C29 H35 Li O2 - Comments: Dem'yanov, Piotr; Boche, Gernot; Marsch, Michael; Harms, Klaus; Fyodorova, Galina; Petrosyan, Valery Crystal Structure of η^3^-lithio-1,3,3-triphenylpropyne-(diethyl ether)~2~ and [1-lithio-1-(2-methoxyphenyl)-3,3-diphenylallene‒diethyl ether]~2~: Propargyl- versus allenyl-type structures Liebigs Annalen 1995(3) (1995) 457-460 Space group: P 21 21 21 Cell volume: 2506.27 Cell parameters: 7.601; 17.345; 19.01; 90; 90; 90; |
| COD ID: 1100409 | |
| CIF file | Formula: - C76 H64 O4 P4 Pd - Comments: Bolm, Carsten; Kaufmann, Daniel; Gessler, Simon; Harms, Klaus Crystal structure of a new chiral Pd(0) / diphosphine complex and its use in enantioselective allylic alkylations Journal of Organometallic Chemistry 502(1-2) (1995) 47-52 Space group: P 21 21 21 Cell volume: 6212.31 Cell parameters: 12.614; 21.611; 22.789; 90; 90; 90; |
| COD ID: 1100416 | |
| CIF file | Formula: - C17 H26 N2 O - Comments: () Space group: P 21 21 21 Cell volume: 1639.72 Cell parameters: 9.109; 9.436; 19.077; 90; 90; 90; |
| COD ID: 1100418 | |
| CIF file | Formula: - C23 H36 Cl2 O6 P2 Sn - Comments: Grigoriev, E. V.; Yashina, N. S.; Prischenko, A. A.; Livantsov, M. V.; Petrosyan, V. S.; Massa, W.; Harms, K.; Wocadlo, S.; Pellerito, L. Organotin(IV) complexes with tetraethyl ethylene- and propylene-diphosphonates Applied Organometallic Chemistry 9(1) (1995) 11-22 Space group: P 21 21 21 Cell volume: 2918.13 Cell parameters: 12.78; 13.9; 16.427; 90; 90; 90; |
| COD ID: 1100428 | |
| CIF file | Formula: - C28 H26 N2 O5 S2 V - Comments: Bolm, Carsten; Bienewald, Frank; Harms, Klaus Syntheses and Vanadium Complex of Salen-like Bissulfoximines Synlett 1996(8) (1996) 775-776 Space group: P 21 21 21 Cell volume: 2614.44 Cell parameters: 11.348; 12.175; 18.923; 90; 90; 90; |
| COD ID: 1100442 | |
| CIF file | Formula: - C12 H21 N O3 - Comments: Aurich, Hans Günter; Biesemeier, Frank; Geiger, Michael; Harms, Klaus Bicyclic and Tricyclic Compounds with β-Amino Alcohol Groups as Chiral Ligands in the Enantioselective Reaction of Diethylzinc with Aldehydes Liebigs Annalen/Recueil 1997(2) (1997) 423-434 Space group: P 21 21 21 Cell volume: 1205.86 Cell parameters: 5.291; 13.453; 16.941; 90; 90; 90; |
| COD ID: 1100448 | |
| CIF file | Formula: - C22 H24 N2 O5 V - Comments: Boln, Carsten; Luong, Thi Kim Khanh; Harms, Klaus Bis[2-(oxazolinyl)phenolato]oxovanadium(IV) Complexes: Syntheses, Crystal Structures and Catalyses Chemische Berichte/Recueil 130(7) (1997) 887-890 Space group: P 21 21 21 Cell volume: 2080.12 Cell parameters: 8.344; 11.263; 22.134; 90; 90; 90; |
| COD ID: 1100449 | |
| CIF file | Formula: - C24 H28 N2 O5 V - Comments: Boln, Carsten; Luong, Thi Kim Khanh; Harms, Klaus Bis[2-(oxazolinyl)phenolato]oxovanadium(IV) Complexes: Syntheses, Crystal Structures and Catalyses Chemische Berichte/Recueil 130(7) (1997) 887-890 Space group: P 21 21 21 Cell volume: 2356.2 Cell parameters: 10.09; 11.779; 19.825; 90; 90; 90; |
| COD ID: 1100450 | |
| CIF file | Formula: - C44 H80 B3 Li O4 Si2 - Comments: Unverzagt, Markus; Subramanian, Govindan; Hofmann, Matthias; von Ragué Schleyer, Paul; Berger, Stefan; Harms, Klaus; Massa, Werner; Berndt, Armin Carbene Analogues of Boron Stabilized by Neighboring B‒B Moieties: Doubly Aromatic Bishomotriboriranides Angewandte Chemie, International Edition in English 36(1314) (1997) 1469-1472 Space group: P 21 21 21 Cell volume: 4997.33 Cell parameters: 11.7956; 19.3126; 21.937; 90; 90; 90; |
| COD ID: 1100462 | |
| CIF file | Formula: - C19 H19 N O - Comments: Hoppe, I.; Hoppe, D.; Marsch, M.; Harms, K.; Boche, G. Crystal structure of (1R)-1-methyl-1-(α-methylbenzyl-carboxamido)-indene, C~19~H~19~NO Zeitschrift für Kristallographie 211(5) (1996) 331-332 Space group: P 21 21 21 Cell volume: 3146.4 Cell parameters: 10.29; 16.86; 18.136; 90; 90; 90; |
| COD ID: 1100489 | |
| CIF file | Formula: - C3 H9 I Pb - Comments: Hillwig, Ralf; Kunkel, Frank; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt Die Kristallstrukturen von Trimethylbleiiodid und Diphenylbismutchlorid / Crystal Structures of Trimethyllead Iodide and Diphenylbismuth Chloride Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 52(1) (1997) 149-152 Space group: P 21 21 21 Cell volume: 759.26 Cell parameters: 6.53; 10.34; 11.245; 90; 90; 90; |
| COD ID: 1100505 | |
| CIF file | Formula: - C40 H71 B2 Li3 O2 Si2 - Comments: Scheschkewitz, David; Menzel, Matthias; Hofmann, Matthias; Schleyer, Paul Ragué; Geiseler, Gertraud; Massa, Werner; Harms, Klaus; Berndt, Armin A Five-Membered Ring with Three Negative Charges and Solvent-Free Lithium Counterions Angewandte Chemie, International Edition 38(19) (1999) 2936-2939 Space group: P 21 21 21 Cell volume: 4378.81 Cell parameters: 14.858; 16.2; 18.192; 90; 90; 90; |
| COD ID: 1100506 | |
| CIF file | Formula: - C33 H36 N O6 P - Comments: Breit, Bernhard; Dauber, Mario; Harms, Klaus Substrate-Directed Diastereoselective Hydroformylation: Key Step for the Assembly of Polypropionate Subunits Chemistry - A European Journal 5(10) (1999) 2819-2827 Space group: P 21 21 21 Cell volume: 3021.54 Cell parameters: 8.919; 15.543; 21.796; 90; 90; 90; |
| COD ID: 1100516 | |
| CIF file | Formula: - C25 H32 N2 O2 - Comments: Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus Formation of enantiopure β-amino alcohols with a 3-oxa-2,7-diazabicyclo[3.3.0]octane framework Tetrahedron 55(5) (1999) 1249-1270 Space group: P 21 21 21 Cell volume: 2248.22 Cell parameters: 6.376; 18.155; 19.422; 90; 90; 90; |
| COD ID: 1100517 | |
| CIF file | Formula: - C22 H26 N2 O2 - Comments: Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus Formation of enantiopure β-amino alcohols with a 3-oxa-2,7-diazabicyclo[3.3.0]octane framework Tetrahedron 55(5) (1999) 1249-1270 Space group: P 21 21 21 Cell volume: 1929.74 Cell parameters: 7.515; 13.748; 18.678; 90; 90; 90; |
| COD ID: 1100530 | |
| CIF file | Formula: - C16 H25 N O3 - Comments: Baskaran, Subramanian; Aurich, Hans Günter; Biesemeier, Frank; Harms, Klaus Effect of the substitution pattern on the oxidation of the isoxazolidine moiety in bi- and tricyclic compounds Tetrahedron 54(40) (1998) 12249-12264 Space group: P 21 21 21 Cell volume: 1522.02 Cell parameters: 7.984; 10.045; 18.978; 90; 90; 90; |
| COD ID: 1100536 | |
| CIF file | Formula: - C18 H19 N O3 - Comments: Bach, Thorsten; Schröder, Jürgen; Brandl, Trixie; Hecht, Jürgen; Harms, Klaus Facial diastereoselectivity in the photocycloaddition of chiral N-acyl enamines to benzaldehyde Tetrahedron 54(18) (1998) 4507-4520 Space group: P 21 21 21 Cell volume: 1538.96 Cell parameters: 6.47; 13.708; 17.352; 90; 90; 90; |
| COD ID: 1100537 | |
| CIF file | Formula: - C19 H21 N O3 - Comments: Bach, Thorsten; Schröder, Jürgen; Brandl, Trixie; Hecht, Jürgen; Harms, Klaus Facial diastereoselectivity in the photocycloaddition of chiral N-acyl enamines to benzaldehyde Tetrahedron 54(18) (1998) 4507-4520 Space group: P 21 21 21 Cell volume: 1687.58 Cell parameters: 6.373; 14.8; 17.892; 90; 90; 90; |
| COD ID: 1100552 | |
| CIF file | Formula: - C27 H29 N O2 - Comments: Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus Formation of Chiral N-Oxides from 2-Azabicyclo[3.3.0]octanes European Journal of Organic Chemistry 1999(5) (1999) 1249-1252 Space group: P 21 21 21 Cell volume: 2054.49 Cell parameters: 5.9843; 15.9963; 21.462; 90; 90; 90; |
| COD ID: 1100580 | |
| CIF file | Formula: - C51 H131 Lu2 N6 Na O6 Si9 - Comments: Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K. Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren Zeitschrift für anorganische und allgemeine Chemie 625(8) (1999) 1301-1309 Space group: P 21 21 21 Cell volume: 8010.3 Cell parameters: 15.423; 19.946; 26.039; 90; 90; 90; |
| COD ID: 1100583 | |
| CIF file | Formula: - C10 H16 N2 O4 - Comments: Baskaran, Subramanian; Aurich, Hans Günter; Biesemeier, Frank; Harms, Klaus Cycloadducts from highly functionalized nitrones and oximes as ligands in the enantioselective addition of diethylzinc to benzaldehyde Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) (issue 22) (1998) 3717-3724 Space group: P 21 21 21 Cell volume: 1095.02 Cell parameters: 5.968; 8.448; 21.719; 90; 90; 90; |
| COD ID: 1100609 | |
| CIF file | Formula: - C22 H54 B3 I3 N5 P3 - Comments: Möhlen, Michael; Neumüller, Bernhard; Harms, Klaus; Krautscheid, Harald; Fenske, Dieter; Diedenhofen, Michael; Frenking, Gernot; Dehnicke, Kurt Tri(phosphorano)borazinium-Ionen Zeitschrift fuer Anorganische und Allgemeine Chemie 624(7) (1998) 1105-1110 Space group: P 21 21 21 Cell volume: 3700.41 Cell parameters: 12.546; 14.113; 20.899; 90; 90; 90; |
| COD ID: 1100634 | |
| CIF file | Formula: - C17 H24 N2 O - Comments: Aurich, Hans Günter; Geiger, Michael; Gentes, Christian; Harms, Klaus; Köster, Heiner Formation of enantiopure tricyclic compounds by intramolecular 1,3-dipolar cycloaddition of nitrones Tetrahedron 54(13) (1998) 3181-3196 Space group: P 21 21 21 Cell volume: 1542.87 Cell parameters: 9.75; 10.525; 15.035; 90; 90; 90; |
| COD ID: 1100645 | |
| CIF file | Formula: - C15 H21 N O4 S - Comments: Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone European Journal of Organic Chemistry 1999(11) (1999) 2977-2990 Space group: P 21 21 21 Cell volume: 1514.29 Cell parameters: 8.0799; 12.969; 14.451; 90; 90; 90; |
| COD ID: 1100646 | |
| CIF file | Formula: - C14 H19 N O4 S - Comments: Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone European Journal of Organic Chemistry 1999(11) (1999) 2977-2990 Space group: P 21 21 21 Cell volume: 1417.39 Cell parameters: 8.455; 11.6555; 14.3828; 90; 90; 90; |
| COD ID: 1100650 | |
| CIF file | Formula: - C8 H8 N2 O2 - Comments: Azumaya, Isao; Okamoto, Iwao; Takayanagi, Hiroaki Spontaneous Optical Resolution of 1,2-Bis(formylamino)benzene in Crystals Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x3-x4 Space group: P 21 21 21 Cell volume: 778 Cell parameters: 14.21; 6.28; 8.73; 90; 90; 90; |
| COD ID: 1100652 | |
| CIF file | Formula: - C28 H50 O3 - Comments: Fujii, Isao; Hirayama, Noriaki Structure of 7-α-hydroxycholesterol Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x7-x8 Space group: P 21 21 21 Cell volume: 2767.6 Cell parameters: 14.5558; 30.2416; 6.2872; 90; 90; 90; |
| COD ID: 1100681 | |
| CIF file | Formula: - C6 H9 N O5 - Comments: Imai, Tokiko; Yoshihiro, Yokoyama; Sekine, Akiko; Uekusa, Hidediro; Ohashi, Yuji The Structure of 2-Amino-2-deoxyascorbic acid and 2-Amino-2-deoxyerythorbic acid Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x65-x66 Space group: P 21 21 21 Cell volume: 726.67 Cell parameters: 8.8162; 16.942; 4.8651; 90; 90; 90; |
| COD ID: 1100682 | |
| CIF file | Formula: - C6 H9 N O5 - Comments: Imai, Tokiko; Yoshihiro, Yokoyama; Sekine, Akiko; Uekusa, Hidediro; Ohashi, Yuji The Structure of 2-Amino-2-deoxyascorbic acid and 2-Amino-2-deoxyerythorbic acid Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x65-x66 Space group: P 21 21 21 Cell volume: 688.8 Cell parameters: 8.3338; 10.294; 8.029; 90; 90; 90; |
| COD ID: 1100729 | |
| CIF file | Formula: - C37 H34 Cl2 Hg I2 N4 O3 - Comments: Tara J. Burchell; Richard J. Puddephatt Self-Assembly of Chiral Coordination Polymers and Macrocycles: A Metal Template Effect on the Polymer-Macrocycle Equilibrium Inorganic Chemistry 44 (2005) 3718-3730 Space group: P 21 21 21 Cell volume: 3875.1 Cell parameters: 15.023; 15.582; 16.554; 90; 90; 90; |
| COD ID: 1100765 | |
| CIF file | Formula: - C20 H25 B N6 S2 Zn - Comments: Mian Ji; Boumahdi Benkmil; Heinrich Vahrenkamp Zinc-Thiolate Complexes of the Bis(pyrazolyl)(thioimidazolyl)hydroborate Tripods for the Modeling of Thiolate Alkylating Enzymes Inorganic Chemistry 44(10) (2005) 3518-3523 Space group: P 21 21 21 Cell volume: 2307.1 Cell parameters: 9.392; 12.838; 19.134; 90; 90; 90; |
| COD ID: 1100823 | |
| CIF file | Formula: - C31 H51 Si2 Y - Comments: Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278 Space group: P 21 21 21 Cell volume: 3110.5 Cell parameters: 10.0582; 10.9779; 28.1698; 90; 90; 90; |
| COD ID: 1100844 | |
| CIF file | Formula: - C16 H36 Cl2 N2 O P2 Ru - Comments: Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501 Space group: P 21 21 21 Cell volume: 2288.45 Cell parameters: 10.7245; 13.8487; 15.4083; 90; 90; 90; |
| COD ID: 1100854 | |
| CIF file | Formula: - C20 H41 B8 Cl Ru2 - Comments: Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~ Organometallics 24(10) (2005) 2473-2480 Space group: P 21 21 21 Cell volume: 2542.8 Cell parameters: 9.705; 13.701; 19.123; 90; 90; 90; |
| COD ID: 1100907 | |
| CIF file | Formula: - C17 H15 N O4 - Comments: Brady, Fiona; Gallagher, John F. Intermolecular O-H...O hydrogen bonding in the three independent molecules of (2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acid Acta Crystallographica, Section C 56 (2000) 1407-1410 Space group: P 21 21 21 Cell volume: 4357.9 Cell parameters: 10.7589; 17.8696; 22.667; 90; 90; 90; |
| COD ID: 1100946 | |
| CIF file | Formula: - C20 H22 Ce Cu N5 O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2561 Cell parameters: 8.697; 13.905; 21.176; 90; 90; 90; |
| COD ID: 1100947 | |
| CIF file | Formula: - C20 H22 Cu N5 O13 Pr - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2525.6 Cell parameters: 8.619; 13.8698; 21.1269; 90; 90; 90; |
| COD ID: 1100948 | |
| CIF file | Formula: - C20 H22 Cu Eu N5 O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2507.6 Cell parameters: 8.601; 13.786; 21.1483; 90; 90; 90; |
| COD ID: 1100949 | |
| CIF file | Formula: - C20 H22 Cu N5 O13 Tb - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2527 Cell parameters: 8.611; 13.814; 21.244; 90; 90; 90; |
| COD ID: 1100950 | |
| CIF file | Formula: - C20 H22 Cu Dy N5 O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2500.61 Cell parameters: 8.587; 13.758; 21.1665; 90; 90; 90; |
| COD ID: 1100951 | |
| CIF file | Formula: - C20 H22 Cu Ho N5 O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2500.7 Cell parameters: 8.583; 13.749; 21.191; 90; 90; 90; |
| COD ID: 1100952 | |
| CIF file | Formula: - C20 H22 Cu N5 O13 Tm - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2491.7 Cell parameters: 8.566; 13.735; 21.1786; 90; 90; 90; |
| COD ID: 1100953 | |
| CIF file | Formula: - C20 H22 Cu N5 O13 Yb - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2481.6 Cell parameters: 8.576; 13.705; 21.114; 90; 90; 90; |
| COD ID: 1100954 | |
| CIF file | Formula: - C20 H22 Ce N5 Ni O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2526.6 Cell parameters: 8.6323; 13.822; 21.176; 90; 90; 90; |
| COD ID: 1100955 | |
| CIF file | Formula: - C20 H22 N5 Nd Ni O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2515.4 Cell parameters: 8.6215; 13.776; 21.179; 90; 90; 90; |
| COD ID: 1100956 | |
| CIF file | Formula: - C20 H22 Eu N5 Ni O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2514.4 Cell parameters: 8.617; 21.215; 13.754; 90; 90; 90; |
| COD ID: 1100957 | |
| CIF file | Formula: - C20 H22 N5 Ni O13 Tb - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2512.2 Cell parameters: 8.607; 21.24; 13.742; 90; 90; 90; |
| COD ID: 1100958 | |
| CIF file | Formula: - C20 H22 Er N5 Ni O13 - Comments: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions Inorganic Chemistry 44 (2005) 3524-3536 Space group: P 21 21 21 Cell volume: 2506 Cell parameters: 8.601; 13.71; 21.252; 90; 90; 90; |
| COD ID: 1101056 | |
| CIF file | Formula: - C13 H13 N O3 - Comments: Coles, Simon J.; Hursthouse, Michael B.; Whitby, Richard J.; Hunter, Rupert private communication () Space group: P 21 21 21 Cell volume: 1113.21 Cell parameters: 6.8078; 9.3184; 17.5481; 90; 90; 90; |
| COD ID: 1101107 | |
| CIF file | Formula: - C16 H22 Cl2 Cu N8 O15 - Comments: Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Crystal structure of the Λ-[4M] enantiomer of cis-diaqua-bis(1,3-dimethylpteridine-2,4(1H,3H)-dione-N^5^,O^4^) copper(II) perchlorate monohydrate Journal of Chemical Crystallography 29(5) (1999) 571-574 Space group: P 21 21 21 Cell volume: 2636.2 Cell parameters: 8.749; 14.213; 21.2; 90; 90; 90; |
| COD ID: 1101129 | |
| CIF file | Formula: - C12 H14 N2 O3 - Comments: Raj P. Sharma; Paramjit Singh; Kuldip K. Bhasin; Miguel Quirós; Juan M. Salas; J. F. Hansen Synthesis, spectroscopic and X-ray structural study of 4-p-methoxy-phenylimino-3-hydroxyimino-2-pentanone Journal of Chemical Cristallography 26(6) (1996) 407-412 Space group: P 21 21 21 Cell volume: 1223.9 Cell parameters: 7.2294; 11.54; 14.67; 90; 90; 90; |
| COD ID: 1101141 | |
| CIF file | Formula: - C5 H8 Cu N3 O5.5 - Comments: Francisco Hueso-Ureña; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas; René Faure; Gerardo Álvarez de Cienfuegos Spectral and magnetic properties, and biological activity of several coordination compounds of dinegative isoorotato and 2-thioisoorotato ligands. Crystal structure of the tetrameric complex [Cu~4~(isoorotato^2-^)~4~(NH~3~)~4(H~2~O)~2~].4H~2~O Inorganica Chimica Acta 241 (1996) 61-69 Space group: P 21 21 21 Cell volume: 4084.4 Cell parameters: 13.362; 13.566; 22.532; 90; 90; 90; |
| COD ID: 1501555 | |
| CIF file | Formula: - C9 H18 Ag F3 O4 S3 - Comments: Mohamed Osman Awaleh; Francois Brisse; Youssouf Djibril Soubaneh; Thierry Maris Influence of the counteranion on silver(I)-dithioether coordination polymers Polyhedron 29 (2010) 2966-2975 Space group: P 21 21 21 Cell volume: 1639.87 Cell parameters: 8.0541; 9.6501; 21.099; 90; 90; 90; |
| COD ID: 1501565 | |
| CIF file | Formula: - C16 H14 - Comments: Hung Dang; Thierry Maris; Ji-Hyun Yi; Federico Rosei; Antonio Nancy; James D. Wuest Ensuring Homology between 2D and 3D Molecular Crystals Langmuir 23 (2007) 11980-11985 Space group: P 21 21 21 Cell volume: 2224.35 Cell parameters: 8.0049; 8.5815; 32.3805; 90; 90; 90; |
| COD ID: 1501646 | |
| CIF file | Formula: - C26 H20 Cl N O4 - Comments: Kotani, Hiroaki; Ohkubo, Kei; Fukuzumi, Shunichi Formation of a long-lived electron-transfer state of a naphthalene‒quinolinium ion dyad and the π-dimer radical cation Faraday Discussions 155 (2012) 89 Space group: P 21 21 21 Cell volume: 2078.3 Cell parameters: 9.2173; 9.9916; 22.5665; 90; 90; 90; |
| COD ID: 1501660 | |
| CIF file | Formula: - C26 H26 N2 O2 - Comments: Trapella, Claudio; Pela, Michela; Del Zoppo, Luisa; Calo, Girolamo; Camarda, Valeria; Ruzza, Chiara; Cavazzini, Alberto; Costa, Valentina; Bertolasi, Valerio; Reinscheid, Rainer K.; Salvadori, Severo; Guerrini, Remo Synthesis and separation of the enantiomers of the neuropeptide S receptor antagonist (9R/S)-3-oxo-1,1-diphenyl-tetrahydro-oxazolo[3,4-a]pyrazine-7-carboxylic acid 4-fluoro-benzylamide (SHA 68). Journal of medicinal chemistry 54(8) (2011) 2738-2744 Space group: P 21 21 21 Cell volume: 2162.3 Cell parameters: 11.2339; 11.6808; 16.4783; 90; 90; 90; |
| COD ID: 1501661 | |
| CIF file | Formula: - C46 H36 Br4 N2 O7 - Comments: Magedov, Igor V.; Frolova, Liliya; Manpadi, Madhuri; Bhoga, Uma devi; Tang, Hong; Evdokimov, Nikolai M.; George, Olivia; Georgiou, Kathy Hadje; Renner, Steffen; Getlik, Matthäus; Kinnibrugh, Tiffany L.; Fernandes, Manuel A.; Van slambrouck, Severine; Steelant, Wim F. A.; Shuster, Charles B.; Rogelj, Snezna; van Otterlo, Willem A. L.; Kornienko, Alexander Anticancer properties of an important drug lead podophyllotoxin can be efficiently mimicked by diverse heterocyclic scaffolds accessible via one-step synthesis. Journal of medicinal chemistry 54(12) (2011) 4234-4246 Space group: P 21 21 21 Cell volume: 4364.2 Cell parameters: 8.6598; 21.3183; 23.6397; 90; 90; 90; |
| COD ID: 1501664 | |
| CIF file | Formula: - C17 H24 Br N O4 Si - Comments: Xin, Qisheng; Fan, Houxing; Guo, Bin; He, Huili; Gao, Suo; Wang, Hui; Huang, Yanqin; Yang, Yushe Design, synthesis, and structure-activity relationship studies of highly potent novel benzoxazinyl-oxazolidinone antibacterial agents. Journal of medicinal chemistry 54(21) (2011) 7493-7502 Space group: P 21 21 21 Cell volume: 2009.1 Cell parameters: 6.5913; 15.0012; 20.319; 90; 90; 90; |
| COD ID: 1501666 | |
| CIF file | Formula: - C21 H30 F3 N O3 - Comments: Woods, James R.; Mo, Huaping; Bieberich, Andrew A.; Alavanja, Tanja; Colby, David A. Fluorinated amino-derivatives of the sesquiterpene lactone, parthenolide, as (19)f NMR probes in deuterium-free environments. Journal of medicinal chemistry 54(22) (2011) 7934-7941 Space group: P 21 21 21 Cell volume: 2026.65 Cell parameters: 8.1766; 10.4313; 23.7612; 90; 90; 90; |
| COD ID: 1501682 | |
| CIF file | Formula: - C17 H16 N2 O3 V - Comments: Matsuoka, Naoki; Tsuchimoto, Masanobu; Yoshioka, Naoki Theoretical study of magnetic properties of oxovanadium(IV) complex self-assemblies with tetradentate Schiff base ligands. The journal of physical chemistry. B 115(26) (2011) 8465-8473 Space group: P 21 21 21 Cell volume: 1545.1 Cell parameters: 11.905; 17.238; 7.529; 90; 90; 90; |
| COD ID: 1501683 | |
| CIF file | Formula: - C14 H10 O2 - Comments: Zhu, Xiao-Qing; Zhou, Jian; Wang, Chun-Hua; Li, Xiu-Tao; Jing, Sha Actual structure, thermodynamic driving force, and mechanism of benzofuranone-typical compounds as antioxidants in solution. The journal of physical chemistry. B 115(13) (2011) 3588-3603 Space group: P 21 21 21 Cell volume: 1027.4 Cell parameters: 8.1037; 10.127; 12.519; 90; 90; 90; |
| COD ID: 1501698 | |
| CIF file | Formula: - C27 H26 F3 N Si - Comments: Shimizu, Masaki; Mochida, Kenji; Hiyama, Tamejiro Highly Efficient Blue Fluorescence from 3,2′-Silylene-Bridged 2-Phenylindoles in the Solid State The Journal of Physical Chemistry C 115(22) (2011) 11265 Space group: P 21 21 21 Cell volume: 2411 Cell parameters: 8.0586; 14.782; 20.24; 90; 90; 90; |
| COD ID: 1501725 | |
| CIF file | Formula: - C13 H10 Cl N O - Comments: Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A 115(26) (2011) 7834-7848 Space group: P 21 21 21 Cell volume: 1156.37 Cell parameters: 6.0806; 12.2086; 15.577; 90; 90; 90; |
| COD ID: 1501747 | |
| CIF file | Formula: - C9 H40 F N15 O12 S3 - Comments: Szafrański, Marek Crystal structures, phase transitions, and pressure-induced ferroelectricity in [C(NH2)3]5SO4(SO3-OC2H5)2F. The journal of physical chemistry. B 115(34) (2011) 10277-10284 Space group: P 21 21 21 Cell volume: 3044.7 Cell parameters: 10.517; 14.329; 20.204; 90; 90; 90; |
| COD ID: 1501793 | |
| CIF file | Formula: - C26 H44 F6 O6 P2 Pd S2 - Comments: Stempfle, Florian; Quinzler, Dorothee; Heckler, Ilona; Mecking, Stefan Long-Chain Linear C19and C23Monomers and Polycondensates from Unsaturated Fatty Acid Esters Macromolecules 44(11) (2011) 4159 Space group: P 21 21 21 Cell volume: 3404.5 Cell parameters: 9.1472; 11.3899; 32.6773; 90; 90; 90; |
| COD ID: 1501799 | |
| CIF file | Formula: - C28 H38 O9 - Comments: Tang, Wen-Zhao; Ma, Shuang-Gang; Qu, Jing; Yu, Shi-Shan; Liu, Yun-Bao; Su, Dong-Min; Liu, Jing Dimeric prenylated C6-C3 compounds from the stem bark of Illicium oligandrum. Journal of natural products 74(5) (2011) 1268-1271 Space group: P 21 21 21 Cell volume: 2686.9 Cell parameters: 9.393; 14.905; 19.192; 90; 90; 90; |
| COD ID: 1501801 | |
| CIF file | Formula: - C20 H30 O2 - Comments: Ioannou, Efstathia; Quesada, Antonio; Rahman, M. Mukhlesur; Gibbons, Simon; Vagias, Constantinos; Roussis, Vassilios Dolabellanes with antibacterial activity from the brown alga Dilophus spiralis. Journal of natural products 74(2) (2011) 213-222 Space group: P 21 21 21 Cell volume: 1698.7 Cell parameters: 7.7877; 13.9979; 15.583; 90; 90; 90; |
| COD ID: 1501803 | |
| CIF file | Formula: - C49 H79 N6 O13.5 - Comments: Montaser, Rana; Abboud, Khalil A.; Paul, Valerie J.; Luesch, Hendrik Pitiprolamide, a proline-rich dolastatin 16 analogue from the marine cyanobacterium Lyngbya majuscula from Guam. Journal of natural products 74(1) (2011) 109-112 Space group: P 21 21 21 Cell volume: 5278.1 Cell parameters: 10.534; 14.952; 33.511; 90; 90; 90; |
| COD ID: 1501811 | |
| CIF file | Formula: - C22 H33 N O3 - Comments: Chou, Bo-Hon; Yang, Li-Ming; Chang, Shwu-Fen; Hsu, Feng-Lin; Wang, Li-Hsuan; Lin, Wen-Kuang; Liu, Pan-Chun; Lin, Shwu-Jiuan Transformation of isosteviol lactam by fungi and the suppressive effects of its transformed products on LPS-induced iNOS expression in macrophages. Journal of natural products 74(6) (2011) 1379-1385 Space group: P 21 21 21 Cell volume: 2039.1 Cell parameters: 7.7118; 10.43; 25.351; 90; 90; 90; |
| COD ID: 1501813 | |
| CIF file | Formula: - C22 H34 O7 - Comments: Wu, Hankui; Fronczek, Frank R.; Ferreira, Daneel; Burandt, Jr, Charles L; Zjawiony, Jordan K. Labdane diterpenoids from Leonurus sibiricus. Journal of natural products 74(4) (2011) 831-836 Space group: P 21 21 21 Cell volume: 2064.1 Cell parameters: 11.373; 11.703; 15.508; 90; 90; 90; |
| COD ID: 1501814 | |
| CIF file | Formula: - C22 H34 O7 - Comments: Wu, Hankui; Fronczek, Frank R.; Ferreira, Daneel; Burandt, Jr, Charles L; Zjawiony, Jordan K. Labdane diterpenoids from Leonurus sibiricus. Journal of natural products 74(4) (2011) 831-836 Space group: P 21 21 21 Cell volume: 2064.3 Cell parameters: 11.3687; 11.7108; 15.5053; 90; 90; 90; |
| COD ID: 1501815 | |
| CIF file | Formula: - C32 H40 O9 - Comments: Najmuldeen, Ibrahim A.; Hadi, A Hamid A; Awang, Khalijah; Mohamad, Khalit; Ketuly, Kamal Aziz; Mukhtar, Mat Ropi; Chong, Soon-Lim; Chan, Gomathi; Nafiah, Mohd Azlan; Weng, Ng Seik; Shirota, Osamu; Hosoya, Takahiro; Nugroho, Alfarius E.; Morita, Hiroshi Chisomicines A-C, limonoids from Chisocheton ceramicus. Journal of natural products 74(5) (2011) 1313-1317 Space group: P 21 21 21 Cell volume: 5774.33 Cell parameters: 12.491; 13.4647; 34.3327; 90; 90; 90; |
| COD ID: 1501819 | |
| CIF file | Formula: - C27 H38 O3 - Comments: Chao, Chih-Hua; Chou, Kuei-Ju; Wen, Zhi-Hong; Wang, Guey-Horng; Wu, Yang-Chang; Dai, Chang-Feng; Sheu, Jyh-Horng Paraminabeolides A-F, cytotoxic and anti-inflammatory marine withanolides from the soft coral Paraminabea acronocephala. Journal of natural products 74(5) (2011) 1132-1141 Space group: P 21 21 21 Cell volume: 2248.7 Cell parameters: 6.5336; 14.5778; 23.6095; 90; 90; 90; |
| COD ID: 1501821 | |
| CIF file | Formula: - C27.5 H48 O5.5 - Comments: Challinor, Victoria L.; Stuthe, Julia M. U.; Bernhardt, Paul V.; Lehmann, Reginald P.; Kitching, William; De Voss, James J. Structure and absolute configuration of helosides A and B, new saponins from Chamaelirium luteum. Journal of natural products 74(7) (2011) 1557-1560 Space group: P 21 21 21 Cell volume: 2636.89 Cell parameters: 6.1059; 12.3606; 34.9384; 90; 90; 90; |
| COD ID: 1501822 | |
| CIF file | Formula: - C20 H26 O5 - Comments: Tsukada, Mariko; Fukai, Miyuki; Miki, Kazuhiko; Shiraishi, Takeshi; Suzuki, Toshihiro; Nishio, Kazuto; Sugita, Takashi; Ishino, Masahiro; Kinoshita, Kaoru; Takahashi, Kunio; Shiro, Motoo; Koyama, Kiyotaka Chemical constituents of a marine fungus, Arthrinium sacchari. Journal of natural products 74(7) (2011) 1645-1649 Space group: P 21 21 21 Cell volume: 1751.59 Cell parameters: 11.9928; 12.0355; 12.1352; 90; 90; 90; |
| COD ID: 1501823 | |
| CIF file | Formula: - C20 H26 O4 - Comments: Tsukada, Mariko; Fukai, Miyuki; Miki, Kazuhiko; Shiraishi, Takeshi; Suzuki, Toshihiro; Nishio, Kazuto; Sugita, Takashi; Ishino, Masahiro; Kinoshita, Kaoru; Takahashi, Kunio; Shiro, Motoo; Koyama, Kiyotaka Chemical constituents of a marine fungus, Arthrinium sacchari. Journal of natural products 74(7) (2011) 1645-1649 Space group: P 21 21 21 Cell volume: 1692.5 Cell parameters: 11.3885; 11.8068; 12.5872; 90; 90; 90; |
| COD ID: 1501825 | |
| CIF file | Formula: - C16 H24 O5 - Comments: Li, Hanxiang; Huang, Hongbo; Shao, Changlun; Huang, Huarong; Jiang, Jieyi; Zhu, Xun; Liu, Yayue; Liu, Lan; Lu, Yongjun; Li, Mengfeng; Lin, Yongcheng; She, Zhigang Cytotoxic norsesquiterpene peroxides from the endophytic fungus Talaromyces flavus isolated from the mangrove plant Sonneratia apetala. Journal of natural products 74(5) (2011) 1230-1235 Space group: P 21 21 21 Cell volume: 3004.05 Cell parameters: 10.9434; 12.4201; 22.1019; 90; 90; 90; |
| COD ID: 1501827 | |
| CIF file | Formula: - C14 H22 O4 - Comments: Li, Hanxiang; Huang, Hongbo; Shao, Changlun; Huang, Huarong; Jiang, Jieyi; Zhu, Xun; Liu, Yayue; Liu, Lan; Lu, Yongjun; Li, Mengfeng; Lin, Yongcheng; She, Zhigang Cytotoxic norsesquiterpene peroxides from the endophytic fungus Talaromyces flavus isolated from the mangrove plant Sonneratia apetala. Journal of natural products 74(5) (2011) 1230-1235 Space group: P 21 21 21 Cell volume: 1268.88 Cell parameters: 7.3125; 12.4303; 13.9596; 90; 90; 90; |
| COD ID: 1501829 | |
| CIF file | Formula: - C30 H46 O4 - Comments: Cheng, Shi-Yie; Wang, Chao-Min; Hsu, Yuan-Man; Huang, Tsurng-Juhn; Chou, Shen-Chieh; Lin, En-Hung; Chou, Chang-Hung Oleanane-type triterpenoids from the leaves and twigs of Fatsia polycarpa. Journal of natural products 74(8) (2011) 1744-1750 Space group: P 21 21 21 Cell volume: 2745.98 Cell parameters: 8.0495; 17.7248; 19.2463; 90; 90; 90; |
| COD ID: 1501830 | |
| CIF file | Formula: - C30 H46 O3 - Comments: Cheng, Shi-Yie; Wang, Chao-Min; Hsu, Yuan-Man; Huang, Tsurng-Juhn; Chou, Shen-Chieh; Lin, En-Hung; Chou, Chang-Hung Oleanane-type triterpenoids from the leaves and twigs of Fatsia polycarpa. Journal of natural products 74(8) (2011) 1744-1750 Space group: P 21 21 21 Cell volume: 2961.3 Cell parameters: 11.1004; 12.7518; 20.9205; 90; 90; 90; |
| COD ID: 1501833 | |
| CIF file | Formula: - C24 H38 O5 - Comments: Ciavatta, Maria Letizia; Manzo, Emiliano; Mollo, Ernesto; Mattia, Carlo Andrea; Tedesco, Consiglia; Irace, Carlo; Guo, Yue-Wei; Li, Xiu-Bao; Cimino, Guido; Gavagnin, Margherita Tritoniopsins A-D, cladiellane-based diterpenes from the South China Sea nudibranch Tritoniopsis elegans and its prey Cladiella krempfi. Journal of natural products 74(9) (2011) 1902-1907 Space group: P 21 21 21 Cell volume: 2186.9 Cell parameters: 9.873; 14.759; 15.008; 90; 90; 90; |
| COD ID: 1501836 | |
| CIF file | Formula: - C16 H22 O10 - Comments: Yu, Yang; Song, Weixia; Zhu, Chenggen; Lin, Sheng; Zhao, Feng; Wu, Xiuli; Yue, Zhenggang; Liu, Bo; Wang, Sujuan; Yuan, Shaopeng; Hou, Qi; Shi, Jiangong Homosecoiridoids from the flower buds of Lonicera japonica. Journal of natural products 74(10) (2011) 2151-2160 Space group: P 21 21 21 Cell volume: 1699 Cell parameters: 8.4601; 11.033; 18.202; 90; 90; 90; |
| COD ID: 1501837 | |
| CIF file | Formula: - C28 H40 O4 - Comments: Rateb, Mostafa E.; Houssen, Wael E.; Harrison, William T. A.; Deng, Hai; Okoro, Chinyere K.; Asenjo, Juan A.; Andrews, Barbara A.; Bull, Alan T.; Goodfellow, Michael; Ebel, Rainer; Jaspars, Marcel Diverse metabolic profiles of a Streptomyces strain isolated from a hyper-arid environment. Journal of natural products 74(9) (2011) 1965-1971 Space group: P 21 21 21 Cell volume: 2691.6 Cell parameters: 8.8119; 11.8088; 25.8659; 90; 90; 90; |
| COD ID: 1501838 | |
| CIF file | Formula: - C39 H56 O15 - Comments: Xu, Jing; Guo, Yuanqiang; Xie, Chunfeng; Li, Yushan; Gao, Jie; Zhang, Tiejun; Hou, Wenbin; Fang, Lingzhi; Gui, Liping Bioactive myrsinol diterpenoids from the roots of Euphorbia prolifera. Journal of natural products 74(10) (2011) 2224-2230 Space group: P 21 21 21 Cell volume: 4054.3 Cell parameters: 10.2388; 12.9739; 30.5211; 90; 90; 90; |
| COD ID: 1501846 | |
| CIF file | Formula: - C32 H52 O4 - Comments: Huang, Hong-Li; Wang, Chun-Ming; Wang, Zhen-Hua; Yao, Ming-Jun; Han, Guang-Tian; Yuan, Ji-Cheng; Gao, Kun; Yuan, Cheng-Shan Tirucallane-type triterpenoids from Dysoxylum lenticellatum. Journal of natural products 74(10) (2011) 2235-2242 Space group: P 21 21 21 Cell volume: 2981 Cell parameters: 7.541; 10.852; 36.43; 90; 90; 90; |
| COD ID: 1501847 | |
| CIF file | Formula: - C31 H46 O5 - Comments: Huang, Hong-Li; Wang, Chun-Ming; Wang, Zhen-Hua; Yao, Ming-Jun; Han, Guang-Tian; Yuan, Ji-Cheng; Gao, Kun; Yuan, Cheng-Shan Tirucallane-type triterpenoids from Dysoxylum lenticellatum. Journal of natural products 74(10) (2011) 2235-2242 Space group: P 21 21 21 Cell volume: 2810 Cell parameters: 7.299; 16.568; 23.238; 90; 90; 90; |
| COD ID: 1501848 | |
| CIF file | Formula: - C22 H26 Cl6 N2 O2 - Comments: Lim, Siew-Huah; Tan, Shin-Jowl; Low, Yun-Yee; Kam, Toh-Seok Lumutinines A-D, linearly fused macroline-macroline and macroline-sarpagine bisindoles from Alstonia macrophylla. Journal of natural products 74(12) (2011) 2556-2562 Space group: P 21 21 21 Cell volume: 2504.05 Cell parameters: 10.389; 10.4473; 23.0709; 90; 90; 90; |
| COD ID: 1501857 | |
| CIF file | Formula: - C20 H20 Fe O6 S - Comments: Paley, Robert S.; Laupheimer, Madeleine C.; Erskine, Nathaniel A. K.; Rablen, Paul R.; Pike, Robert D.; Jones, James S. Diastereoselective spiroketalization: stereocontrol using an iron(0) tricarbonyl diene complex. Organic letters 13(1) (2011) 58-61 Space group: P 21 21 21 Cell volume: 1984.33 Cell parameters: 12.0135; 12.644; 13.0635; 90; 90; 90; |
| COD ID: 1501858 | |
| CIF file | Formula: - C21 H22 Fe O6 S - Comments: Paley, Robert S.; Laupheimer, Madeleine C.; Erskine, Nathaniel A. K.; Rablen, Paul R.; Pike, Robert D.; Jones, James S. Diastereoselective spiroketalization: stereocontrol using an iron(0) tricarbonyl diene complex. Organic letters 13(1) (2011) 58-61 Space group: P 21 21 21 Cell volume: 2108.33 Cell parameters: 6.1275; 9.7503; 35.2888; 90; 90; 90; |
| COD ID: 1501864 | |
| CIF file | Formula: - C23 H20 O2 S - Comments: Antczak, Monika I.; Cai, Feng; Ready, Joseph M. Asymmetric synthesis of tertiary benzylic alcohols. Organic letters 13(2) (2011) 184-187 Space group: P 21 21 21 Cell volume: 3933 Cell parameters: 11.15; 11.305; 31.2; 90; 90; 90; |
| COD ID: 1501870 | |
| CIF file | Formula: - C11 H18 O2 - Comments: Chen, Yan; Ju, Tong Enantioselective synthesis of A key A-ring intermediate for the preparation of 1α,25-dihydroxyvitamin D(3). Organic letters 13(1) (2011) 86-89 Space group: P 21 21 21 Cell volume: 1038.5 Cell parameters: 5.4202; 10.233; 18.723; 90; 90; 90; |
| COD ID: 1501876 | |
| CIF file | Formula: - C21 H20 Br N O4 - Comments: Jin, Zhichao; Wang, Xiao; Huang, Huicai; Liang, Xinmiao; Ye, Jinxing Diastereo- and enantioselective synthesis of oxazine and oxazolidine derivatives with a chiral quaternary carbon center under multifunctional catalysis. Organic letters 13(4) (2011) 564-567 Space group: P 21 21 21 Cell volume: 1879.3 Cell parameters: 7.5957; 11.494; 21.526; 90; 90; 90; |
| COD ID: 1501894 | |
| CIF file | Formula: - C25 H20 N2 O3 S - Comments: Barroso, Santiago; Blay, Gonzalo; Muñoz, M Carmen; Pedro, José R Highly enantioselective nitrone cycloadditions with 2-alkenoyl pyridine N-oxides catalyzed by Cu(II)-BOX complexes. Organic letters 13(3) (2011) 402-405 Space group: P 21 21 21 Cell volume: 2103.36 Cell parameters: 8.007; 15.022; 17.487; 90; 90; 90; |
| COD ID: 1501904 | |
| CIF file | Formula: - C28 H38 O10 - Comments: Lin, Yu-Chi; Lo, I-Wen; Chen, Shun-Ying; Lin, Pi-Han; Chien, Ching-Te; Chang, Sui-yuan; Shen, Ya-Ching Schinarisanlactone A, a new bisnortriterpenoid from Schisandra arisanensis. Organic letters 13(3) (2011) 446-449 Space group: P 21 21 21 Cell volume: 2662.93 Cell parameters: 10.3366; 10.93; 23.5701; 90; 90; 90; |
| COD ID: 1501909 | |
| CIF file | Formula: - C28 H24 O2 - Comments: Wen, Bo; Petersen, Jeffrey L.; Wang, Kung K. Synthesis of 1,4-naphthoquinone methides via acid-catalyzed cascade cyclizations of benzannulated enediynyl alcohols. Organic letters 13(1) (2011) 168-171 Space group: P 21 21 21 Cell volume: 2151.9 Cell parameters: 11.083; 12.964; 14.977; 90; 90; 90; |
| COD ID: 1501910 | |
| CIF file | Formula: - C29 H26 O2 - Comments: Wen, Bo; Petersen, Jeffrey L.; Wang, Kung K. Synthesis of 1,4-naphthoquinone methides via acid-catalyzed cascade cyclizations of benzannulated enediynyl alcohols. Organic letters 13(1) (2011) 168-171 Space group: P 21 21 21 Cell volume: 2198.3 Cell parameters: 6.1374; 11.8458; 30.2363; 90; 90; 90; |
| COD ID: 1501930 | |
| CIF file | Formula: - C44 H36 O4 P2 - Comments: Mori, Fumiya; Fukawa, Naohiro; Noguchi, Keiichi; Tanaka, Ken Asymmetric synthesis of axially chiral biaryl diphosphine ligands by rhodium-catalyzed enantioselective intramolecular double [2 + 2 + 2] cycloaddition. Organic letters 13(3) (2011) 362-365 Space group: P 21 21 21 Cell volume: 3544.37 Cell parameters: 8.98499; 16.8485; 23.4132; 90; 90; 90; |
| COD ID: 1501935 | |
| CIF file | Formula: - C19 H15 Cl N2 - Comments: Li, Shaoyu; Wu, Jie Synthesis of H-pyrazolo[5,1-a]isoquinolines via copper(II)-catalyzed oxidation of an aliphatic C-H bond of tertiary amine in air. Organic letters 13(4) (2011) 712-715 Space group: P 21 21 21 Cell volume: 2950.9 Cell parameters: 7.659; 14.452; 26.66; 90; 90; 90; |
| COD ID: 1501949 | |
| CIF file | Formula: - C18 H25 N O2 S Si - Comments: Yazaki, Ryo; Kumagai, Naoya; Shibasaki, Masakatsu Enantioselective synthesis of a GPR40 agonist AMG 837 via catalytic asymmetric conjugate addition of terminal alkyne to α,β-unsaturated thioamide. Organic letters 13(5) (2011) 952-955 Space group: P 21 21 21 Cell volume: 1932.59 Cell parameters: 5.93358; 17.3531; 18.7692; 90; 90; 90; |
| COD ID: 1501950 | |
| CIF file | Formula: - C21 H27 N O4 S - Comments: Buesking, Andrew W.; Baguley, Tyler D.; Ellman, Jonathan A. Asymmetric synthesis of amines by the Knochel-type MgCl2-enhanced addition of benzyl zinc reagents to N-tert-butanesulfinyl aldimines. Organic letters 13(5) (2011) 964-967 Space group: P 21 21 21 Cell volume: 2034 Cell parameters: 5.57254; 11.2226; 32.524; 90; 90; 90; |
| COD ID: 1501951 | |
| CIF file | Formula: - C16 H26 F N O S - Comments: Buesking, Andrew W.; Baguley, Tyler D.; Ellman, Jonathan A. Asymmetric synthesis of amines by the Knochel-type MgCl2-enhanced addition of benzyl zinc reagents to N-tert-butanesulfinyl aldimines. Organic letters 13(5) (2011) 964-967 Space group: P 21 21 21 Cell volume: 1660.79 Cell parameters: 8.7454; 10.5113; 18.0667; 90; 90; 90; |
| COD ID: 1501956 | |
| CIF file | Formula: - C25 H23 Br Cl2 N2 O3 - Comments: Jia, Zhen-Xin; Luo, Yong-Chun; Xu, Peng-Fei Highly enantioselective synthesis of polysubstituted tetrahydroquinolines via organocatalytic Michael/Aza-Henry tandem reactions. Organic letters 13(5) (2011) 832-835 Space group: P 21 21 21 Cell volume: 2545 Cell parameters: 7.74; 13.342; 24.64; 90; 90; 90; |
| COD ID: 1501964 | |
| CIF file | Formula: - C16 H27 I2 N O5 - Comments: Brock, E. Anne; Davies, Stephen G.; Lee, James A.; Roberts, Paul M.; Thomson, James E. Asymmetric synthesis of polyhydroxylated pyrrolizidines via transannular iodoamination with concomitant N-debenzylation. Organic letters 13(7) (2011) 1594-1597 Space group: P 21 21 21 Cell volume: 2022.3 Cell parameters: 11.4404; 12.2759; 14.3996; 90; 90; 90; |
| COD ID: 1501971 | |
| CIF file | Formula: - C17 H23 B O6 - Comments: Hager, Anastasia; Mazunin, Dmitry; Mayer, Peter; Trauner, Dirk Synthetic studies toward A-74528. Organic letters 13(6) (2011) 1386-1389 Space group: P 21 21 21 Cell volume: 1730.5 Cell parameters: 10.3923; 10.6376; 15.6535; 90; 90; 90; |
| COD ID: 1501980 | |
| CIF file | Formula: - C15 H20 Cl N O5 - Comments: Emerson, Christopher R.; Zakharov, Lev N.; Blakemore, Paul R. Iterative stereospecific reagent-controlled homologation using a functionalized α-chloroalkyllithium: synthesis of cyclic targets related to epibatidine. Organic letters 13(6) (2011) 1318-1321 Space group: P 21 21 21 Cell volume: 1564 Cell parameters: 8.0356; 11.0921; 17.5466; 90; 90; 90; |
| COD ID: 1501987 | |
| CIF file | Formula: - C23 H27 Cl N2 O4 - Comments: Hong, Bor-Cherng; Dange, Nitin S.; Hsu, Che-Sheng; Liao, Ju-Hsiou; Lee, Gene-Hsiang Dynamic kinetic asymmetric synthesis of five contiguous stereogenic centers by sequential organocatalytic stetter and Michael-aldol reaction: enantioselective synthesis of fully substituted cyclopentanols bearing a quaternary stereocenter. Organic letters 13(6) (2011) 1338-1341 Space group: P 21 21 21 Cell volume: 2303 Cell parameters: 5.8373; 18.1668; 21.7172; 90; 90; 90; |
| COD ID: 1501988 | |
| CIF file | Formula: - C23 H25 Br N2 O4 - Comments: Hong, Bor-Cherng; Dange, Nitin S.; Hsu, Che-Sheng; Liao, Ju-Hsiou; Lee, Gene-Hsiang Dynamic kinetic asymmetric synthesis of five contiguous stereogenic centers by sequential organocatalytic stetter and Michael-aldol reaction: enantioselective synthesis of fully substituted cyclopentanols bearing a quaternary stereocenter. Organic letters 13(6) (2011) 1338-1341 Space group: P 21 21 21 Cell volume: 2198.3 Cell parameters: 5.8869; 12.4397; 30.019; 90; 90; 90; |
| COD ID: 1502021 | |
| CIF file | Formula: - C14 H16 N2 O2 - Comments: Kumar, Arepalli Sateesh; Nagarajan, Rajagopal Synthesis of α-carbolines via Pd-catalyzed amidation and Vilsmeier-Haack reaction of 3-acetyl-2-chloroindoles. Organic letters 13(6) (2011) 1398-1401 Space group: P 21 21 21 Cell volume: 1326.2 Cell parameters: 8.466; 9.68; 16.183; 90; 90; 90; |
| COD ID: 1502027 | |
| CIF file | Formula: - C29 H41 Br O4 - Comments: Lin, Hongkun; Pochapsky, Susan S.; Krauss, Isaac J. A short asymmetric route to the bromophycolide A and D skeleton. Organic letters 13(5) (2011) 1222-1225 Space group: P 21 21 21 Cell volume: 2754.4 Cell parameters: 8.4428; 10.0656; 32.412; 90; 90; 90; |
| COD ID: 1502028 | |
| CIF file | Formula: - C34 H20 N2 O - Comments: Chen, Jinshui; Captain, Burjor; Takenaka, Norito Helical chiral 2,2'-bipyridine N-monoxides as catalysts in the enantioselective propargylation of aldehydes with allenyltrichlorosilane. Organic letters 13(7) (2011) 1654-1657 Space group: P 21 21 21 Cell volume: 2273.05 Cell parameters: 8.3737; 12.6257; 21.4999; 90; 90; 90; |
| COD ID: 1502049 | |
| CIF file | Formula: - C8 H10 N2 O3 - Comments: Hovey, M. Todd; Eklund, Emily J.; Pike, Robert D.; Mainkar, Anshul A.; Scheerer, Jonathan R. Synthesis of (±)-acetylnorloline via stereoselective tethered aminohydroxylation. Organic letters 13(5) (2011) 1246-1249 Space group: P 21 21 21 Cell volume: 852.64 Cell parameters: 5.1827; 8.0456; 20.4481; 90; 90; 90; |
| COD ID: 1502051 | |
| CIF file | Formula: - C22 H25 Br N2 O3 S3 - Comments: Liu, Xiaodong; Deng, Leijiao; Song, Hongjin; Jia, Huazhen; Wang, Rui Asymmetric aza-Mannich addition: synthesis of modified chiral 2-(ethylthio)-thiazolone derivatives with anticancer potency. Organic letters 13(6) (2011) 1494-1497 Space group: P 21 21 21 Cell volume: 2468.6 Cell parameters: 7.7364; 13.139; 24.286; 90; 90; 90; |
| COD ID: 1502053 | |
| CIF file | Formula: - C70 H72 Br Li N2 O8.5 P2 Ru - Comments: Kurono, Nobuhito; Yoshikawa, Tatsuya; Yamasaki, Mikio; Ohkuma, Takeshi Enantioselective hydrocyanation of aldehydes catalyzed by [Li{Ru(phgly)2(binap)}]X (X = Cl, Br). Organic letters 13(5) (2011) 1254-1257 Space group: P 21 21 21 Cell volume: 6393 Cell parameters: 16.1277; 18.8951; 20.979; 90; 90; 90; |
| COD ID: 1502067 | |
| CIF file | Formula: - C16 H29 N O4 S - Comments: Brichacek, Matthew; Villalobos, Mauricio Navarro; Plichta, Alexandra; Njardarson, Jon T. Stereospecific ring expansion of chiral vinyl aziridines. Organic letters 13(5) (2011) 1110-1113 Space group: P 21 21 21 Cell volume: 1819.19 Cell parameters: 10.8154; 10.8724; 15.4707; 90; 90; 90; |
| COD ID: 1502068 | |
| CIF file | Formula: - C17 H29 N O4 S - Comments: Brichacek, Matthew; Villalobos, Mauricio Navarro; Plichta, Alexandra; Njardarson, Jon T. Stereospecific ring expansion of chiral vinyl aziridines. Organic letters 13(5) (2011) 1110-1113 Space group: P 21 21 21 Cell volume: 1855.1 Cell parameters: 5.6398; 15.691; 20.963; 90; 90; 90; |
| COD ID: 1502070 | |
| CIF file | Formula: - C23 H20 I N O2 S - Comments: Brichacek, Matthew; Villalobos, Mauricio Navarro; Plichta, Alexandra; Njardarson, Jon T. Stereospecific ring expansion of chiral vinyl aziridines. Organic letters 13(5) (2011) 1110-1113 Space group: P 21 21 21 Cell volume: 2115.69 Cell parameters: 12.1844; 12.7928; 13.5732; 90; 90; 90; |
| COD ID: 1502071 | |
| CIF file | Formula: - C21 H22 Br N O2 S - Comments: Brichacek, Matthew; Villalobos, Mauricio Navarro; Plichta, Alexandra; Njardarson, Jon T. Stereospecific ring expansion of chiral vinyl aziridines. Organic letters 13(5) (2011) 1110-1113 Space group: P 21 21 21 Cell volume: 1892.91 Cell parameters: 8.0511; 14.6698; 16.0269; 90; 90; 90; |
| COD ID: 1502088 | |
| CIF file | Formula: - C14 H18 O4 - Comments: Rohr, Kerstin; Mahrwald, Rainer Stereoselective direct amine-catalyzed decarboxylative aldol addition. Organic letters 13(7) (2011) 1878-1880 Space group: P 21 21 21 Cell volume: 1352.63 Cell parameters: 5.8014; 8.9652; 26.0067; 90; 90; 90; |
| COD ID: 1502089 | |
| CIF file | Formula: - C16 H18 Br N O4 S - Comments: Terada, Masahiro; Ando, Kenichi Enantioselective direct vinylogous Michael addition of functionalized furanones to nitroalkenes catalyzed by an axially chiral guanidine base. Organic letters 13(8) (2011) 2026-2029 Space group: P 21 21 21 Cell volume: 5272 Cell parameters: 6.224; 17.136; 49.434; 90; 90; 90; |
| COD ID: 1502091 | |
| CIF file | Formula: - C30 H33 N O4 - Comments: Anwar, Shaik; Chang, Hui-Ju; Chen, Kwunmin Organocatalytic synthesis of multiple substituted bicyclo[4.4.0]decalin system. Organic letters 13(9) (2011) 2200-2203 Space group: P 21 21 21 Cell volume: 2529.9 Cell parameters: 8.3963; 11.4021; 26.4261; 90; 90; 90; |
| COD ID: 1502092 | |
| CIF file | Formula: - C47 H50 Cl2 N4 O12 - Comments: Anwar, Shaik; Chang, Hui-Ju; Chen, Kwunmin Organocatalytic synthesis of multiple substituted bicyclo[4.4.0]decalin system. Organic letters 13(9) (2011) 2200-2203 Space group: P 21 21 21 Cell volume: 4376 Cell parameters: 8.39; 22.555; 23.123; 90; 90; 90; |
| COD ID: 1502095 | |
| CIF file | Formula: - C16 H24 N2 O4 - Comments: Takita, Satoshi; Yokoshima, Satoshi; Fukuyama, Tohru A practical synthesis of (-)-kainic acid. Organic letters 13(8) (2011) 2068-2070 Space group: P 21 21 21 Cell volume: 1646.07 Cell parameters: 9.5185; 10.7567; 16.0768; 90; 90; 90; |
| COD ID: 1502103 | |
| CIF file | Formula: - C67 H92 B4 N2 O15 - Comments: Teraoka, Takuro; Hiroto, Satoru; Shinokubo, Hiroshi Iridium-catalyzed direct tetraborylation of perylene bisimides. Organic letters 13(10) (2011) 2532-2535 Space group: P 21 21 21 Cell volume: 6896 Cell parameters: 11.01; 18.968; 33.023; 90; 90; 90; |
| COD ID: 1502104 | |
| CIF file | Formula: - C25.5 H29.5 N1.5 O3.5 P - Comments: Ingle, Gajendrasingh K.; Liang, Yuxue; Mormino, Michael G.; Li, Guilong; Fronczek, Frank R.; Antilla, Jon C. Chiral magnesium BINOL phosphate-catalyzed phosphination of imines: access to enantioenriched α-amino phosphine oxides. Organic letters 13(8) (2011) 2054-2057 Space group: P 21 21 21 Cell volume: 4834.1 Cell parameters: 10.7654; 19.089; 23.5235; 90; 90; 90; |
| COD ID: 1502108 | |
| CIF file | Formula: - C13 H16 O4 - Comments: Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters 13(8) (2011) 2086-2089 Space group: P 21 21 21 Cell volume: 1197.9 Cell parameters: 8.8027; 9.9264; 13.7092; 90; 90; 90; |
| COD ID: 1502110 | |
| CIF file | Formula: - C22 H31 N O5 Si - Comments: Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters 13(8) (2011) 2086-2089 Space group: P 21 21 21 Cell volume: 2246.2 Cell parameters: 10.7398; 8.2057; 25.488; 90; 90; 90; |
| COD ID: 1502111 | |
| CIF file | Formula: - C15 H26 O2 - Comments: Ushakov, Dmitry B.; Navickas, Vaidotas; Ströbele, Markus; Maichle-Mössmer, Cäcilia; Sasse, Florenz; Maier, Martin E. Total synthesis and biological evaluation of (-)-9-deoxy-englerin A. Organic letters 13(8) (2011) 2090-2093 Space group: P 21 21 21 Cell volume: 2858.9 Cell parameters: 12.146; 12.8011; 18.387; 90; 90; 90; |
| COD ID: 1502112 | |
| CIF file | Formula: - C12 H20 O2 - Comments: Ushakov, Dmitry B.; Navickas, Vaidotas; Ströbele, Markus; Maichle-Mössmer, Cäcilia; Sasse, Florenz; Maier, Martin E. Total synthesis and biological evaluation of (-)-9-deoxy-englerin A. Organic letters 13(8) (2011) 2090-2093 Space group: P 21 21 21 Cell volume: 1140.2 Cell parameters: 7.5572; 8.5747; 17.595; 90; 90; 90; |
| COD ID: 1502133 | |
| CIF file | Formula: - C32 H29 Br N2 O7 - Comments: Duan, Shu-Wen; An, Jing; Chen, Jia-Rong; Xiao, Wen-Jing Facile synthesis of enantioenriched Cγ-tetrasubstituted α-amino acid derivatives via an asymmetric nucleophilic addition/protonation cascade. Organic letters 13(9) (2011) 2290-2293 Space group: P 21 21 21 Cell volume: 3040.3 Cell parameters: 10.774; 14.2273; 19.8345; 90; 90; 90; |
| COD ID: 1502143 | |
| CIF file | Formula: - C25 H27 N O3 - Comments: Bentley, Scott A.; Davies, Stephen G.; Lee, James A.; Roberts, Paul M.; Thomson, James E. Conjugate addition of lithium N-phenyl-N-(α-methylbenzyl)amide: application to the asymmetric synthesis of (R)-(-)-angustureine. Organic letters 13(10) (2011) 2544-2547 Space group: P 21 21 21 Cell volume: 2100.97 Cell parameters: 9.6818; 14.3637; 15.1077; 90; 90; 90; |
| COD ID: 1502146 | |
| CIF file | Formula: - C24 H25 Br N2 O8 - Comments: Cheng, Mou-Nuo; Wang, Hao; Gong, Liu-Zhu Asymmetic organocatalytic 1,3-dipolar cycloaddition of azomethine ylide to methyl 2-(2-nitrophenyl)acrylate for the synthesis of diastereoisomers of spirotryprostatin A. Organic letters 13(9) (2011) 2418-2421 Space group: P 21 21 21 Cell volume: 2499 Cell parameters: 8.066; 8.898; 34.816; 90; 90; 90; |
| COD ID: 1502154 | |
| CIF file | Formula: - C13 H18 Cl N - Comments: Yoshida, Akiko; Hattori, Gaku; Miyake, Yoshihiro; Nishibayashi, Yoshiaki Copper-catalyzed enantioselective propargylic amination of nonaromatic propargylic esters with amines. Organic letters 13(9) (2011) 2460-2463 Space group: P 21 21 21 Cell volume: 1258.08 Cell parameters: 8.9833; 10.722; 13.0616; 90; 90; 90; |
| COD ID: 1502155 | |
| CIF file | Formula: - C16 H14 O3 - Comments: Hodgson, David M.; Talbot, Eric P. A.; Clark, Barry P. Stereoselective synthesis of β-(hydroxymethylaryl/alkyl)-α-methylene-γ-butyrolactones. Organic letters 13(10) (2011) 2594-2597 Space group: P 21 21 21 Cell volume: 3818.95 Cell parameters: 10.1029; 12.3851; 30.521; 90; 90; 90; |
| COD ID: 1502171 | |
| CIF file | Formula: - C38 H39 N O3 - Comments: Luan, Yi; Schaus, Scott E. Multicomponent Mannich reactions with boron enolates derived from diazo esters and 9-BBN. Organic letters 13(9) (2011) 2510-2513 Space group: P 21 21 21 Cell volume: 3006.1 Cell parameters: 10.3359; 14.861; 19.5709; 90; 90; 90; |
| COD ID: 1502187 | |
| CIF file | Formula: - C11 H11 Br O2 - Comments: Tan, Chong Kiat; Zhou, Ling; Yeung, Ying-Yeung Aminothiocarbamate-catalyzed asymmetric bromolactonization of 1,2-disubstituted olefinic acids. Organic letters 13(10) (2011) 2738-2741 Space group: P 21 21 21 Cell volume: 2031.44 Cell parameters: 5.7541; 12.5905; 28.0403; 90; 90; 90; |
| COD ID: 1502189 | |
| CIF file | Formula: - C21 H22 O2 S - Comments: Thaler, Tobias; Guo, Li-Na; Steib, Andreas K.; Raducan, Mihai; Karaghiosoff, Konstantin; Mayer, Peter; Knochel, Paul Sulfoxide-alkene hybrids: a new class of chiral ligands for the Hayashi-Miyaura reaction. Organic letters 13(12) (2011) 3182-3185 Space group: P 21 21 21 Cell volume: 1772.43 Cell parameters: 6.4067; 13.1037; 21.1126; 90; 90; 90; |
| COD ID: 1502199 | |
| CIF file | Formula: - C15 H22 O4 - Comments: Wang, Peng-Cheng; Ran, Xin-Hui; Luo, Huai-Rong; Hu, Jiang-Miao; Chen, Rui; Ma, Qing-Yun; Dai, Hao-Fu; Liu, Yu-Qing; Xie, Ming-Jin; Zhou, Jun; Zhao, You-Xing Volvalerelactones A and B, two new sesquiterpenoid lactones with an unprecedented skeleton from Valeriana officinalis var. latifolia. Organic letters 13(12) (2011) 3036-3039 Space group: P 21 21 21 Cell volume: 1464.9 Cell parameters: 8.4887; 10.4646; 16.491; 90; 90; 90; |
| COD ID: 1502200 | |
| CIF file | Formula: - C30 H46 O6 - Comments: Wang, Peng-Cheng; Ran, Xin-Hui; Luo, Huai-Rong; Hu, Jiang-Miao; Chen, Rui; Ma, Qing-Yun; Dai, Hao-Fu; Liu, Yu-Qing; Xie, Ming-Jin; Zhou, Jun; Zhao, You-Xing Volvalerelactones A and B, two new sesquiterpenoid lactones with an unprecedented skeleton from Valeriana officinalis var. latifolia. Organic letters 13(12) (2011) 3036-3039 Space group: P 21 21 21 Cell volume: 2904.6 Cell parameters: 13.27; 13.618; 16.073; 90; 90; 90; |
| COD ID: 1502204 | |
| CIF file | Formula: - C15 H21 N O4 S - Comments: Churches, Quentin I.; White, Jonathan M.; Hutton, Craig A. Synthesis of β,γ-dihydroxyhomotyrosines by a tandem Petasis-asymmetric dihydroxylation approach. Organic letters 13(11) (2011) 2900-2903 Space group: P 21 21 21 Cell volume: 1623.28 Cell parameters: 5.8864; 13.4539; 20.4973; 90; 90; 90; |
| COD ID: 1502206 | |
| CIF file | Formula: - C23 H19 N O3 Se - Comments: Marcos, Vanesa; Alemán, Jose; Ruano, Jose L Garcia; Marini, Francesca; Tiecco, Marcello Asymmetric synthesis of α-alkyl α-selenocarbonyl compounds catalyzed by bifunctional organocatalysts. Organic letters 13(12) (2011) 3052-3055 Space group: P 21 21 21 Cell volume: 5835.5 Cell parameters: 8.6811; 13.9912; 48.0454; 90; 90; 90; |
| COD ID: 1502208 | |
| CIF file | Formula: - C16 H15 N O3 S - Comments: Zhou, Lin; Lin, Lili; Ji, Jie; Xie, Mingsheng; Liu, Xiaohua; Feng, Xiaoming Catalytic asymmetric vinylogous Mannich-type (AVM) reaction of nonactivated α-angelica lactone. Organic letters 13(12) (2011) 3056-3059 Space group: P 21 21 21 Cell volume: 1490.69 Cell parameters: 10.487; 11.7829; 12.0638; 90; 90; 90; |
| COD ID: 1502213 | |
| CIF file | Formula: - C17 H25 N O7 - Comments: Shing, Tony K. M.; So, King H. Facile and enantiospecific syntheses of (6S,7R)-6-chloro-7-benzyloxy-, (7S)-halo-, and (7S)-hydroxy-cocaine and natural (-)-cocaine from D-(-)-ribose. Organic letters 13(11) (2011) 2916-2919 Space group: P 21 21 21 Cell volume: 1771.3 Cell parameters: 8.7316; 11.9598; 16.9623; 90; 90; 90; |
| COD ID: 1502215 | |
| CIF file | Formula: - C31 H29 N O8 - Comments: Shing, Tony K. M.; So, King H. Facile and enantiospecific syntheses of (6S,7R)-6-chloro-7-benzyloxy-, (7S)-halo-, and (7S)-hydroxy-cocaine and natural (-)-cocaine from D-(-)-ribose. Organic letters 13(11) (2011) 2916-2919 Space group: P 21 21 21 Cell volume: 2785 Cell parameters: 9.897; 11.401; 24.683; 90; 90; 90; |
| COD ID: 1502219 | |
| CIF file | Formula: - C30 H32 Cl F O4 - Comments: Shibatomi, Kazutaka; Narayama, Akira; Soga, Yoshinori; Muto, Tsubasa; Iwasa, Seiji Enantioselective gem-chlorofluorination of active methylene compounds using a chiral spiro oxazoline ligand. Organic letters 13(11) (2011) 2944-2947 Space group: P 21 21 21 Cell volume: 2801.4 Cell parameters: 10.3798; 14.597; 18.4891; 90; 90; 90; |
| COD ID: 1502223 | |
| CIF file | Formula: - C30 H25 F6 N3 O3 - Comments: Knight, John D.; Sauer, Scott J.; Coltart, Don M. Asymmetric total synthesis of the antimalarial drug (+)-mefloquine hydrochloride via chiral N-amino cyclic carbamate hydrazones. Organic letters 13(12) (2011) 3118-3121 Space group: P 21 21 21 Cell volume: 2650.9 Cell parameters: 7.2964; 13.4415; 27.0296; 90; 90; 90; |
| COD ID: 1502226 | |
| CIF file | Formula: - C29 H32 N2 O8 S - Comments: Yao, Ming; Lu, Chong-Dao Three-component reactions of sulfonylimidates, silyl glyoxylates and N-tert-butanesulfinyl aldimines: an efficient, diastereoselective, and enantioselective synthesis of Cyclic N-sulfonylamidines. Organic letters 13(10) (2011) 2782-2785 Space group: P 21 21 21 Cell volume: 2938 Cell parameters: 10.792; 15.356; 17.73; 90; 90; 90; |
| COD ID: 1502266 | |
| CIF file | Formula: - C20 H17 N O - Comments: Wang, Lu; Li, Guijie; Liu, Yuanhong Gold-catalyzed deacylative cycloisomerization reactions of 3-acylindole/ynes: a new approach for carbazole synthesis. Organic letters 13(15) (2011) 3786-3789 Space group: P 21 21 21 Cell volume: 1500.2 Cell parameters: 5.8247; 13.4193; 19.193; 90; 90; 90; |
| COD ID: 1502267 | |
| CIF file | Formula: - C20 H17 N O2 - Comments: Wang, Lu; Li, Guijie; Liu, Yuanhong Gold-catalyzed deacylative cycloisomerization reactions of 3-acylindole/ynes: a new approach for carbazole synthesis. Organic letters 13(15) (2011) 3786-3789 Space group: P 21 21 21 Cell volume: 1542 Cell parameters: 5.5936; 13.6523; 20.192; 90; 90; 90; |
| COD ID: 1502273 | |
| CIF file | Formula: - C23 H22 N2 O - Comments: Shacklady-McAtee, Danielle M; Dasgupta, Srimoyee; Watson, Mary P. Nickel(0)-catalyzed cyclization of N-benzoylaminals for isoindolinone synthesis. Organic letters 13(13) (2011) 3490-3493 Space group: P 21 21 21 Cell volume: 1830.7 Cell parameters: 9.928; 10.295; 17.911; 90; 90; 90; |
| COD ID: 1502275 | |
| CIF file | Formula: - C22 H28 N2 O2 S - Comments: Hatcher, John M.; Kohler, Mark C.; Coltart, Don M. Catalytic asymmetric addition of thiols to nitrosoalkenes leading to chiral non-racemic α-sulfenyl ketones. Organic letters 13(15) (2011) 3810-3813 Space group: P 21 21 21 Cell volume: 6084.81 Cell parameters: 12.1885; 21.5857; 23.1276; 90; 90; 90; |
| COD ID: 1502276 | |
| CIF file | Formula: - C13 H14 Br N O3 - Comments: Kwiatkowski, Piotr; Dudziński, Krzysztof; Łyżwa, Dawid Effect of high pressure on the organocatalytic asymmetric Michael reaction: highly enantioselective synthesis of γ-nitroketones with quaternary stereogenic centers. Organic letters 13(14) (2011) 3624-3627 Space group: P 21 21 21 Cell volume: 1284.95 Cell parameters: 6.3321; 9.3119; 21.7921; 90; 90; 90; |
| COD ID: 1502277 | |
| CIF file | Formula: - C14 H15 Br N2 O2 - Comments: Kwiatkowski, Piotr; Dudziński, Krzysztof; Łyżwa, Dawid Effect of high pressure on the organocatalytic asymmetric Michael reaction: highly enantioselective synthesis of γ-nitroketones with quaternary stereogenic centers. Organic letters 13(14) (2011) 3624-3627 Space group: P 21 21 21 Cell volume: 1319.93 Cell parameters: 9.1006; 10.0753; 14.3954; 90; 90; 90; |
| COD ID: 1502279 | |
| CIF file | Formula: - C17 H20 O4 - Comments: Kuang, Yulong; Liu, Xiaohua; Chang, Lu; Wang, Min; Lin, Lili; Feng, Xiaoming Catalytic asymmetric conjugate allylation of coumarins. Organic letters 13(15) (2011) 3814-3817 Space group: P 21 21 21 Cell volume: 1596.4 Cell parameters: 8.5637; 12.1843; 15.3; 90; 90; 90; |
| COD ID: 1502290 | |
| CIF file | Formula: - C29 H44 O14 - Comments: Shi, Yi-Ming; Li, Xing-Yao; Li, Xiao-Nian; Luo, Xiao; Xue, Yong-Bo; Liang, Cheng-Qin; Zou, Juan; Kong, Ling-Mei; Li, Yan; Pu, Jian-Xin; Xiao, Wei-Lie; Sun, Han-Dong Schicagenins A-C: three cagelike nortriterpenoids from leaves and stems of Schisandra chinensis. Organic letters 13(15) (2011) 3848-3851 Space group: P 21 21 21 Cell volume: 3195.76 Cell parameters: 11.1986; 12.092; 23.6; 90; 90; 90; |
| COD ID: 1502291 | |
| CIF file | Formula: - C34 H43 Cl3 N2 O18 - Comments: Jung, Michael E.; Koch, Pierre An efficient synthesis of the protected carbohydrate moiety of Brasilicardin A. Organic letters 13(14) (2011) 3710-3713 Space group: P 21 21 21 Cell volume: 4164.7 Cell parameters: 9.1634; 15.94; 28.513; 90; 90; 90; |
| COD ID: 1502294 | |
| CIF file | Formula: - C24 H26 N2 O6 - Comments: Zhao, Bing-Xin; Wang, Ying; Zhang, Dong-Mei; Jiang, Ren-Wang; Wang, Guo-Cai; Shi, Jun-Min; Huang, Xiao-Jun; Chen, Wei-Min; Che, Chun-Tao; Ye, Wen-Cai Flueggines A and B, two new dimeric indolizidine alkaloids from Flueggea virosa. Organic letters 13(15) (2011) 3888-3891 Space group: P 21 21 21 Cell volume: 2048.98 Cell parameters: 5.9124; 11.5275; 30.0634; 90; 90; 90; |
| COD ID: 1502299 | |
| CIF file | Formula: - C19 H23 N3 O8 - Comments: Williams, David E.; Dalisay, Doralyn S.; Patrick, Brian O.; Matainaho, Teatulohi; Andrusiak, Kerry; Deshpande, Raamesh; Myers, Chad L.; Piotrowski, Jeff S.; Boone, Charles; Yoshida, Minoru; Andersen, Raymond J. Padanamides A and B, highly modified linear tetrapeptides produced in culture by a Streptomyces sp. isolated from a marine sediment. Organic letters 13(15) (2011) 3936-3939 Space group: P 21 21 21 Cell volume: 2037.6 Cell parameters: 7.9106; 11.5982; 22.2085; 90; 90; 90; |
| COD ID: 1502301 | |
| CIF file | Formula: - C13 H17 N3 O7 - Comments: Williams, David E.; Dalisay, Doralyn S.; Patrick, Brian O.; Matainaho, Teatulohi; Andrusiak, Kerry; Deshpande, Raamesh; Myers, Chad L.; Piotrowski, Jeff S.; Boone, Charles; Yoshida, Minoru; Andersen, Raymond J. Padanamides A and B, highly modified linear tetrapeptides produced in culture by a Streptomyces sp. isolated from a marine sediment. Organic letters 13(15) (2011) 3936-3939 Space group: P 21 21 21 Cell volume: 1525.5 Cell parameters: 6.8458; 8.1555; 27.3235; 90; 90; 90; |
| COD ID: 1502316 | |
| CIF file | Formula: - C23 H24 Cl N O5 S - Comments: Medeiros, Matthew R.; Schaus, Scott E.; Porco, Jr, John A A cycloisomerization/Friedel-Crafts alkylation strategy for the synthesis of pyrano[3,4-b]indoles. Organic letters 13(15) (2011) 4012-4015 Space group: P 21 21 21 Cell volume: 2219.13 Cell parameters: 5.176; 9.5637; 44.8293; 90; 90; 90; |
| COD ID: 1502322 | |
| CIF file | Formula: - C15 H22 O4 - Comments: Hao, Hong-Dong; Li, Yun; Han, Wei-Bo; Wu, Yikang A hydrogen peroxide based access to qinghaosu (artemisinin). Organic letters 13(16) (2011) 4212-4215 Space group: P 21 21 21 Cell volume: 1472.7 Cell parameters: 9.0867; 12.11; 13.383; 90; 90; 90; |
| COD ID: 1502325 | |
| CIF file | Formula: - C26 H30 N2 O7 - Comments: Varga, Szilárd; Jakab, Gergely; Drahos, László; Holczbauer, Tamás; Czugler, Mátyás; Soós, Tibor Double diastereocontrol in bifunctional thiourea organocatalysis: iterative Michael-Michael-Henry sequence regulated by the configuration of chiral catalysts. Organic letters 13(20) (2011) 5416-5419 Space group: P 21 21 21 Cell volume: 2473.02 Cell parameters: 6.0225; 19.0267; 21.5818; 90; 90; 90; |
| COD ID: 1502334 | |
| CIF file | Formula: - C24 H17 Br O3 - Comments: Rong, Zi-Qiang; Jia, Min-Qiang; You, Shu-Li Enantioselective N-heterocyclic carbene-catalyzed Michael addition to α,β-unsaturated aldehydes by redox oxidation. Organic letters 13(15) (2011) 4080-4083 Space group: P 21 21 21 Cell volume: 1926.7 Cell parameters: 7.6826; 11.6731; 21.484; 90; 90; 90; |
| COD ID: 1502344 | |
| CIF file | Formula: - C23 H18 O - Comments: Jin, Weiwei; Du, Wangming; Yang, Qin; Yu, Haifeng; Chen, Jiping; Yu, Zhengkun Regio- and stereoselective synthesis of multisubstituted olefins and conjugate dienes by using α-oxo ketene dithioacetals as the building blocks. Organic letters 13(16) (2011) 4272-4275 Space group: P 21 21 21 Cell volume: 1723.9 Cell parameters: 10.4782; 12.795; 12.858; 90; 90; 90; |
| COD ID: 1502350 | |
| CIF file | Formula: - C28 H32 O4 S - Comments: Soni, Rina; Collinson, John-Michael; Clarkson, Guy C.; Wills, Martin An unexpected directing effect in the asymmetric transfer hydrogenation of α,α-disubstituted ketones. Organic letters 13(16) (2011) 4304-4307 Space group: P 21 21 21 Cell volume: 2341.09 Cell parameters: 7.43712; 8.62914; 36.4793; 90; 90; 90; |
| COD ID: 1502363 | |
| CIF file | Formula: - C16 H15 N O3 - Comments: Carroll, William R.; Zhao, Chen; Smith, Mark D.; Pellechia, Perry J.; Shimizu, Ken D. A molecular balance for measuring aliphatic CH-π interactions. Organic letters 13(16) (2011) 4320-4323 Space group: P 21 21 21 Cell volume: 1308.98 Cell parameters: 10.1874; 10.7672; 11.9335; 90; 90; 90; |
| COD ID: 1502375 | |
| CIF file | Formula: - C15 H14 O4 - Comments: Zhu, Xi; Lin, Aijun; Shi, Yan; Guo, Jingyu; Zhu, Chengjian; Cheng, Yixiang Enantioselective synthesis of polycyclic coumarin derivatives catalyzed by an in situ formed primary amine-imine catalyst. Organic letters 13(16) (2011) 4382-4385 Space group: P 21 21 21 Cell volume: 1210.27 Cell parameters: 7.1044; 9.9689; 17.0887; 90; 90; 90; |
| COD ID: 1502380 | |
| CIF file | Formula: - C25 H29 N O4 - Comments: Buchanan, Grant S.; Dai, Huifang; Hsung, Richard P.; Gerasyuto, Aleksey I.; Scheinebeck, Casi M. Asymmetric aza-[3+3] annulation in the synthesis of indolizidines: an unexpected reversal of regiochemistry. Organic letters 13(16) (2011) 4402-4405 Space group: P 21 21 21 Cell volume: 2171.1 Cell parameters: 5.8701; 13.7261; 26.946; 90; 90; 90; |
| COD ID: 1502383 | |
| CIF file | Formula: - C33 H39 N O4 S2 - Comments: Zhang, Wei; Sato, Kasumi; Kato, Atsushi; Jia, Yue-Mei; Hu, Xiang-Guo; Wilson, Francis X.; van Well, Renate; Horne, Graeme; Fleet, George W. J.; Nash, Robert J.; Yu, Chu-Yi Synthesis of fully substituted polyhydroxylated pyrrolizidines via Cope-House cyclization. Organic letters 13(16) (2011) 4414-4417 Space group: P 21 21 21 Cell volume: 3033.5 Cell parameters: 10.1866; 13.017; 22.877; 90; 90; 90; |
| COD ID: 1502384 | |
| CIF file | Formula: - C33 H39 N O4 S2 - Comments: Zhang, Wei; Sato, Kasumi; Kato, Atsushi; Jia, Yue-Mei; Hu, Xiang-Guo; Wilson, Francis X.; van Well, Renate; Horne, Graeme; Fleet, George W. J.; Nash, Robert J.; Yu, Chu-Yi Synthesis of fully substituted polyhydroxylated pyrrolizidines via Cope-House cyclization. Organic letters 13(16) (2011) 4414-4417 Space group: P 21 21 21 Cell volume: 3037.1 Cell parameters: 8.7786; 14.075; 24.58; 90; 90; 90; |
| COD ID: 1502393 | |
| CIF file | Formula: - C26 H25 N O7 S - Comments: Peng, Jing; Huang, Xin; Jiang, Lin; Cui, Hai-Lei; Chen, Ying-Chun Tertiary amine-catalyzed chemoselective and asymmetric [3 + 2] annulation of Morita-Baylis-Hillman carbonates of isatins with propargyl sulfones. Organic letters 13(17) (2011) 4584-4587 Space group: P 21 21 21 Cell volume: 2511.5 Cell parameters: 8.6914; 12.794; 22.586; 90; 90; 90; |
| COD ID: 1502399 | |
| CIF file | Formula: - C13 H12 Cl N O - Comments: Zhang, Xinying; Jia, Xuefei; Fang, Liangliang; Liu, Nan; Wang, Jianji; Fan, Xuesen Tandem reactions of 1,2-allenic ketones leading to substituted benzenes and α,β-unsaturated nitriles. Organic letters 13(19) (2011) 5024-5027 Space group: P 21 21 21 Cell volume: 1253.3 Cell parameters: 8.14; 11.896; 12.943; 90; 90; 90; |
| COD ID: 1502400 | |
| CIF file | Formula: - C38 H42 Br N O3 - Comments: Zhang, Zhihui; Baubet, Valérie; Ventocilla, Christian; Xiang, Chaomei; Dahmane, Nadia; Winkler, Jeffrey D. Stereoselective synthesis of F-ring saturated estrone-derived inhibitors of Hedgehog signaling based on cyclopamine. Organic letters 13(18) (2011) 4786-4789 Space group: P 21 21 21 Cell volume: 6273.6 Cell parameters: 9.389; 15.1811; 44.014; 90; 90; 90; |
| COD ID: 1502413 | |
| CIF file | Formula: - C17 H22 O2 - Comments: Ito, Yuji; Takahashi, Kazunori; Nagase, Hiromasa; Honda, Toshio Integral stereocontrolled synthesis of a spiro-norlignan, sequosempervirin A: revision of absolute configuration. Organic letters 13(17) (2011) 4640-4643 Space group: P 21 21 21 Cell volume: 1447.47 Cell parameters: 7.1962; 9.5745; 21.0083; 90; 90; 90; |
| COD ID: 1502419 | |
| CIF file | Formula: - C21 H23 N3 O4 - Comments: Sau, Míriam; Rodríguez-Escrich, Carles; Pericàs, Miquel A Copper-free intramolecular alkyne-azide cycloadditions leading to seven-membered heterocycles. Organic letters 13(19) (2011) 5044-5047 Space group: P 21 21 21 Cell volume: 1850.15 Cell parameters: 6.662; 10.282; 27.01; 90; 90; 90; |
| COD ID: 1502423 | |
| CIF file | Formula: - C66.5 H44 Cl3 F6 Fe2 N2 O17 S2 - Comments: Li, Yang; Cao, Rui; Lippard, Stephen J. Design and synthesis of a novel triptycene-based ligand for modeling carboxylate-bridged diiron enzyme active sites. Organic letters 13(19) (2011) 5052-5055 Space group: P 21 21 21 Cell volume: 6877.5 Cell parameters: 15.8758; 20.1039; 21.5485; 90; 90; 90; |
| COD ID: 1502425 | |
| CIF file | Formula: - C29 H24 N2 O3 - Comments: Dong, Shunxi; Liu, Xiaohua; Zhang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric synthesis of 3,4-diaminochroman-2-ones promoted by guanidine and bisguanidium salt. Organic letters 13(19) (2011) 5060-5063 Space group: P 21 21 21 Cell volume: 2311.9 Cell parameters: 9.768; 10.747; 22.023; 90; 90; 90; |
| COD ID: 1502426 | |
| CIF file | Formula: - C29 H24 N2 O3 - Comments: Dong, Shunxi; Liu, Xiaohua; Zhang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric synthesis of 3,4-diaminochroman-2-ones promoted by guanidine and bisguanidium salt. Organic letters 13(19) (2011) 5060-5063 Space group: P 21 21 21 Cell volume: 2343.4 Cell parameters: 11.19; 13.078; 16.013; 90; 90; 90; |
| COD ID: 1502434 | |
| CIF file | Formula: - C18 H20 N2 O7 - Comments: Shi, Feng; Luo, Shi-Wei; Tao, Zhong-Lin; He, Long; Yu, Jie; Tu, Shu-Jiang; Gong, Liu-Zhu The catalytic asymmetric 1,3-dipolar cycloaddition of ynones with azomethine ylides. Organic letters 13(17) (2011) 4680-4683 Space group: P 21 21 21 Cell volume: 1872.13 Cell parameters: 8.857; 11.004; 19.2087; 90; 90; 90; |
| COD ID: 1502441 | |
| CIF file | Formula: - C17 H22 O12 - Comments: Bigovic, Miljan; Maslak, Veselin; Tokic-Vujosevic, Zorana; Divjakovic, Vladimir; Saicic, Radomir N. A useful synthetic equivalent of a hydroxyacetone enolate. Organic letters 13(17) (2011) 4720-4723 Space group: P 21 21 21 Cell volume: 2031.4 Cell parameters: 8.3121; 8.8281; 27.683; 90; 90; 90; |
| COD ID: 1502449 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Woolven, Holly; González-Rodríguez, Carlos; Marco, Isabel; Thompson, Amber L.; Willis, Michael C. DABCO-bis(sulfur dioxide), DABSO, as a convenient source of sulfur dioxide for organic synthesis: utility in sulfonamide and sulfamide preparation. Organic letters 13(18) (2011) 4876-4878 Space group: P 21 21 21 Cell volume: 950.09 Cell parameters: 6.6019; 7.9218; 18.1666; 90; 90; 90; |
| COD ID: 1502453 | |
| CIF file | Formula: - C22 H17 Br O - Comments: Okamoto, Ryuichi; Okazaki, Eri; Noguchi, Keiichi; Tanaka, Ken Rhodium-catalyzed olefin isomerization/enantioselective intramolecular Alder-ene reaction cascade. Organic letters 13(18) (2011) 4894-4897 Space group: P 21 21 21 Cell volume: 1688.35 Cell parameters: 5.6443; 8.8426; 33.8277; 90; 90; 90; |
| COD ID: 1502455 | |
| CIF file | Formula: - C18 H13 N3 O - Comments: Chen, Weiliang; Cai, Yunfei; Fu, Xuan; Liu, Xiaohua; Lin, Lili; Feng, Xiaoming Enantioselective one-pot synthesis of 2-amino-4-(indol-3-yl)-4H-chromenes. Organic letters 13(18) (2011) 4910-4913 Space group: P 21 21 21 Cell volume: 1404.4 Cell parameters: 9.896; 11.39; 12.46; 90; 90; 90; |
| COD ID: 1502461 | |
| CIF file | Formula: - C31 H31 N3 O6 - Comments: Yang, Zhicai; Jin, Xiaomin; Guaciaro, Michael; Molino, Bruce F.; Mocek, Ursula; Reategui, Ricardo; Rhea, Joshua; Morley, Tim The revised structure, total synthesis, and absolute configuration of streptophenazine A. Organic letters 13(20) (2011) 5436-5439 Space group: P 21 21 21 Cell volume: 2701.25 Cell parameters: 8.786; 10.5897; 29.0329; 90; 90; 90; |
| COD ID: 1502466 | |
| CIF file | Formula: - C12 H21 N O3 S - Comments: Ruan, Shu-Tang; Luo, Jie-Min; Du, Yu; Huang, Pei-Qiang Asymmetric vinylogous Mannich reactions: a versatile approach to functionalized heterocycles. Organic letters 13(18) (2011) 4938-4941 Space group: P 21 21 21 Cell volume: 1371.55 Cell parameters: 5.8404; 12.8879; 18.2216; 90; 90; 90; |
| COD ID: 1502470 | |
| CIF file | Formula: - C28 H37 Br O5 - Comments: Curti, Claudio; Battistini, Lucia; Sartori, Andrea; Lodola, Alessio; Mor, Marco; Rassu, Gloria; Pelosi, Giorgio; Zanardi, Franca; Casiraghi, Giovanni Catalytic, asymmetric hypervinylogous Mukaiyama aldol reactions of extended furan-based silyl enolates. Organic letters 13(17) (2011) 4738-4741 Space group: P 21 21 21 Cell volume: 2760.6 Cell parameters: 23.426; 18.992; 6.205; 90; 90; 90; |
| COD ID: 1502479 | |
| CIF file | Formula: - C28 H22 O4 - Comments: Biswas, Anup; De Sarkar, Suman; Fröhlich, Roland; Studer, Armido Highly stereoselective synthesis of 1,2,3-trisubstituted indanes via oxidative N-heterocyclic carbene-catalyzed cascades. Organic letters 13(18) (2011) 4966-4969 Space group: P 21 21 21 Cell volume: 2158.5 Cell parameters: 9.6259; 12.6135; 17.7779; 90; 90; 90; |
| COD ID: 1502483 | |
| CIF file | Formula: - C18 H20 - Comments: García-García, Patricia; Martínez, Alberto; Sanjuán, Ana M; Fernández-Rodríguez, Manuel A; Sanz, Roberto Gold(I)-catalyzed tandem cyclization-selective migration reaction of 1,3-dien-5-ynes: regioselective synthesis of highly substituted benzenes. Organic letters 13(18) (2011) 4970-4973 Space group: P 21 21 21 Cell volume: 1346.5 Cell parameters: 7.8299; 8.1023; 21.225; 90; 90; 90; |
| COD ID: 1502491 | |
| CIF file | Formula: - C32 H34 N2 O10 - Comments: Sun, Deqian; Zhao, Qiwu; Li, Chaozhong Total synthesis of (+)-decursivine. Organic letters 13(19) (2011) 5302-5305 Space group: P 21 21 21 Cell volume: 3183 Cell parameters: 8.974; 14.304; 24.8; 90; 90; 90; |
| COD ID: 1502492 | |
| CIF file | Formula: - C40 H40 N2 O9 S - Comments: Sun, Deqian; Zhao, Qiwu; Li, Chaozhong Total synthesis of (+)-decursivine. Organic letters 13(19) (2011) 5302-5305 Space group: P 21 21 21 Cell volume: 3652 Cell parameters: 12.793; 13.184; 21.65; 90; 90; 90; |
| COD ID: 1502500 | |
| CIF file | Formula: - C19 H21 N3 O7 - Comments: Fu, Peng; Liu, Peipei; Li, Xia; Wang, Yi; Wang, Shuxia; Hong, Kui; Zhu, Weiming Cyclic bipyridine glycosides from the marine-derived actinomycete Actinoalloteichus cyanogriseus WH1-2216-6. Organic letters 13(22) (2011) 5948-5951 Space group: P 21 21 21 Cell volume: 1818.98 Cell parameters: 7.1319; 10.2706; 24.8328; 90; 90; 90; |
| COD ID: 1502502 | |
| CIF file | Formula: - C19 H21 N3 O7 - Comments: Fu, Peng; Liu, Peipei; Li, Xia; Wang, Yi; Wang, Shuxia; Hong, Kui; Zhu, Weiming Cyclic bipyridine glycosides from the marine-derived actinomycete Actinoalloteichus cyanogriseus WH1-2216-6. Organic letters 13(22) (2011) 5948-5951 Space group: P 21 21 21 Cell volume: 1885.8 Cell parameters: 7.2572; 10.3636; 25.073; 90; 90; 90; |
| COD ID: 1502503 | |
| CIF file | Formula: - C27 H26 O4 - Comments: Lv, Hui; Mo, Junming; Fang, Xinqiang; Chi, Yonggui Robin Formal Diels-Alder reactions of chalcones and formylcyclopropanes catalyzed by chiral N-heterocyclic carbenes. Organic letters 13(19) (2011) 5366-5369 Space group: P 21 21 21 Cell volume: 2169.74 Cell parameters: 10.1002; 13.2118; 16.2598; 90; 90; 90; |
| COD ID: 1502508 | |
| CIF file | Formula: - C44 H52 N4 O8 - Comments: Zhong, Cheng; Wang, Yikai; Hung, Alvin W.; Schreiber, Stuart L.; Young, Damian W. Diastereoselective control of intramolecular aza-Michael reactions using achiral catalysts. Organic letters 13(20) (2011) 5556-5559 Space group: P 21 21 21 Cell volume: 4073.81 Cell parameters: 10.3717; 16.0215; 24.5159; 90; 90; 90; |
| COD ID: 1502514 | |
| CIF file | Formula: - C22 H23 Br N2 O2 - Comments: Lee, Yunmi; Klausen, Rebekka S.; Jacobsen, Eric N. Thiourea-catalyzed enantioselective iso-Pictet-Spengler reactions. Organic letters 13(20) (2011) 5564-5567 Space group: P 21 21 21 Cell volume: 2034.82 Cell parameters: 10.1786; 10.4497; 19.1308; 90; 90; 90; |
| COD ID: 1502515 | |
| CIF file | Formula: - C20 H28 N2 O3 - Comments: Lee, Yunmi; Klausen, Rebekka S.; Jacobsen, Eric N. Thiourea-catalyzed enantioselective iso-Pictet-Spengler reactions. Organic letters 13(20) (2011) 5564-5567 Space group: P 21 21 21 Cell volume: 1966.52 Cell parameters: 10.5196; 11.1008; 16.8401; 90; 90; 90; |
| COD ID: 1502526 | |
| CIF file | Formula: - C25 H26 Br N O5 - Comments: Teng, Huai-Long; Luo, Fei-Long; Tao, Hai-Yan; Wang, Chun-Jiang A facile Cu(I)/BINAP-catalyzed asymmetric approach to functionalized pyroglutamate derivatives bearing a unique quaternary stereogenic center. Organic letters 13(20) (2011) 5600-5603 Space group: P 21 21 21 Cell volume: 2432.1 Cell parameters: 7.8787; 11.789; 26.185; 90; 90; 90; |
| COD ID: 1502527 | |
| CIF file | Formula: - C14 H13 Cl N2 O2 - Comments: Gutierrez, Elisa G.; Wong, Casey J.; Sahin, Aziza H.; Franz, Annaliese K. Enantioselective and regioselective indium(III)-catalyzed addition of pyrroles to isatins. Organic letters 13(21) (2011) 5754-5757 Space group: P 21 21 21 Cell volume: 1316.7 Cell parameters: 5.296; 12.43; 20.001; 90; 90; 90; |
| COD ID: 1502528 | |
| CIF file | Formula: - C19 H15 N O5 - Comments: Hong, Bor-Cherng; Kotame, Prakash; Lee, Gene-Hsiang Asymmetric synthesis of 3,4-dihydrocoumarin motif with an all-carbon quaternary stereocenter via a Michael-acetalization sequence with bifunctional amine-thiourea organocatalysts. Organic letters 13(21) (2011) 5758-5761 Space group: P 21 21 21 Cell volume: 1613.99 Cell parameters: 9.6671; 10.0197; 16.6629; 90; 90; 90; |
| COD ID: 1502533 | |
| CIF file | Formula: - C29 H25 Br N2 - Comments: Cheng, Dao-Juan; Wu, Hai-Bian; Tian, Shi-Kai Catalytic asymmetric Pictet-Spengler-type reaction for the synthesis of optically active indolo[3,4-cd][1]benzazepines. Organic letters 13(20) (2011) 5636-5639 Space group: P 21 21 21 Cell volume: 2361.1 Cell parameters: 8.631; 12.0157; 22.767; 90; 90; 90; |
| COD ID: 1502537 | |
| CIF file | Formula: - C20 H21 N2 O2 S - Comments: Ghorai, Manas K.; Sahoo, Ashis K.; Kumar, Sarvesh Synthetic route to chiral tetrahydroquinoxalines via ring-opening of activated aziridines. Organic letters 13(22) (2011) 5972-5975 Space group: P 21 21 21 Cell volume: 1789.1 Cell parameters: 9.01; 12.674; 15.667; 90; 90; 90; |
| COD ID: 1502538 | |
| CIF file | Formula: - C21 H17 Br O - Comments: Turner, Heather M.; Patel, Jignesh; Niljianskul, Nootaree; Chong, J. Michael Binaphthol-catalyzed asymmetric conjugate arylboration of enones. Organic letters 13(21) (2011) 5796-5799 Space group: P 21 21 21 Cell volume: 1688.8 Cell parameters: 5.7256; 16.786; 17.572; 90; 90; 90; |
| COD ID: 1502545 | |
| CIF file | Formula: - C15 H23 N3 O2 S - Comments: Zhou, Ling; Chen, Jie; Zhou, Jing; Yeung, Ying-Yeung N-Bromosuccinimide promoted one-pot synthesis of guanidine: scope and mechanism. Organic letters 13(21) (2011) 5804-5807 Space group: P 21 21 21 Cell volume: 1628.83 Cell parameters: 8.0247; 9.3837; 21.6308; 90; 90; 90; |
| COD ID: 1502553 | |
| CIF file | Formula: - C22 H24 O4 S2 - Comments: Hong, Wan Pyo; Noshi, Mohammad N.; El-Awa, Ahmad; Fuchs, Philip L. Synthesis of the C1-C20 and C15-C27 segments of aplyronine A. Organic letters 13(24) (2011) 6342-6345 Space group: P 21 21 21 Cell volume: 2175.63 Cell parameters: 8.4312; 8.9716; 28.7625; 90; 90; 90; |
| COD ID: 1502577 | |
| CIF file | Formula: - C16 H22 O4 - Comments: Mondal, Sujit; Yadav, Ram Naresh; Ghosh, Subrata Influence of diene substituent position on the stereochemical outcome in IMDA reaction of decatrienones. An asymmetric synthesis of C10-epi-dihydro-epi-deoxy arteannuin B. Organic letters 13(22) (2011) 6078-6081 Space group: P 21 21 21 Cell volume: 1442.9 Cell parameters: 7.0739; 13.657; 14.9355; 90; 90; 90; |
| COD ID: 1502591 | |
| CIF file | Formula: - C16 H17 Br O3 - Comments: Calter, Michael A.; Korotkov, Alexander Catalytic, asymmetric, interrupted Feist-Bénary reactions of α-tosyloxyacetophenones. Organic letters 13(23) (2011) 6328-6330 Space group: P 21 21 21 Cell volume: 1500.97 Cell parameters: 6.3501; 14.4176; 16.3945; 90; 90; 90; |
| COD ID: 1502594 | |
| CIF file | Formula: - C27 H24 N2 O4 S - Comments: Wang, Xiao-Na; Shen, Li-Tao; Ye, Song NHC-catalyzed enantioselective [2 + 2] and [2 + 2 + 2] cycloadditions of ketenes with isothiocyanates. Organic letters 13(24) (2011) 6382-6385 Space group: P 21 21 21 Cell volume: 2360.6 Cell parameters: 7.6443; 9.925; 31.114; 90; 90; 90; |
| COD ID: 1502597 | |
| CIF file | Formula: - C28 H23 N O3 - Comments: Zheng, Danqing; Li, Shaoyu; Luo, Yong; Wu, Jie An efficient route to tetrahydroindeno[2,1-b]pyrroles via a base-promoted reaction of (E)-2-alkynylphenylchalcone with 2-isocyanoacetate. Organic letters 13(24) (2011) 6402-6405 Space group: P 21 21 21 Cell volume: 2172 Cell parameters: 8.03; 9.784; 27.646; 90; 90; 90; |
| COD ID: 1502618 | |
| CIF file | Formula: - C17 H23 N O3 S - Comments: Fustero, Santos; Rodríguez, Elsa; Herrera, Lidia; Asensio, Amparo; Maestro, Miguel A.; Barrio, Pablo Intramolecular Michael reaction of tert-butylsulfinyl ketimines: asymmetric synthesis of 3-substituted indanones. Organic letters 13(24) (2011) 6564-6567 Space group: P 21 21 21 Cell volume: 1692.13 Cell parameters: 9.6319; 10.4594; 16.7964; 90; 90; 90; |
| COD ID: 1502620 | |
| CIF file | Formula: - C14 H17 N O3 - Comments: Lim, Hwan Jung; RajanBabu, T. V. Ethylene in organic synthesis: a new route to anticholenergic pyrrolidinoindolines, and other molecules with all carbon-quaternary centers via asymmetric hydrovinylation. Organic letters 13(24) (2011) 6596-6599 Space group: P 21 21 21 Cell volume: 1232.58 Cell parameters: 6.3728; 12.4132; 15.5812; 90; 90; 90; |
| COD ID: 1502622 | |
| CIF file | Formula: - C18 H25 Cl N O2.5 - Comments: Shevchenko, Anna; Belle, David Din; Tiittanen, Saara; Karjalainen, Arto; Tolvanen, Arto; Tanninen, Veli Pekka; Haarala, Jorma; Mäkelä, Mikko; Yliruusi, Jouko; Miroshnyk, Inna Coupling Polymorphism/Solvatomorphism and Physical Stability Evaluation with Early Salt Synthesis Optimization of an Investigational Drug Organic Process Research & Development 15(3) (2011) 666 Space group: P 21 21 21 Cell volume: 3395.7 Cell parameters: 6.9608; 15.583; 31.3056; 90; 90; 90; |
| COD ID: 1502625 | |
| CIF file | Formula: - C23.6 H23 Br0.2 F2.4 N7 O8.6 Re - Comments: Struthers, Harriet; Viertl, David; Kosinski, Marek; Spingler, Bernhard; Buchegger, Franz; Schibli, Roger Charge dependent substrate activity of C3' and N3 functionalized, organometallic technetium and rhenium-labeled thymidine derivatives toward human thymidine kinase 1. Bioconjugate chemistry 21(4) (2010) 622-634 Space group: P 21 21 21 Cell volume: 2897.43 Cell parameters: 8.00672; 15.303; 23.6473; 90; 90; 90; |
| COD ID: 1502658 | |
| CIF file | Formula: - C27 H23 Cl3 N4 O2 - Comments: Yan, Lin; Huo, Pei; Debenham, John S.; Madsen-Duggan, Christina B; Lao, Julie; Chen, Richard Z.; Xiao, Jing Chen; Shen, Chun-Pyn; Stribling, D. Sloan; Shearman, Lauren P.; Strack, Alison M.; Tsou, Nancy; Ball, Richard G.; Wang, Junying; Tong, Xinchun; Bateman, Thomas J.; Reddy, Vijay B. G.; Fong, Tung M.; Hale, Jeffrey J. Discovery of N-[(4R)-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-2,2-dimethyl-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl]-5-methyl-1H-pyrazole-3-carboxamide (MK-5596) as a novel cannabinoid-1 receptor (CB1R) inverse agonist for the treatment of obesity. Journal of medicinal chemistry 53(10) (2010) 4028-4037 Space group: P 21 21 21 Cell volume: 2508.1 Cell parameters: 11.1695; 11.2252; 20.0044; 90; 90; 90; |
| COD ID: 1502672 | |
| CIF file | Formula: - C33 H52 O3 - Comments: Genet, Cédric; Strehle, Axelle; Schmidt, Céline; Boudjelal, Geoffrey; Lobstein, Annelise; Schoonjans, Kristina; Souchet, Michel; Auwerx, Johan; Saladin, Régis; Wagner, Alain Structure-activity relationship study of betulinic acid, a novel and selective TGR5 agonist, and its synthetic derivatives: potential impact in diabetes. Journal of medicinal chemistry 53(1) (2010) 178-190 Space group: P 21 21 21 Cell volume: 2901.94 Cell parameters: 7.2672; 11.8653; 33.6544; 90; 90; 90; |
| COD ID: 1502677 | |
| CIF file | Formula: - C24 H42 N2 O2 - Comments: Corvis, Yohann; Négrier, Philippe; Lazerges, Mathieu; Massip, Stéphane; Léger, Jean-Michel; Espeau, Philippe Lidocaine/L-menthol binary system: cocrystallization versus solid-state immiscibility. The journal of physical chemistry. B 114(16) (2010) 5420-5426 Space group: P 21 21 21 Cell volume: 2495.3 Cell parameters: 8.4016; 13.4207; 22.13; 90; 90; 90; |
| COD ID: 1502700 | |
| CIF file | Formula: - C9 H15 Li2 O6 Tl - Comments: Martínez Casado, F J; Ramos Riesco, M.; da Silva, I.; Labrador, A.; Redondo, M. I.; García Pérez, M V; López-Andrés, S; Rodríguez Cheda, J A Thermal and structural study of the crystal phases and mesophases in the lithium and thallium(i) propanoates and pentanoates binary systems: formation of mixed salts and stabilization of the ionic liquid crystal phase. The journal of physical chemistry. B 114(31) (2010) 10075-10085 Space group: P 21 21 21 Cell volume: 1343.5 Cell parameters: 4.909; 11.892; 23.014; 90; 90; 90; |
| COD ID: 1502736 | |
| CIF file | Formula: - C24 H25 N O2 - Comments: Jaworska, Magdalena; Hrynczyszyn, Paweł B; Wełniak, Mirosław; Wojtczak, Andrzej; Nowicka, Katarzyna; Krasiński, Grzegorz; Kassassir, Hassan; Ciesielski, Włodzimierz; Potrzebowski, Marek J. Solid state NMR spectroscopy as a precise tool for assigning the tautomeric form and proton position in the intramolecular bridges of o-hydroxy Schiff bases. The journal of physical chemistry. A 114(47) (2010) 12522-12530 Space group: P 21 21 21 Cell volume: 1993.6 Cell parameters: 6.1987; 16.054; 20.033; 90; 90; 90; |
| COD ID: 1502756 | |
| CIF file | Formula: - C22 H14 N4 O2 - Comments: Yang, Chih-Chiang; Hsu, Chia-Jung; Chou, Pi-Tai; Cheng, Hsu Chun; Su, Yuhlong Oliver; Leung, Man-kit Excited state luminescence of multi-(5-phenyl-1,3,4-oxadiazo-2-yl)benzenes in an electron-donating matrix: exciplex or electroplex? The journal of physical chemistry. B 114(2) (2010) 756-768 Space group: P 21 21 21 Cell volume: 1776.24 Cell parameters: 5.404; 16.068; 20.4562; 90; 90; 90; |
| COD ID: 1502773 | |
| CIF file | Formula: - C30 H53 Mg N3 O2 Si2 - Comments: Wang, Liying; Ma, Haiyan Highly Active Magnesium Initiators for Ring-Opening Polymerization ofrac-Lactide Macromolecules 43(16) (2010) 6535 Space group: P 21 21 21 Cell volume: 3387.5 Cell parameters: 13.032; 14.817; 17.543; 90; 90; 90; |
| COD ID: 1502777 | |
| CIF file | Formula: - C57 H116 O40 - Comments: Nishiyama, Yoshiharu; Mazeau, Karim; Morin, Morgane; Cardoso, Mateus B.; Chanzy, Henri; Putaux, Jean-Luc Molecular and Crystal Structure of 7-Fold V-Amylose Complexed with 2-Propanol Macromolecules 43(20) (2010) 8628 Space group: P 21 21 21 Cell volume: 6639 Cell parameters: 28.29; 29.3; 8.01; 90; 90; 90; |
| COD ID: 1502792 | |
| CIF file | Formula: - C15 H14 O5 - Comments: Lin, Jie; Liu, Shuchun; Sun, Bingda; Niu, Shubin; Li, Erwei; Liu, Xingzhong; Che, Yongsheng Polyketides from the ascomycete fungus Leptosphaeria sp. Journal of natural products 73(5) (2010) 905-910 Space group: P 21 21 21 Cell volume: 1344.5 Cell parameters: 5.7411; 9.4947; 24.665; 90; 90; 90; |
| COD ID: 1502794 | |
| CIF file | Formula: - C30 H48 O13 - Comments: Cheng, Yuan-Bin; Liao, Tzu-Ching; Lo, Yi-Wen; Chen, Yu-Chen; Kuo, Yuh-Chi; Chen, Shun-Ying; Chien, Ching-Te; Hwang, Tsong-Long; Shen, Ya-Ching Nortriterpene lactones from the fruits of Schisandra arisanensis. Journal of natural products 73(7) (2010) 1228-1233 Space group: P 21 21 21 Cell volume: 3104.4 Cell parameters: 9.1827; 18.1165; 18.6612; 90; 90; 90; |
| COD ID: 1502799 | |
| CIF file | Formula: - C22 H32 O4 - Comments: Wei, Xiaomei; Rodríguez, Abimael D; Baran, Peter; Raptis, Raphael G. Dolabellane-type diterpenoids with antiprotozoan activity from a southwestern Caribbean gorgonian octocoral of the genus Eunicea. Journal of natural products 73(5) (2010) 925-934 Space group: P 21 21 21 Cell volume: 2046.7 Cell parameters: 8.9941; 12.14; 18.745; 90; 90; 90; |
| COD ID: 1502804 | |
| CIF file | Formula: - C17 H30 O4 - Comments: Chokpaiboon, Supichar; Sommit, Damrong; Teerawatananond, Thapong; Muangsin, Nongnuj; Bunyapaiboonsri, Taridaporn; Pudhom, Khanitha Cytotoxic nor-chamigrane and chamigrane endoperoxides from a basidiomycetous fungus. Journal of natural products 73(5) (2010) 1005-1007 Space group: P 21 21 21 Cell volume: 1280.69 Cell parameters: 7.3526; 12.4749; 13.9626; 90; 90; 90; |
| COD ID: 1502806 | |
| CIF file | Formula: - C20 H23 N O4 - Comments: Zein, Ahmed L.; Dawe, Louise N.; Georghiou, Paris E. Enantioselective total synthesis and X-ray structures of the tetrahydroprotoberberine alkaloids (-)-(S)-tetrahydropalmatrubine and (-)-(S)-corytenchine. Journal of natural products 73(8) (2010) 1427-1430 Space group: P 21 21 21 Cell volume: 1654.3 Cell parameters: 7.2621; 8.0445; 28.318; 90; 90; 90; |
| COD ID: 1502810 | |
| CIF file | Formula: - C27 H36 O10 - Comments: Sarigaputi, Chanin; Nuanyai, Thanesuan; Teerawatananond, Thapong; Pengpreecha, Somchai; Muangsin, Nongnuj; Pudhom, Khanitha Xylorumphiins A-D, mexicanolide limonoids from the seed kernels of Xylocarpus rumphii. Journal of natural products 73(8) (2010) 1456-1459 Space group: P 21 21 21 Cell volume: 2472.76 Cell parameters: 10.0323; 10.9812; 22.4456; 90; 90; 90; |
| COD ID: 1502811 | |
| CIF file | Formula: - C14 H19 Cl O6 - Comments: Lin, Sheng; Shen, Yun-Heng; Zhang, Zhong-Xiao; Li, Hui-Liang; Shan, Lei; Liu, Run-Hui; Xu, Xi-Ke; Zhang, Wei-Dong Revision of the Structures of 1,5-Dihydroxy-3,8-epoxyvalechlorine, Volvaltrate B, and Valeriotetrate C fromValeriana jatamansiandV. officinalis Journal of Natural Products 73(10) (2010) 1723 Space group: P 21 21 21 Cell volume: 1537.6 Cell parameters: 9.547; 12.328; 13.064; 90; 90; 90; |
| COD ID: 1502812 | |
| CIF file | Formula: - C18 H28 O3 - Comments: Hu, Wei-Min; Li, Min-Yi; Li, Jun; Xiao, Qiang; Feng, Gang; Wu, Jun Dolabranes from the Chinese Mangrove,Ceriops tagal Journal of Natural Products 73(10) (2010) 1701 Space group: P 21 21 21 Cell volume: 3208.2 Cell parameters: 7.6054; 10.8888; 38.7397; 90; 90; 90; |
| COD ID: 1502814 | |
| CIF file | Formula: - C20 H22 N2 O3 - Comments: Tan, Shin-Jowl; Low, Yun-Yee; Choo, Yeun-Mun; Abdullah, Zanariah; Etoh, Tadahiro; Hayashi, Masahiko; Komiyama, Kanki; Kam, Toh-Seok Strychnan and secoangustilobine A type alkaloids from Alstonia spatulata. Revision of the C-20 configuration of scholaricine. Journal of natural products 73(11) (2010) 1891-1897 Space group: P 21 21 21 Cell volume: 1676.96 Cell parameters: 7.8037; 11.7086; 18.3534; 90; 90; 90; |
| COD ID: 1502815 | |
| CIF file | Formula: - C44 H58 N4 O11 - Comments: Tan, Shin-Jowl; Low, Yun-Yee; Choo, Yeun-Mun; Abdullah, Zanariah; Etoh, Tadahiro; Hayashi, Masahiko; Komiyama, Kanki; Kam, Toh-Seok Strychnan and secoangustilobine A type alkaloids from Alstonia spatulata. Revision of the C-20 configuration of scholaricine. Journal of natural products 73(11) (2010) 1891-1897 Space group: P 21 21 21 Cell volume: 4112.56 Cell parameters: 10.4901; 18.5736; 21.1075; 90; 90; 90; |
| COD ID: 1502825 | |
| CIF file | Formula: - C22 H36 O6 - Comments: Wang, Rui; Chen, Wen-Hao; Shi, Yan-Ping ent-kaurane and ent-pimarane diterpenoids from Siegesbeckia pubescens. Journal of natural products 73(1) (2010) 17-21 Space group: P 21 21 21 Cell volume: 2159.6 Cell parameters: 7.4147; 10.7871; 27.001; 90; 90; 90; |
| COD ID: 1502827 | |
| CIF file | Formula: - C20 H24 N2 O4 - Comments: Feng, Tao; Cai, Xiang-Hai; Liu, Ya-Ping; Li, Yan; Wang, Yuan-Yuan; Luo, Xiao-Dong Melodinines A-G, monoterpenoid indole alkaloids from Melodinus henryi. Journal of natural products 73(1) (2010) 22-26 Space group: P 21 21 21 Cell volume: 1762.3 Cell parameters: 6.9521; 14.5835; 17.382; 90; 90; 90; |
| COD ID: 1502828 | |
| CIF file | Formula: - C18 H22 O2 - Comments: Zhu, Qin; Tang, Chun-Ping; Ke, Chang-Qiang; Li, Xi-Qiang; Liu, Jin; Gan, Li-She; Weiss, Hans-Christoph; Gesing, Ernst-Rudolf; Ye, Yang Constituents of Trigonostemon chinensis. Journal of natural products 73(1) (2010) 40-44 Space group: P 21 21 21 Cell volume: 1418.67 Cell parameters: 6.164; 10.0724; 22.85; 90; 90; 90; |
| COD ID: 1502829 | |
| CIF file | Formula: - C20 H16 N2 O3 - Comments: Zhu, Qin; Tang, Chun-Ping; Ke, Chang-Qiang; Li, Xi-Qiang; Liu, Jin; Gan, Li-She; Weiss, Hans-Christoph; Gesing, Ernst-Rudolf; Ye, Yang Constituents of Trigonostemon chinensis. Journal of natural products 73(1) (2010) 40-44 Space group: P 21 21 21 Cell volume: 1621.7 Cell parameters: 9.294; 11.4297; 15.266; 90; 90; 90; |
| COD ID: 1502833 | |
| CIF file | Formula: - C23 H28 O13 - Comments: Shimokawa, Yoko; Akao, Yusuke; Hirasawa, Yusuke; Awang, Khalijah; Hadi, A Hamid A; Sato, Seizo; Aoyama, Chihiro; Takeo, Jiro; Shiro, Motoo; Morita, Hiroshi Gneyulins A and B, stilbene trimers, and noidesols A and B, dihydroflavonol-C-glucosides, from the bark of Gnetum gnemonoides. Journal of natural products 73(4) (2010) 763-767 Space group: P 21 21 21 Cell volume: 2344.21 Cell parameters: 9.31894; 11.1351; 22.591; 90; 90; 90; |
| COD ID: 1502834 | |
| CIF file | Formula: - C19 H24 O8 - Comments: Xu, Liangxiong; He, Zhengxiang; Xue, Jinghua; Chen, Xiaoping; Wei, Xiaoyi beta-Resorcylic acid lactones from a Paecilomyces fungus. Journal of natural products 73(5) (2010) 885-889 Space group: P 21 21 21 Cell volume: 1796.42 Cell parameters: 6.7386; 9.6557; 27.6093; 90; 90; 90; |
| COD ID: 1502835 | |
| CIF file | Formula: - C21 H22 N2 O2 - Comments: Feng, Tao; Li, Yan; Liu, Ya-Ping; Cai, Xiang-Hai; Wang, Yuan-Yuan; Luo, Xiao-Dong Melotenine A, a cytotoxic monoterpenoid indole alkaloid from Melodinus tenuicaudatus. Organic letters 12(5) (2010) 968-971 Space group: P 21 21 21 Cell volume: 1741.9 Cell parameters: 6.5866; 10.932; 24.192; 90; 90; 90; |
| COD ID: 1502836 | |
| CIF file | Formula: - C22 H19 Cl O4 - Comments: Cui, Hai-Lei; Huang, Ji-Rong; Lei, Jie; Wang, Zhao-Feng; Chen, Shi; Wu, Li; Chen, Ying-Chun Direct asymmetric allylic alkylation of butenolides with Morita-Baylis-Hillman carbonates. Organic letters 12(4) (2010) 720-723 Space group: P 21 21 21 Cell volume: 1888.1 Cell parameters: 6.7271; 8.4431; 33.243; 90; 90; 90; |
| COD ID: 1502838 | |
| CIF file | Formula: - C29 H40 O10 - Comments: Cheng, Yuan-Bin; Liao, Tzu-Ching; Lo, I-Wen; Chen, Yu-Chen; Kuo, Yuh-Chi; Chen, Shun-Ying; Chien, Ching-Te; Shen, Ya-Ching Arisandilactone A, a new triterpenoid from the fruits of Schisandra arisanensis. Organic letters 12(5) (2010) 1016-1019 Space group: P 21 21 21 Cell volume: 2873.1 Cell parameters: 10.4314; 15.4544; 17.8219; 90; 90; 90; |
| COD ID: 1502839 | |
| CIF file | Formula: - C24 H23 N O - Comments: Schultz, Danielle M.; Wolfe, John P. Synthesis of polycyclic nitrogen heterocycles via alkene aminopalladation/carbopalladation cascade reactions. Organic letters 12(5) (2010) 1028-1031 Space group: P 21 21 21 Cell volume: 1750.02 Cell parameters: 7.6052; 13.5568; 16.9736; 90; 90; 90; |
| COD ID: 1502842 | |
| CIF file | Formula: - C14 H19 Br N2 O4 - Comments: Li, Qing; Ding, Chang-Hua; Hou, Xue-Long; Dai, Li-Xin Diastereo- and enantioselective synthesis of alpha,gamma-diaminobutyric acid derivatives via Cu-catalyzed asymmetric Michael reaction. Organic letters 12(5) (2010) 1080-1083 Space group: P 21 21 21 Cell volume: 1680.1 Cell parameters: 5.86; 15.3822; 18.6383; 90; 90; 90; |
| COD ID: 1502843 | |
| CIF file | Formula: - C28 H40 O6 - Comments: Wang, Cui-Fang; Liu, Jie-Qing; Yan, Yu-Xin; Chen, Jian-Chao; Lu, Yang; Guo, Yong-Hui; Qiu, Ming-Hua Three new triterpenoids containing four-membered ring from the fruiting body of Ganoderma sinense. Organic letters 12(8) (2010) 1656-1659 Space group: P 21 21 21 Cell volume: 2580.82 Cell parameters: 7.6814; 12.1284; 27.7022; 90; 90; 90; |
| COD ID: 1502846 | |
| CIF file | Formula: - C21 H15 N O4 - Comments: Mondal, Mukulesh; Ibrahim, Ahmad A.; Wheeler, Kraig A.; Kerrigan, Nessan J. Phosphine-catalyzed asymmetric synthesis of beta-lactones from arylketoketenes and aromatic aldehydes. Organic letters 12(8) (2010) 1664-1667 Space group: P 21 21 21 Cell volume: 1695.42 Cell parameters: 9.5125; 10.8526; 16.4229; 90; 90; 90; |
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