Crystallography Open Database

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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 128

COD ID: 1101223
CIF file Formula: - H1262 K43 Mo214 Na11 O1404 S12 V34 -
Comments: Botar, Bogdan; Kögerler, Paul; Hill, Craig L. A Nanoring‒Nanosphere Molecule, {Mo~214~V~30~}: Pushing the Boundaries of Controllable Inorganic Structural Organization at the Molecular Level Journal of the American Chemical Society 128(16) (2006) 5336-5337
Space group: C 1 2/m 1
Cell volume: 75763
Cell parameters: 46.324; 42.268; 41.896; 90; 112.549; 90;  

COD ID: 4101101
CIF file Formula: - C15 H24 O3 -
Comments: Hayashi, Sayuri; Hirano, Koji; Yorimitsu, Hideki; Oshima, Koichiro Palladium-Catalyzed Stereo- and Regiospecific Allylation of Aryl Halides with Homoallyl Alcohols via Retro-Allylation: Selective Generation and Use of σ-Allylpalladium Journal of the American Chemical Society 128(7) (2006) 2210-2211
Space group: P 21 21 21
Cell volume: 2940.2
Cell parameters: 7.8962; 12.311; 30.247; 90; 90; 90;  

COD ID: 4101130
CIF file Formula: - C78 H85 B2 N5 U -
Comments: Maynadié, J.; Berthet, J. C.; Thuéry, P.; Ephritikhine, M. An Unprecedented Type of Linear Metallocene with an f-Element Journal of the American Chemical Society 128(4) (2006) 1082-1083
Space group: P 1 21/c 1
Cell volume: 6675.1
Cell parameters: 10.0055; 27.7679; 24.2432; 90; 97.678; 90;  

COD ID: 4101131
CIF file Formula: - C35 H52.5 I2 N7.5 U -
Comments: Maynadié, J.; Berthet, J. C.; Thuéry, P.; Ephritikhine, M. An Unprecedented Type of Linear Metallocene with an f-Element Journal of the American Chemical Society 128(4) (2006) 1082-1083
Space group: C 1 2/c 1
Cell volume: 8402.4
Cell parameters: 21.0005; 19.4352; 22.9247; 90; 116.103; 90;  

COD ID: 4101161
CIF file Formula: - C13 H27 N3 O5 Os -
Comments: Donohoe, Timothy J.; Chughtai, Majid J.; Klauber, David J.; Griffin, David; Campbell, Andrew D. N-Sulfonyloxy Carbamates as Reoxidants for the Tethered Aminohydroxylation Reaction Journal of the American Chemical Society 128(8) (2006) 2514-2515
Space group: P 1 21/n 1
Cell volume: 1729.48
Cell parameters: 12.242; 9.6351; 15.1197; 90; 104.127; 90;  

COD ID: 4101245
CIF file Formula: - C42 H87 F12 N2 P5 Re6 Sb2 Se8 -
Comments: Roland, Bryan K; Flora, Ware H; Selby, Hugh D; Armstrong, Neal R; Zheng, Zhiping Dendritic arrays of [Re6(mu3-Se)8]2+ core-containing clusters: exploratory synthesis and electrochemical studies. Journal of the American Chemical Society 128(20) (2006) 6620-6625
Space group: P 1 21/n 1
Cell volume: 7044.3
Cell parameters: 16.9603; 20.6955; 20.1896; 90; 96.263; 90;  

COD ID: 4101246
CIF file Formula: - C846 H1919 N262 O491 S8.83 -
Comments: Fuhrmann, Cynthia N; Daugherty, Matthew D; Agard, David A Subangstrom crystallography reveals that short ionic hydrogen bonds, and not a His-Asp low-barrier hydrogen bond, stabilize the transition state in serine protease catalysis. Journal of the American Chemical Society 128(28) (2006) 9086-9102
Space group: P 32 2 1
Cell volume: 296844
Cell parameters: 65.68; 65.68; 79.46; 90; 90; 120;  

COD ID: 4101247
CIF file Formula: - C846 H2027 B N262 O581 S9.5 -
Comments: Fuhrmann, Cynthia N; Daugherty, Matthew D; Agard, David A Subangstrom crystallography reveals that short ionic hydrogen bonds, and not a His-Asp low-barrier hydrogen bond, stabilize the transition state in serine protease catalysis. Journal of the American Chemical Society 128(28) (2006) 9086-9102
Space group: P 32 2 1
Cell volume: 298004
Cell parameters: 65.77; 65.77; 79.55; 90; 90; 120;  

COD ID: 4101248
CIF file Formula: - P S4 Sb -
Comments: Malliakas, Christos D; Kanatzidis, Mercouri G Inorganic single wall nanotubes of SbPS(4-x)Se(x) (0 < or = x < or = 3) with tunable band gap. Journal of the American Chemical Society 128(20) (2006) 6538-6539
Space group: P -1
Cell volume: 1841.4
Cell parameters: 6.2719; 13.059; 22.493; 90.09; 90.065; 91.76;  

COD ID: 4101249
CIF file Formula: - C42 H58 O12 -
Comments: Boeckman, Jr, Robert K; Shao, Pengcheng; Wrobleski, Stephen T; Boehmler, Debra J; Heintzelman, Geoffrey R; Barbosa, Antonio J Toward the development of a general chiral auxiliary. A total synthesis of (+)-tetronolide via a tandem ketene-trapping [4 + 2] cycloaddition strategy. Journal of the American Chemical Society 128(32) (2006) 10572-10588
Space group: P 21 21 21
Cell volume: 3909.6
Cell parameters: 12.2516; 12.8193; 24.8929; 90; 90; 90;  

COD ID: 4101250
CIF file Formula: - C52 H45 Br2 Ir N2 O2 S2 -
Comments: Evans, Nicholas R; Sudha Devi, Lekshmi; Mak, Chris S K; Watkins, Scott E; Pascu, Sofia I; Köhler, Anna; Friend, Richard H; Williams, Charlotte K; Holmes, Andrew B Triplet energy back transfer in conjugated polymers with pendant phosphorescent iridium complexes. Journal of the American Chemical Society 128(20) (2006) 6647-6656
Space group: I b a 2
Cell volume: 9718.4
Cell parameters: 46.929; 11.5729; 17.8941; 90; 90; 90;  

COD ID: 4101251
CIF file Formula: - C35 H33 Ir N2 O3 S2 -
Comments: Evans, Nicholas R; Sudha Devi, Lekshmi; Mak, Chris S K; Watkins, Scott E; Pascu, Sofia I; Köhler, Anna; Friend, Richard H; Williams, Charlotte K; Holmes, Andrew B Triplet energy back transfer in conjugated polymers with pendant phosphorescent iridium complexes. Journal of the American Chemical Society 128(20) (2006) 6647-6656
Space group: P c a 21
Cell volume: 3240.17
Cell parameters: 12.6135; 14.2569; 18.018; 90; 90; 90;  

COD ID: 4101252
CIF file Formula: - C17 H30 N4 O2 -
Comments: Lafitte, Valérie G H; Aliev, Abil E; Horton, Peter N; Hursthouse, Michael B; Bala, Kason; Golding, Peter; Hailes, Helen C Quadruply hydrogen bonded cytosine modules for supramolecular applications. Journal of the American Chemical Society 128(20) (2006) 6544-6545
Space group: P -1
Cell volume: 903.2
Cell parameters: 4.5636; 9.979; 20.116; 81.1; 86.46; 88.48;  

COD ID: 4101253
CIF file Formula: - C23 H28 N P Sn -
Comments: Grundy, Joanna; Donnadieu, Bruno; Mathey, François The alpha-iminophospholide ligands. Journal of the American Chemical Society 128(24) (2006) 7716-7717
Space group: P 1 21/n 1
Cell volume: 2179.2
Cell parameters: 14.938; 9.6522; 15.763; 90; 106.491; 90;  

COD ID: 4101254
CIF file Formula: - C84 H84 Cl8 Cu4 N4 P4 -
Comments: Grundy, Joanna; Donnadieu, Bruno; Mathey, François The alpha-iminophospholide ligands. Journal of the American Chemical Society 128(24) (2006) 7716-7717
Space group: P -1
Cell volume: 3990.42
Cell parameters: 14.9291; 17.6446; 17.8388; 67.097; 79.278; 67.324;  

COD ID: 4101255
CIF file Formula: - C29 H25 Cl N2 O2 -
Comments: Sharma, Vasudha; Peddibhotla, Satyamaheshwar; Tepe, Jetze J Sensitization of cancer cells to DNA damaging agents by imidazolines. Journal of the American Chemical Society 128(28) (2006) 9137-9143
Space group: P 1 21 1
Cell volume: 1228.7
Cell parameters: 9.4466; 10.052; 13.087; 90; 98.62; 90;  

COD ID: 4101256
CIF file Formula: - C30 H26 Cl4 N2 O2 -
Comments: Sharma, Vasudha; Peddibhotla, Satyamaheshwar; Tepe, Jetze J Sensitization of cancer cells to DNA damaging agents by imidazolines. Journal of the American Chemical Society 128(28) (2006) 9137-9143
Space group: P -1
Cell volume: 1470.4
Cell parameters: 10.256; 11.428; 13.011; 90.97; 105.28; 90.96;  

COD ID: 4101257
CIF file Formula: - C10 H20 N2 O3 -
Comments: Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society 128(20) (2006) 6737-6744
Space group: P 61
Cell volume: 1904.3
Cell parameters: 14.573; 14.573; 10.354; 90; 90; 120;  

COD ID: 4101258
CIF file Formula: - C11 H22 N2 O3 -
Comments: Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society 128(20) (2006) 6737-6744
Space group: P 61
Cell volume: 1950.6
Cell parameters: 14.774; 14.774; 10.319; 90; 90; 120;  

COD ID: 4101259
CIF file Formula: - C9 H18 N2 O4 -
Comments: Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society 128(20) (2006) 6737-6744
Space group: P 65
Cell volume: 1755.9
Cell parameters: 18.138; 18.138; 6.163; 90; 90; 120;  

COD ID: 4101260
CIF file Formula: - C11 H22 N2 O3 -
Comments: Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society 128(20) (2006) 6737-6744
Space group: P 61
Cell volume: 1973.6
Cell parameters: 14.871; 14.871; 10.305; 90; 90; 120;  

COD ID: 4101261
CIF file Formula: - C9 H18 N2 O3 -
Comments: Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society 128(20) (2006) 6737-6744
Space group: P 61
Cell volume: 1822.8
Cell parameters: 14.481; 14.481; 10.037; 90; 90; 120;  

COD ID: 4101262
CIF file Formula: - C9 H18 N2 O3 -
Comments: Soldatov, Dmitriy V; Moudrakovski, Igor L; Grachev, Eugeny V; Ripmeester, John A Micropores in crystalline dipeptides as seen from the crystal structure, He pycnometry, and 129Xe NMR spectroscopy. Journal of the American Chemical Society 128(20) (2006) 6737-6744
Space group: P 61
Cell volume: 1800.2
Cell parameters: 14.261; 14.261; 10.221; 90; 90; 120;  

COD ID: 4101263
CIF file Formula: - C30 H18 Ba2 Cl N6 O37.14 S6 Sm -
Comments: Chandler, Brett D; Cramb, David T; Shimizu, George K H Microporous metal-organic frameworks formed in a stepwise manner from luminescent building blocks. Journal of the American Chemical Society 128(32) (2006) 10403-10412
Space group: P 1 21/c 1
Cell volume: 5879
Cell parameters: 24.579; 23.016; 10.511; 90; 98.643; 90;  

COD ID: 4101264
CIF file Formula: - C30 H18 Ba2 Cl Gd N6 O39.16 S6 -
Comments: Chandler, Brett D; Cramb, David T; Shimizu, George K H Microporous metal-organic frameworks formed in a stepwise manner from luminescent building blocks. Journal of the American Chemical Society 128(32) (2006) 10403-10412
Space group: P 1 21/c 1
Cell volume: 5830
Cell parameters: 24.423; 22.995; 10.498; 90; 98.54; 90;  

COD ID: 4101265
CIF file Formula: - C30 H18 Ba2 Cl N6 O38.22 S6 Tb -
Comments: Chandler, Brett D; Cramb, David T; Shimizu, George K H Microporous metal-organic frameworks formed in a stepwise manner from luminescent building blocks. Journal of the American Chemical Society 128(32) (2006) 10403-10412
Space group: P 1 21/c 1
Cell volume: 5852
Cell parameters: 24.525; 22.917; 10.531; 90; 98.595; 90;  

COD ID: 4101266
CIF file Formula: - C30 H18 Ba2 Cl Dy N6 O34.48 S6 -
Comments: Chandler, Brett D; Cramb, David T; Shimizu, George K H Microporous metal-organic frameworks formed in a stepwise manner from luminescent building blocks. Journal of the American Chemical Society 128(32) (2006) 10403-10412
Space group: P 1 21/c 1
Cell volume: 5824
Cell parameters: 24.627; 22.651; 10.547; 90; 98.168; 90;  

COD ID: 4101267
CIF file Formula: - C30 H25.5 Ba2 Cl Eu N6 O34.5 S6 -
Comments: Chandler, Brett D; Cramb, David T; Shimizu, George K H Microporous metal-organic frameworks formed in a stepwise manner from luminescent building blocks. Journal of the American Chemical Society 128(32) (2006) 10403-10412
Space group: P 1 21/c 1
Cell volume: 5858.5
Cell parameters: 24.55; 23.026; 10.4867; 90; 98.796; 90;  

COD ID: 4101268
CIF file Formula: - C39 H60 N6 O8 -
Comments: Rai, Rajkishor; Aravinda, Subrayashastry; Kanagarajadurai, Karuppiah; Raghothama, Srinivasarao; Shamala, Narayanaswamy; Balaram, Padmanabhan Diproline templates as folding nuclei in designed peptides. Conformational analysis of synthetic peptide helices containing amino terminal Pro-Pro segments. Journal of the American Chemical Society 128(24) (2006) 7916-7928
Space group: P 1 21 1
Cell volume: 4291
Cell parameters: 13.9099; 19.766; 15.7615; 90; 98.033; 90;  

COD ID: 4101269
CIF file Formula: - C13 H14 Cd Cl N5 O2 -
Comments: Ye, Qiong; Song, Yu-Mei; Wang, Guo-Xi; Chen, Kai; Fu, Da-Wei; Chan, Philip Wai Hong; Zhu, Jin-Song; Huang, Songping D; Xiong, Ren-Gen Ferroelectric metal-organic framework with a high dielectric constant. Journal of the American Chemical Society 128(20) (2006) 6554-6555
Space group: C 1 c 1
Cell volume: 1540.7
Cell parameters: 9.086; 24.088; 7.7691; 90; 115.028; 90;  

COD ID: 4101270
CIF file Formula: - C142.75 H171 Mn3.85 N45.75 O101.25 Pd6 -
Comments: Kawano, Masaki; Kobayashi, Yasuhiro; Ozeki, Tomoji; Fujita, Makoto Direct crystallographic observation of a coordinatively unsaturated transition-metal complex in situ generated within a self-assembled cage. Journal of the American Chemical Society 128(20) (2006) 6558-6559
Space group: P 1 21/c 1
Cell volume: 51905
Cell parameters: 24.3311; 46.3186; 46.72; 90; 99.6656; 90;  

COD ID: 4101271
CIF file Formula: - C142.75 H171.5 Mn3.84 N45.5 O97.25 Pd6 -
Comments: Kawano, Masaki; Kobayashi, Yasuhiro; Ozeki, Tomoji; Fujita, Makoto Direct crystallographic observation of a coordinatively unsaturated transition-metal complex in situ generated within a self-assembled cage. Journal of the American Chemical Society 128(20) (2006) 6558-6559
Space group: P 1 21/c 1
Cell volume: 51173
Cell parameters: 24.3225; 45.7184; 46.6645; 90; 99.5401; 90;  

COD ID: 4101272
CIF file Formula: - C157.48 H111.92 Mn3.18 N45.66 O106.58 Pd6 -
Comments: Kawano, Masaki; Kobayashi, Yasuhiro; Ozeki, Tomoji; Fujita, Makoto Direct crystallographic observation of a coordinatively unsaturated transition-metal complex in situ generated within a self-assembled cage. Journal of the American Chemical Society 128(20) (2006) 6558-6559
Space group: P 41 21 2
Cell volume: 25973
Cell parameters: 29.055; 29.055; 30.767; 90; 90; 90;  

COD ID: 4101273
CIF file Formula: - C8 H5 Mn O3 -
Comments: Kawano, Masaki; Kobayashi, Yasuhiro; Ozeki, Tomoji; Fujita, Makoto Direct crystallographic observation of a coordinatively unsaturated transition-metal complex in situ generated within a self-assembled cage. Journal of the American Chemical Society 128(20) (2006) 6558-6559
Space group: P 1 21/n 1
Cell volume: 781.13
Cell parameters: 10.7492; 6.9262; 11.6456; 90; 115.72; 90;  

COD ID: 4101274
CIF file Formula: - C21 H24 N2 O4 -
Comments: Elliott, Gregory I; Fuchs, James R; Blagg, Brian S J; Ishikawa, Hayato; Tao, Houchao; Yuan, Z-Q; Boger, Dale L Intramolecular diels-alder/1,3-dipolar cycloaddition cascade of 1,3,4-oxadiazoles. Journal of the American Chemical Society 128(32) (2006) 10589-10595
Space group: P 1 21/c 1
Cell volume: 1819.7
Cell parameters: 8.0847; 17.899; 13.168; 90; 107.26; 90;  

COD ID: 4101275
CIF file Formula: - C30 H34 N2 O7 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P -1
Cell volume: 1409.2
Cell parameters: 8.21; 9.372; 18.942; 97.915; 93.978; 101.191;  

COD ID: 4101276
CIF file Formula: - C22 H30 N2 O3 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 1 21/c 1
Cell volume: 1965
Cell parameters: 8.6242; 10.7709; 21.359; 90; 97.95; 90;  

COD ID: 4101277
CIF file Formula: - C22 H26 N2 O3 S -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 21 21 21
Cell volume: 2030.2
Cell parameters: 10.191; 13.011; 15.311; 90; 90; 90;  

COD ID: 4101278
CIF file Formula: - C31 H46 N2 O4 S Si -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 21 21 21
Cell volume: 3140.2
Cell parameters: 11.485; 13.835; 19.763; 90; 90; 90;  

COD ID: 4101279
CIF file Formula: - C23 H28 N2 O4 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 21 21 21
Cell volume: 2061.8
Cell parameters: 10.1539; 11.5677; 17.553; 90; 90; 90;  

COD ID: 4101280
CIF file Formula: - C21 H24 N2 O4 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 1 21 1
Cell volume: 942.9
Cell parameters: 8.8858; 6.9643; 15.401; 90; 98.36; 90;  

COD ID: 4101281
CIF file Formula: - C30 H34 N2 O6 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 1 21/c 1
Cell volume: 2653.5
Cell parameters: 13.2501; 9.0998; 22.7; 90; 104.187; 90;  

COD ID: 4101282
CIF file Formula: - C30 H34 N2 O6 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 1 21/n 1
Cell volume: 2630.1
Cell parameters: 9.7531; 14.2685; 19.3063; 90; 101.784; 90;  

COD ID: 4101283
CIF file Formula: - C37 H37 Br N2 O8 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P -1
Cell volume: 3438
Cell parameters: 14.772; 14.944; 18.334; 109.94; 95.96; 110.8;  

COD ID: 4101284
CIF file Formula: - C23 H26 Br2 N2 O5 -
Comments: Ishikawa, Hayato; Elliott, Gregory I; Velcicky, Juraj; Choi, Younggi; Boger, Dale L Total synthesis of (-)- and ent-(+)-vindoline and related alkaloids. Journal of the American Chemical Society 128(32) (2006) 10596-10612
Space group: P 21 21 21
Cell volume: 2375.4
Cell parameters: 11.298; 12.007; 17.511; 90; 90; 90;  

COD ID: 4101285
CIF file Formula: - C69 H82 Cl4 Co2 O3 P4 -
Comments: Affo, Walter; Ohmiya, Hirohisa; Fujioka, Takuma; Ikeda, Yousuke; Nakamura, Tomoaki; Yorimitsu, Hideki; Oshima, Koichiro; Imamura, Yuki; Mizuta, Tsutomu; Miyoshi, Katsuhiko Cobalt-catalyzed trimethylsilylmethylmagnesium-promoted radical alkenylation of alkyl halides: a complement to the Heck reaction. Journal of the American Chemical Society 128(24) (2006) 8068-8077
Space group: P -1
Cell volume: 3594.25
Cell parameters: 15.38; 15.404; 18.353; 75.291; 66.291; 65.176;  

COD ID: 4101286
CIF file Formula: - C43 H55 Cl2 F6 N2 O4 P Ru -
Comments: Becker, Eva; Stingl, Verena; Dazinger, Georg; Puchberger, Michael; Mereiter, Kurt; Kirchner, Karl Facile migratory insertion of a N-heterocyclic carbene into a ruthenium-carbon double bond: a new type of reaction of a NHC ligand. Journal of the American Chemical Society 128(20) (2006) 6572-6573
Space group: P n a 21
Cell volume: 4462.8
Cell parameters: 19.1884; 12.1771; 19.0995; 90; 90; 90;  

COD ID: 4101287
CIF file Formula: - C23 H25 Cl3 Cr F6 N5 O2 Sb -
Comments: Tomov, Atanas K; Chirinos, Juan J; Long, Richard J; Gibson, Vernon C; Elsegood, Mark R J An unprecedented alpha-olefin distribution arising from a homogeneous ethylene oligomerization catalyst. Journal of the American Chemical Society 128(24) (2006) 7704-7705
Space group: P -1
Cell volume: 1473.2
Cell parameters: 9.9577; 12.1717; 12.9933; 92.232; 104.417; 103.785;  

COD ID: 4101288
CIF file Formula: - C21 H33 B N6 O P2 Ru -
Comments: Feng, Yuee; Lail, Marty; Foley, Nicholas A; Gunnoe, T Brent; Barakat, Khaldoon A; Cundari, Thomas R; Petersen, Jeffrey L Hydrogen-deuterium exchange between TpRu(PMe3)(L)X (L = PMe3 and X = OH, OPh, Me, Ph, or NHPh; L = NCMe and X = Ph) and deuterated arene solvents: evidence for metal-mediated processes. Journal of the American Chemical Society 128(24) (2006) 7982-7994
Space group: P n m a
Cell volume: 2561.1
Cell parameters: 16.0881; 12.9815; 12.2632; 90; 90; 90;  

COD ID: 4101289
CIF file Formula: - C21 H33 B N6 P2 Ru -
Comments: Feng, Yuee; Lail, Marty; Foley, Nicholas A; Gunnoe, T Brent; Barakat, Khaldoon A; Cundari, Thomas R; Petersen, Jeffrey L Hydrogen-deuterium exchange between TpRu(PMe3)(L)X (L = PMe3 and X = OH, OPh, Me, Ph, or NHPh; L = NCMe and X = Ph) and deuterated arene solvents: evidence for metal-mediated processes. Journal of the American Chemical Society 128(24) (2006) 7982-7994
Space group: P 1 21/n 1
Cell volume: 2517.3
Cell parameters: 10.4395; 16.5658; 14.5617; 90; 91.616; 90;  

COD ID: 4101290
CIF file Formula: - C20 H27 B N7 P Ru -
Comments: Feng, Yuee; Lail, Marty; Foley, Nicholas A; Gunnoe, T Brent; Barakat, Khaldoon A; Cundari, Thomas R; Petersen, Jeffrey L Hydrogen-deuterium exchange between TpRu(PMe3)(L)X (L = PMe3 and X = OH, OPh, Me, Ph, or NHPh; L = NCMe and X = Ph) and deuterated arene solvents: evidence for metal-mediated processes. Journal of the American Chemical Society 128(24) (2006) 7982-7994
Space group: P n a 21
Cell volume: 2332.3
Cell parameters: 18.778; 9.4456; 13.1493; 90; 90; 90;  

COD ID: 4101291
CIF file Formula: - C14 H30 B10 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Nickel-mediated regioselective [2 + 2 + 2] cycloaddition of carboryne with alkynes. Journal of the American Chemical Society 128(24) (2006) 7728-7729
Space group: P 1 21/c 1
Cell volume: 1913.5
Cell parameters: 9.5798; 17.5497; 12.2467; 90; 111.667; 90;  

COD ID: 4101292
CIF file Formula: - C18 H38 B10 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Nickel-mediated regioselective [2 + 2 + 2] cycloaddition of carboryne with alkynes. Journal of the American Chemical Society 128(24) (2006) 7728-7729
Space group: C 1 2/c 1
Cell volume: 2432
Cell parameters: 9.9134; 16.3843; 15.4447; 90; 104.198; 90;  

COD ID: 4101293
CIF file Formula: - C30 H30 B10 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Nickel-mediated regioselective [2 + 2 + 2] cycloaddition of carboryne with alkynes. Journal of the American Chemical Society 128(24) (2006) 7728-7729
Space group: R -3 :H
Cell volume: 15829
Cell parameters: 38.779; 38.779; 12.1544; 90; 90; 120;  

COD ID: 4101294
CIF file Formula: - C20 H26 B10 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Nickel-mediated regioselective [2 + 2 + 2] cycloaddition of carboryne with alkynes. Journal of the American Chemical Society 128(24) (2006) 7728-7729
Space group: P 1 21/c 1
Cell volume: 2191.3
Cell parameters: 12.868; 12.278; 14.193; 90; 102.27; 90;  

COD ID: 4101295
CIF file Formula: - C61 H21 F26 N7 O5 -
Comments: Hiroto, Satoru; Shinokubo, Hiroshi; Osuka, Atsuhiro Porphyrin synthesis in water provides new expanded porphyrins with direct bipyrrole linkages: isolation and characterization of two heptaphyrins. Journal of the American Chemical Society 128(20) (2006) 6568-6569
Space group: P 1 21/c 1
Cell volume: 5485.9
Cell parameters: 10.382; 18.552; 28.499; 90; 91.956; 90;  

COD ID: 4101296
CIF file Formula: - C161 H44 Cl3 F90 N14 O25 -
Comments: Hiroto, Satoru; Shinokubo, Hiroshi; Osuka, Atsuhiro Porphyrin synthesis in water provides new expanded porphyrins with direct bipyrrole linkages: isolation and characterization of two heptaphyrins. Journal of the American Chemical Society 128(20) (2006) 6568-6569
Space group: P 1 21/c 1
Cell volume: 21642
Cell parameters: 19.12; 31.455; 39.222; 90; 113.439; 90;  

COD ID: 4101297
CIF file Formula: - C99 H31 Cl3 F35 N8 -
Comments: Hiroto, Satoru; Shinokubo, Hiroshi; Osuka, Atsuhiro Porphyrin synthesis in water provides new expanded porphyrins with direct bipyrrole linkages: isolation and characterization of two heptaphyrins. Journal of the American Chemical Society 128(20) (2006) 6568-6569
Space group: P -1
Cell volume: 4273
Cell parameters: 11.921; 13.3; 29.176; 101.478; 95.064; 107.334;  

COD ID: 4101298
CIF file Formula: ?
Comments: Reczek, Joseph J; Villazor, Karen R; Lynch, Vincent; Swager, Timothy M; Iverson, Brent L Tunable columnar mesophases utilizing C2 symmetric aromatic donor-acceptor complexes. Journal of the American Chemical Society 128(24) (2006) 7995-8002
Space group: P 1 21/n 1
Cell volume: 1723.46
Cell parameters: 14.8265; 7.0692; 16.7136; 90; 100.316; 90;  

COD ID: 4101299
CIF file Formula: ?
Comments: Reczek, Joseph J; Villazor, Karen R; Lynch, Vincent; Swager, Timothy M; Iverson, Brent L Tunable columnar mesophases utilizing C2 symmetric aromatic donor-acceptor complexes. Journal of the American Chemical Society 128(24) (2006) 7995-8002
Space group: P 1 21/c 1
Cell volume: 1014.13
Cell parameters: 10.1516; 9.8122; 10.1948; 90; 92.974; 90;  

COD ID: 4101300
CIF file Formula: ?
Comments: Reczek, Joseph J; Villazor, Karen R; Lynch, Vincent; Swager, Timothy M; Iverson, Brent L Tunable columnar mesophases utilizing C2 symmetric aromatic donor-acceptor complexes. Journal of the American Chemical Society 128(24) (2006) 7995-8002
Space group: C 1 2 1
Cell volume: 2422.97
Cell parameters: 41.893; 6.8695; 8.4203; 90; 90.833; 90;  

COD ID: 4101301
CIF file Formula: ?
Comments: Reczek, Joseph J; Villazor, Karen R; Lynch, Vincent; Swager, Timothy M; Iverson, Brent L Tunable columnar mesophases utilizing C2 symmetric aromatic donor-acceptor complexes. Journal of the American Chemical Society 128(24) (2006) 7995-8002
Space group: P 1 21/c 1
Cell volume: 676.164
Cell parameters: 9.2006; 8.5041; 8.6679; 90; 94.442; 90;  

COD ID: 4101302
CIF file Formula: - C36 H72 K2 N4 O12 Pb12 Pt -
Comments: Esenturk, Emren N; Fettinger, James; Eichhorn, Bryan The Pb12(2-) and Pb10(2-) zintl ions and the M@Pb12(2-) and M@Pb10(2-) cluster series where M = Ni, Pd, Pt. Journal of the American Chemical Society 128(28) (2006) 9178-9186
Space group: P -3
Cell volume: 1719.1
Cell parameters: 13.041; 13.041; 11.672; 90; 90; 120;  

COD ID: 4101303
CIF file Formula: - C43 H80 K2 N4 O12 Pb12 Pd -
Comments: Esenturk, Emren N; Fettinger, James; Eichhorn, Bryan The Pb12(2-) and Pb10(2-) zintl ions and the M@Pb12(2-) and M@Pb10(2-) cluster series where M = Ni, Pd, Pt. Journal of the American Chemical Society 128(28) (2006) 9178-9186
Space group: P -1
Cell volume: 3582.8
Cell parameters: 13.59; 13.9389; 22.1236; 72.1144; 85.2884; 64.1532;  

COD ID: 4101304
CIF file Formula: - C38 H80 K2 N6 Ni0.5 O12 Pb6 -
Comments: Esenturk, Emren N; Fettinger, James; Eichhorn, Bryan The Pb12(2-) and Pb10(2-) zintl ions and the M@Pb12(2-) and M@Pb10(2-) cluster series where M = Ni, Pd, Pt. Journal of the American Chemical Society 128(28) (2006) 9178-9186
Space group: P -1
Cell volume: 2882.6
Cell parameters: 14.512; 15.406; 16.335; 62.961; 64.337; 87.126;  

COD ID: 4101305
CIF file Formula: - C36 H72 K2 N4 Ni O12 Pb10 -
Comments: Esenturk, Emren N; Fettinger, James; Eichhorn, Bryan The Pb12(2-) and Pb10(2-) zintl ions and the M@Pb12(2-) and M@Pb10(2-) cluster series where M = Ni, Pd, Pt. Journal of the American Chemical Society 128(28) (2006) 9178-9186
Space group: C 1 2/c 1
Cell volume: 6302.7
Cell parameters: 24.843; 11.9405; 21.403; 90; 96.907; 90;  

COD ID: 4101306
CIF file Formula: - C16 H24 O2 -
Comments: McFadden, Ryan M; Stoltz, Brian M The catalytic enantioselective, protecting group-free total synthesis of (+)-dichroanone. Journal of the American Chemical Society 128(24) (2006) 7738-7739
Space group: P 1 21 1
Cell volume: 702.2
Cell parameters: 7.2276; 9.3724; 10.3744; 90; 92.231; 90;  

COD ID: 4101307
CIF file Formula: - C4 H12 Cl3 Mn N -
Comments: Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure. Journal of the American Chemical Society 128(28) (2006) 9205-9210
Space group: P 63/m
Cell volume: 468.4
Cell parameters: 9.1287; 9.1287; 6.4903; 90; 90; 120;  

COD ID: 4101308
CIF file Formula: - C4 H12 Cl3 Mn N -
Comments: Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure. Journal of the American Chemical Society 128(28) (2006) 9205-9210
Space group: P 63/m
Cell volume: 463.08
Cell parameters: 9.0893; 9.0893; 6.4724; 90; 90; 120;  

COD ID: 4101309
CIF file Formula: - C4 H12 Cl3 Mn N -
Comments: Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure. Journal of the American Chemical Society 128(28) (2006) 9205-9210
Space group: P 63/m
Cell volume: 442.32
Cell parameters: 8.9326; 8.9326; 6.401; 90; 90; 120;  

COD ID: 4101310
CIF file Formula: - C4 H12 Cl3 Mn N -
Comments: Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure. Journal of the American Chemical Society 128(28) (2006) 9205-9210
Space group: P 63/m
Cell volume: 433.76
Cell parameters: 8.8728; 8.8728; 6.362; 90; 90; 120;  

COD ID: 4101311
CIF file Formula: - C4 H12 Cl3 Mn N -
Comments: Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure. Journal of the American Chemical Society 128(28) (2006) 9205-9210
Space group: P 63/m
Cell volume: 453.88
Cell parameters: 9.0215; 9.0215; 6.4395; 90; 90; 120;  

COD ID: 4101312
CIF file Formula: - C4 H12 Cl3 Mn N -
Comments: Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure. Journal of the American Chemical Society 128(28) (2006) 9205-9210
Space group: P 63/m
Cell volume: 476.89
Cell parameters: 9.188; 9.188; 6.523; 90; 90; 120;  

COD ID: 4101313
CIF file Formula: - B2 O7 Se2 -
Comments: Kong, Fang; Huang, Shu-Ping; Sun, Zhong-Ming; Mao, Jiang-Gao; Cheng, Wen-Dan Se2(B2O7): a new type of second-order NLO material. Journal of the American Chemical Society 128(24) (2006) 7750-7751
Space group: P 21 21 21
Cell volume: 534.65
Cell parameters: 7.4815; 7.8984; 9.0478; 90; 90; 90;  

COD ID: 4101314
CIF file Formula: - C16 H12 Cl4 Ga S4 Se8 -
Comments: Endo, Hisataka; Kawamoto, Tadashi; Mori, Takehiko; Terasaki, Ichiro; Kakiuchi, Toru; Sawa, Hiroshi; Kodani, Mie; Takimiya, Kazuo; Otsubo, Tetsuo Current-induced metallic state in an organic (EDT-TSF)2GaCl4 conductor. Journal of the American Chemical Society 128(28) (2006) 9006-9007
Space group: P 1 21/m 1
Cell volume: 1474
Cell parameters: 7.29; 30.69; 6.7; 90; 100.38; 90;  

COD ID: 4101315
CIF file Formula: - C16 H12 Cl4 Fe S4 Se8 -
Comments: Endo, Hisataka; Kawamoto, Tadashi; Mori, Takehiko; Terasaki, Ichiro; Kakiuchi, Toru; Sawa, Hiroshi; Kodani, Mie; Takimiya, Kazuo; Otsubo, Tetsuo Current-induced metallic state in an organic (EDT-TSF)2GaCl4 conductor. Journal of the American Chemical Society 128(28) (2006) 9006-9007
Space group: P 1 21/m 1
Cell volume: 1471
Cell parameters: 7.29; 30.655; 6.696; 90; 100.42; 90;  

COD ID: 4101316
CIF file Formula: - C57 H55 N O4 P2 Pd S -
Comments: Fujita, Ken-ichi; Yamashita, Makoto; Puschmann, Florian; Alvarez-Falcon, Miguel Martinez; Incarvito, Christopher D; Hartwig, John F Organometallic chemistry of amidate complexes. accelerating effect of bidentate ligands on the reductive elimination of N-aryl amidates from palladium(II). Journal of the American Chemical Society 128(28) (2006) 9044-9045
Space group: P 1 21/c 1
Cell volume: 4688.8
Cell parameters: 16.949; 10.207; 27.236; 90; 95.64; 90;  

COD ID: 4101317
CIF file Formula: - C32 H40 Fe N O P Pd -
Comments: Fujita, Ken-ichi; Yamashita, Makoto; Puschmann, Florian; Alvarez-Falcon, Miguel Martinez; Incarvito, Christopher D; Hartwig, John F Organometallic chemistry of amidate complexes. accelerating effect of bidentate ligands on the reductive elimination of N-aryl amidates from palladium(II). Journal of the American Chemical Society 128(28) (2006) 9044-9045
Space group: P 1 21/c 1
Cell volume: 2904.9
Cell parameters: 12.597; 10.484; 22.535; 90; 102.56; 90;  

COD ID: 4101318
CIF file Formula: - C32 H42 Fe N O2 P Pd S -
Comments: Fujita, Ken-ichi; Yamashita, Makoto; Puschmann, Florian; Alvarez-Falcon, Miguel Martinez; Incarvito, Christopher D; Hartwig, John F Organometallic chemistry of amidate complexes. accelerating effect of bidentate ligands on the reductive elimination of N-aryl amidates from palladium(II). Journal of the American Chemical Society 128(28) (2006) 9044-9045
Space group: P -1
Cell volume: 1542.6
Cell parameters: 10.044; 12.385; 14.483; 114.4; 98.26; 102.83;  

COD ID: 4101319
CIF file Formula: - C30 H28 S8 -
Comments: Christensen, Christian A; Batsanov, Andrei S; Bryce, Martin R Extreme conformational constraints in pi-extended tetrathiafulvalenes: unusual topologies and redox behavior of doubly and triply bridged cyclophanes. Journal of the American Chemical Society 128(32) (2006) 10484-10490
Space group: P -1
Cell volume: 1469.9
Cell parameters: 9.0464; 9.7954; 17.4231; 82.06; 81.058; 75.71;  

COD ID: 4101320
CIF file Formula: - C37 H36 S8 -
Comments: Christensen, Christian A; Batsanov, Andrei S; Bryce, Martin R Extreme conformational constraints in pi-extended tetrathiafulvalenes: unusual topologies and redox behavior of doubly and triply bridged cyclophanes. Journal of the American Chemical Society 128(32) (2006) 10484-10490
Space group: C 1 2/c 1
Cell volume: 3521.1
Cell parameters: 17.1006; 12.3124; 18.1867; 90; 113.14; 90;  

COD ID: 4101321
CIF file Formula: - C28 H24 S8 -
Comments: Christensen, Christian A; Batsanov, Andrei S; Bryce, Martin R Extreme conformational constraints in pi-extended tetrathiafulvalenes: unusual topologies and redox behavior of doubly and triply bridged cyclophanes. Journal of the American Chemical Society 128(32) (2006) 10484-10490
Space group: P 1 21/n 1
Cell volume: 2814.7
Cell parameters: 9.1056; 19.1969; 16.1399; 90; 93.89; 90;  

COD ID: 4101322
CIF file Formula: - C44 H42 Cl4 O6 S8 -
Comments: Christensen, Christian A; Batsanov, Andrei S; Bryce, Martin R Extreme conformational constraints in pi-extended tetrathiafulvalenes: unusual topologies and redox behavior of doubly and triply bridged cyclophanes. Journal of the American Chemical Society 128(32) (2006) 10484-10490
Space group: P 1 21/c 1
Cell volume: 4707.6
Cell parameters: 11.6582; 16.0938; 25.285; 90; 97.11; 90;  

COD ID: 4101323
CIF file Formula: - C29.85 H59.55 Al2 Cl2.15 Cr N S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P 1 21/c 1
Cell volume: 3783
Cell parameters: 13.782; 12.776; 21.606; 90; 96.037; 90;  

COD ID: 4101324
CIF file Formula: - C26.5 H43 Al Cl6 Cr N S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P 1 21/n 1
Cell volume: 3595.1
Cell parameters: 10.8236; 29.167; 11.75; 90; 104.261; 90;  

COD ID: 4101325
CIF file Formula: - C20 H39 Al Cl6 Cr N O S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P 1 21/c 1
Cell volume: 3128.9
Cell parameters: 7.4228; 25.919; 16.281; 90; 92.681; 90;  

COD ID: 4101326
CIF file Formula: - C16 H30 Al3 Cl12 Cr N S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P -1
Cell volume: 1857.1
Cell parameters: 9.467; 11.999; 17.895; 83.573; 81.026; 67.885;  

COD ID: 4101327
CIF file Formula: - C24 H49 Al Cl3 Cr N S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P -1
Cell volume: 1601.7
Cell parameters: 10.987; 12.816; 13.475; 67.23; 83.158; 66.385;  

COD ID: 4101328
CIF file Formula: - C20 H39 Cl2 Cr N O S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P 1 21/n 1
Cell volume: 2475
Cell parameters: 11.198; 20.051; 12.262; 90; 115.98; 90;  

COD ID: 4101329
CIF file Formula: - C16 H30 Cl Cr N S2 -
Comments: Jabri, Amir; Temple, Claire; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert Role of the metal oxidation state in the SNS-Cr catalyst for ethylene trimerization: isolation of di- and trivalent cationic intermediates. Journal of the American Chemical Society 128(28) (2006) 9238-9247
Space group: P -1
Cell volume: 965.5
Cell parameters: 8.019; 8.794; 14.224; 79.18; 78.75; 85.58;  

COD ID: 4101330
CIF file Formula: - C28.5 H31.5 Dy Fe N14.5 O26 -
Comments: Ferbinteanu, Marilena; Kajiwara, Takashi; Choi, Kwang-Yong; Nojiri, Hiroyuki; Nakamoto, Akio; Kojima, Norimichi; Cimpoesu, Fanica; Fujimura, Yuichi; Takaishi, Shinya; Yamashita, Masahiro A binuclear Fe(III)Dy(III) single molecule magnet. Quantum effects and models. Journal of the American Chemical Society 128(28) (2006) 9008-9009
Space group: P -1
Cell volume: 2157.4
Cell parameters: 11.115; 13.567; 15.758; 103.462; 92.753; 109.525;  

COD ID: 4101331
CIF file Formula: - C39 H47 N5 -
Comments: Rosenthal, Joel; Hodgkiss, Justin M; Young, Elizabeth R; Nocera, Daniel G Spectroscopic determination of proton position in the proton-coupled electron transfer pathways of donor-acceptor supramolecule assemblies. Journal of the American Chemical Society 128(32) (2006) 10474-10483
Space group: P -1
Cell volume: 1621.4
Cell parameters: 10.671; 12.0211; 13.823; 78.04; 78.255; 70.89;  

COD ID: 4101332
CIF file Formula: - C28 H28 O8 -
Comments: Gerard, Baudouin; Sangji, Sheharbano; O'Leary, Daniel J; Porco, Jr, John A Enantioselective photocycloaddition mediated by chiral Brønsted acids: asymmetric synthesis of the rocaglamides. Journal of the American Chemical Society 128(24) (2006) 7754-7755
Space group: P -1
Cell volume: 1157.17
Cell parameters: 10.0768; 10.4422; 12.5172; 109.267; 106.75; 96.752;  

COD ID: 4101333
CIF file Formula: - C125 H90 Cl6 O8 -
Comments: Gerard, Baudouin; Sangji, Sheharbano; O'Leary, Daniel J; Porco, Jr, John A Enantioselective photocycloaddition mediated by chiral Brønsted acids: asymmetric synthesis of the rocaglamides. Journal of the American Chemical Society 128(24) (2006) 7754-7755
Space group: C 1 2 1
Cell volume: 11196
Cell parameters: 25.603; 16.0366; 27.6197; 90; 99.148; 90;  

COD ID: 4101334
CIF file Formula: - C73 H50 O4 -
Comments: Gerard, Baudouin; Sangji, Sheharbano; O'Leary, Daniel J; Porco, Jr, John A Enantioselective photocycloaddition mediated by chiral Brønsted acids: asymmetric synthesis of the rocaglamides. Journal of the American Chemical Society 128(24) (2006) 7754-7755
Space group: P 1 21 1
Cell volume: 2913.9
Cell parameters: 10.2354; 18.0628; 16.1878; 90; 103.189; 90;  

COD ID: 4101335
CIF file Formula: - C74 H98 N24 O22 V10 -
Comments: Laye, Rebecca H; Wei, Qiang; Mason, Pamela V; Shanmugam, Maheswaran; Teat, Simon J; Brechin, Euan K; Collison, David; McInnes, Eric J L A highly reduced vanadium(III/IV) polyoxovanadate comprising an octavanadyl square-prism surrounding a dimetallic vanadium(III) fragment. Journal of the American Chemical Society 128(28) (2006) 9020-9021
Space group: I 4/m m m
Cell volume: 5671.8
Cell parameters: 17.495; 17.495; 18.5306; 90; 90; 90;  

COD ID: 4101336
CIF file Formula: - C26 H22 N2 O4 Pd2 -
Comments: Thu, Hung-Yat; Yu, Wing-Yiu; Che, Chi-Ming Intermolecular amidation of unactivated sp2 and sp2 C-H bonds via palladium-catalyzed cascade C-H activation/nitrene insertion. Journal of the American Chemical Society 128(28) (2006) 9048-9049
Space group: P 1 21/c 1
Cell volume: 2321.9
Cell parameters: 9.918; 13.261; 17.723; 90; 95.05; 90;  

COD ID: 4101337
CIF file Formula: - C14 H11 F3 N2 O -
Comments: Thu, Hung-Yat; Yu, Wing-Yiu; Che, Chi-Ming Intermolecular amidation of unactivated sp2 and sp2 C-H bonds via palladium-catalyzed cascade C-H activation/nitrene insertion. Journal of the American Chemical Society 128(28) (2006) 9048-9049
Space group: P 1 21/c 1
Cell volume: 1300.8
Cell parameters: 10.356; 17.055; 7.401; 90; 95.65; 90;  

COD ID: 4101338
CIF file Formula: - C22 H42 I2 N2 O3 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: C 1 2/c 1
Cell volume: 2670.7
Cell parameters: 11.7556; 13.8565; 17.1139; 90; 106.66; 90;  

COD ID: 4101339
CIF file Formula: - C28 H30 F12 I2 N2 O3 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: P b c 21
Cell volume: 6899
Cell parameters: 9.1025; 17.4883; 43.339; 90; 90; 90;  

COD ID: 4101340
CIF file Formula: - C40 H66 I2 N2 O4 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: P 1 21/c 1
Cell volume: 4264.5
Cell parameters: 16.6844; 13.7864; 18.5403; 90; 90.311; 90;  

COD ID: 4101341
CIF file Formula: - C18 H28 I2 N4 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: P 1 21/c 1
Cell volume: 1197.3
Cell parameters: 8.2887; 15.6397; 9.7391; 90; 108.495; 90;  

COD ID: 4101342
CIF file Formula: - C44 H48 I2 N2 O2 P2 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: P 1 21/c 1
Cell volume: 4485.2
Cell parameters: 11.7915; 20.984; 18.416; 90; 100.172; 90;  

COD ID: 4101343
CIF file Formula: - C18 H44 I2 N2 O P2 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: P -4 21 c
Cell volume: 5871.7
Cell parameters: 23.516; 23.516; 10.6177; 90; 90; 90;  

COD ID: 4101344
CIF file Formula: - C23 H28 Cl2 F6 N2 O8 S2 U -
Comments: Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey Synthesis and reactivity of the imido analogues of the uranyl ion. Journal of the American Chemical Society 128(32) (2006) 10549-10559
Space group: P 1 21/n 1
Cell volume: 3248.2
Cell parameters: 13.224; 16.179; 15.338; 90; 98.158; 90;  

COD ID: 4101345
CIF file Formula: - La3 Ni2 O6 -
Comments: Poltavets, Viktor V; Lokshin, Konstantin A; Dikmen, Sibel; Croft, Mark; Egami, Takeshi; Greenblatt, Martha La3Ni2O6: a new double T'-type nickelate with infinite Ni1+/2+O2 layers. Journal of the American Chemical Society 128(28) (2006) 9050-9051
Space group: I 4/m m m
Cell volume: 304.21
Cell parameters: 3.9686; 3.9686; 19.3154; 90; 90; 90;  

COD ID: 4101346
CIF file Formula: - C20 H33 Mo N O -
Comments: Graham, Peter M; Buschhaus, Miriam S A; Legzdins, Peter Intramolecular C-H activation reactions of molybdenacyclobutanes. Journal of the American Chemical Society 128(28) (2006) 9038-9039
Space group: P -1
Cell volume: 945.7
Cell parameters: 8.3346; 8.4671; 14.5068; 84.83; 85.483; 68.227;  

COD ID: 4101347
CIF file Formula: - C21 H33 Mo N O -
Comments: Graham, Peter M; Buschhaus, Miriam S A; Legzdins, Peter Intramolecular C-H activation reactions of molybdenacyclobutanes. Journal of the American Chemical Society 128(28) (2006) 9038-9039
Space group: P 1 21/c 1
Cell volume: 1997.1
Cell parameters: 8.9342; 13.7757; 16.5414; 90; 101.191; 90;  

COD ID: 4101348
CIF file Formula: - C23 H39 Mo N O -
Comments: Graham, Peter M; Buschhaus, Miriam S A; Legzdins, Peter Intramolecular C-H activation reactions of molybdenacyclobutanes. Journal of the American Chemical Society 128(28) (2006) 9038-9039
Space group: C 1 2/c 1
Cell volume: 4561.5
Cell parameters: 19.614; 17.1143; 15.5191; 90; 118.88; 90;  

COD ID: 4101349
CIF file Formula: - C14 H25 N O8 S -
Comments: Schnermann, Martin J; Romero, F Anthony; Hwang, Inkyu; Nakamaru-Ogiso, Eiko; Yagi, Takao; Boger, Dale L Total synthesis of piericidin A1 and B1 and key analogues. Journal of the American Chemical Society 128(36) (2006) 11799-11807
Space group: P 1 21/c 1
Cell volume: 1815.1
Cell parameters: 10.574; 15.982; 10.753; 90; 92.79; 90;  

COD ID: 4101350
CIF file Formula: - C18 H33 N O4 Si -
Comments: Schnermann, Martin J; Romero, F Anthony; Hwang, Inkyu; Nakamaru-Ogiso, Eiko; Yagi, Takao; Boger, Dale L Total synthesis of piericidin A1 and B1 and key analogues. Journal of the American Chemical Society 128(36) (2006) 11799-11807
Space group: P 1 21/c 1
Cell volume: 2025
Cell parameters: 15.341; 8.307; 15.902; 90; 92.24; 90;  

COD ID: 4101351
CIF file Formula: - C17 H14 O2 S -
Comments: Wang, Wei; Li, Hao; Wang, Jian; Zu, Liansuo Enantioselective organocatalytic tandem Michael-Aldol reactions: one-pot synthesis of chiral thiochromenes. Journal of the American Chemical Society 128(32) (2006) 10354-10355
Space group: P 21 21 21
Cell volume: 1387.28
Cell parameters: 5.936; 10.2325; 22.8396; 90; 90; 90;  

COD ID: 4101352
CIF file Formula: - C27 H35 I2 N3 Ni -
Comments: Jones, Gavin D; Martin, Jason L; McFarland, Chris; Allen, Olivia R; Hall, Ryan E; Haley, Aireal D; Brandon, R Jacob; Konovalova, Tatyana; Desrochers, Patrick J; Pulay, Peter; Vicic, David A Ligand redox effects in the synthesis, electronic structure, and reactivity of an alkyl-alkyl cross-coupling catalyst. Journal of the American Chemical Society 128(40) (2006) 13175-13183
Space group: P 1 21/a 1
Cell volume: 2920
Cell parameters: 12.9214; 17.031; 13.687; 90; 104.194; 90;  

COD ID: 4101353
CIF file Formula: - C22 H24 Cl3 N5 O2 -
Comments: Lebel, Olivier; Maris, Thierry; Perron, Marie-Eve; Demers, Eric; Wuest, James D The dark side of crystal engineering: creating glasses from small symmetric molecules that form multiple hydrogen bonds. Journal of the American Chemical Society 128(32) (2006) 10372-10373
Space group: C 1 2/c 1
Cell volume: 5772.5
Cell parameters: 24.7394; 13.3588; 19.2393; 90; 114.79; 90;  

COD ID: 4101354
CIF file Formula: - C69.5 H85.1 Cl1.5 N3 O9 -
Comments: Jiang, Xuan; Bollinger, John C; Lee, Dongwhan Two-dimensional electronic conjugation: cooperative folding and fluorescence switching. Journal of the American Chemical Society 128(36) (2006) 11732-11733
Space group: R -3 :H
Cell volume: 9914
Cell parameters: 19.775; 19.775; 29.273; 90; 90; 120;  

COD ID: 4101355
CIF file Formula: - C64 H32 Co4 N8 O17 -
Comments: Ma, Shengqian; Zhou, Hong-Cai A metal-organic framework with entatic metal centers exhibiting high gas adsorption affinity. Journal of the American Chemical Society 128(36) (2006) 11734-11735
Space group: I m -3 m
Cell volume: 16462.1
Cell parameters: 25.4387; 25.4387; 25.4387; 90; 90; 90;  

COD ID: 4101356
CIF file Formula: - C90 H124 N12 O26 Ru6 -
Comments: Grote, Zacharias; Bonazzi, Simone; Scopelliti, Rosario; Severin, Kay Bridged dihydroxypyridine ligands for the synthesis of expanded helicates. Journal of the American Chemical Society 128(32) (2006) 10382-10383
Space group: P n a 21
Cell volume: 9570.3
Cell parameters: 21.3799; 24.3158; 18.4091; 90; 90; 90;  

COD ID: 4101357
CIF file Formula: - C90 H154 N12 O38 Ru6 -
Comments: Grote, Zacharias; Bonazzi, Simone; Scopelliti, Rosario; Severin, Kay Bridged dihydroxypyridine ligands for the synthesis of expanded helicates. Journal of the American Chemical Society 128(32) (2006) 10382-10383
Space group: I 1 2/a 1
Cell volume: 11288
Cell parameters: 24.471; 14.566; 31.674; 90; 91.08; 90;  

COD ID: 4101358
CIF file Formula: - C147 H229 N15 O17 Rh6 -
Comments: Grote, Zacharias; Bonazzi, Simone; Scopelliti, Rosario; Severin, Kay Bridged dihydroxypyridine ligands for the synthesis of expanded helicates. Journal of the American Chemical Society 128(32) (2006) 10382-10383
Space group: P 21 3
Cell volume: 17091
Cell parameters: 25.758; 25.758; 25.758; 90; 90; 90;  

COD ID: 4101359
CIF file Formula: - Mg0.18 Sc3 Zn17.73 -
Comments: Lin, Qisheng; Corbett, John D The 1/1 and 2/1 approximants in the Sc-Mg-Zn quasicrystal system: triacontahedral clusters as fundamental building blocks. Journal of the American Chemical Society 128(40) (2006) 13268-13273
Space group: I m -3
Cell volume: 2664.2
Cell parameters: 13.8629; 13.8629; 13.8629; 90; 90; 90;  

COD ID: 4101360
CIF file Formula: - Mg2.52 Sc11.18 Zn73.61 -
Comments: Lin, Qisheng; Corbett, John D The 1/1 and 2/1 approximants in the Sc-Mg-Zn quasicrystal system: triacontahedral clusters as fundamental building blocks. Journal of the American Chemical Society 128(40) (2006) 13268-13273
Space group: P a -3
Cell volume: 11257.5
Cell parameters: 22.412; 22.412; 22.412; 90; 90; 90;  

COD ID: 4101361
CIF file Formula: - C22 H23 N O2 S -
Comments: Shibata, Takanori; Tahara, Yu-ki Enantioselective intramolecular [2 + 2 + 2] cycloaddition of 1,4-diene-ynes: a new approach to the construction of quaternary carbon stereocenters. Journal of the American Chemical Society 128(36) (2006) 11766-11767
Space group: P 1 21 1
Cell volume: 917.7
Cell parameters: 6.238; 7.844; 18.827; 90; 94.98; 90;  

COD ID: 4101362
CIF file Formula: - C46 H41 Cl2 N2 P Pd S -
Comments: Matano, Yoshihiro; Miyajima, Tooru; Nakabuchi, Takashi; Imahori, Hiroshi; Ochi, Noriaki; Sakaki, Shigeyoshi Phosphorus-containing hybrid calixphyrins: promising mixed-donor ligands for visible and efficient palladium catalysts. Journal of the American Chemical Society 128(36) (2006) 11760-11761
Space group: C 1 2/c 1
Cell volume: 7674
Cell parameters: 22.055; 12.648; 27.807; 90; 98.3576; 90;  

COD ID: 4101363
CIF file Formula: - C92 H82 Cl4 N4 P2 S2 -
Comments: Matano, Yoshihiro; Miyajima, Tooru; Nakabuchi, Takashi; Imahori, Hiroshi; Ochi, Noriaki; Sakaki, Shigeyoshi Phosphorus-containing hybrid calixphyrins: promising mixed-donor ligands for visible and efficient palladium catalysts. Journal of the American Chemical Society 128(36) (2006) 11760-11761
Space group: P 1 21/n 1
Cell volume: 7817
Cell parameters: 26.188; 10.1923; 31.765; 90; 112.779; 90;  

COD ID: 4101364
CIF file Formula: - C40 H49 Cl2 F4 N2 P Ru -
Comments: Ritter, Tobias; Day, Michael W; Grubbs, Robert H Rate acceleration in olefin metathesis through a fluorine-ruthenium interaction. Journal of the American Chemical Society 128(36) (2006) 11768-11769
Space group: P -1
Cell volume: 1900.6
Cell parameters: 9.7554; 10.0375; 19.968; 87.666; 77.183; 85.699;  

COD ID: 4101365
CIF file Formula: - C25 H22 Cl2 F4 N2 O Ru -
Comments: Ritter, Tobias; Day, Michael W; Grubbs, Robert H Rate acceleration in olefin metathesis through a fluorine-ruthenium interaction. Journal of the American Chemical Society 128(36) (2006) 11768-11769
Space group: P 1 21/c 1
Cell volume: 2401.22
Cell parameters: 15.8715; 13.4827; 11.2212; 90; 90.146; 90;  

COD ID: 4101366
CIF file Formula: - C25 H22 Cl6 N2 O Ru -
Comments: Ritter, Tobias; Day, Michael W; Grubbs, Robert H Rate acceleration in olefin metathesis through a fluorine-ruthenium interaction. Journal of the American Chemical Society 128(36) (2006) 11768-11769
Space group: P 1 21/c 1
Cell volume: 10580.6
Cell parameters: 15.9798; 16.9461; 39.4746; 90; 98.185; 90;  

COD ID: 4101367
CIF file Formula: - C45 H58 Cl6 F4 N3 O3 P Ru -
Comments: Ritter, Tobias; Day, Michael W; Grubbs, Robert H Rate acceleration in olefin metathesis through a fluorine-ruthenium interaction. Journal of the American Chemical Society 128(36) (2006) 11768-11769
Space group: P -1
Cell volume: 4829.7
Cell parameters: 14.8554; 17.3381; 19.4448; 102.681; 97.261; 93.09;  

COD ID: 4101368
CIF file Formula: - C42 H36.5 Cl2 F8 N4 O1.25 Ru -
Comments: Ritter, Tobias; Day, Michael W; Grubbs, Robert H Rate acceleration in olefin metathesis through a fluorine-ruthenium interaction. Journal of the American Chemical Society 128(36) (2006) 11768-11769
Space group: I -4
Cell volume: 7789.8
Cell parameters: 27.2151; 27.2151; 10.5174; 90; 90; 90;  

COD ID: 4101369
CIF file Formula: - C11 H6 Br2 Fe0.5 S5 Se4 -
Comments: Hayashi, Toshiki; Xiao, Xunwen; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Fujimoto, Tsutomu; Yasuzuka, Syuma; Yoshino, Harukazu; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko A metallic (EDT-DSDTFVSDS)2.FeBr4 salt: antiferromagnetic ordering of d spins of FeBr4- ions and anomalous magnetoresistance due to preferential pi-d interaction. Journal of the American Chemical Society 128(36) (2006) 11746-11747
Space group: P c c n
Cell volume: 3960
Cell parameters: 37.64; 7.498; 14.03; 90; 90; 90;  

COD ID: 4101370
CIF file Formula: - C11 H6 Br2 Ga0.5 S5 Se4 -
Comments: Hayashi, Toshiki; Xiao, Xunwen; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Fujimoto, Tsutomu; Yasuzuka, Syuma; Yoshino, Harukazu; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko A metallic (EDT-DSDTFVSDS)2.FeBr4 salt: antiferromagnetic ordering of d spins of FeBr4- ions and anomalous magnetoresistance due to preferential pi-d interaction. Journal of the American Chemical Society 128(36) (2006) 11746-11747
Space group: P c c n
Cell volume: 3978.7
Cell parameters: 37.766; 7.5021; 14.043; 90; 90; 90;  

COD ID: 4101371
CIF file Formula: - C40 H60 B N3 Pt -
Comments: Khaskin, Eugene; Zavalij, Peter Y; Vedernikov, Andrei N Facile arene C-H bond activation and alkane dehydrogenation with anionic LPt(II)Me2- in hydrocarbon-water systems (L = dimethyldi(2-pyridyl)borate). Journal of the American Chemical Society 128(40) (2006) 13054-13055
Space group: P 1 21/n 1
Cell volume: 3765
Cell parameters: 13.177; 18.665; 15.421; 90; 96.982; 90;  

COD ID: 4101372
CIF file Formula: - C44 H78 Al Mg N3 O3 Si2 -
Comments: Nembenna, Sharanappa; Roesky, Herbert W; Mandal, Swadhin K; Oswald, Rainer B; Pal, Aritra; Herbst-Irmer, Regine; Noltemeyer, Mathias; Schmidt, Hans-Georg Soluble molecular compounds with the Mg-O-Al structural motif: a model approach for the fixation of organometallics on a MgO surface. Journal of the American Chemical Society 128(40) (2006) 13056-13057
Space group: P 1 21/n 1
Cell volume: 4900.5
Cell parameters: 11.746; 21.439; 19.87; 90; 101.66; 90;  

COD ID: 4101373
CIF file Formula: - C68 H104 Al2 Mg N4 O4 -
Comments: Nembenna, Sharanappa; Roesky, Herbert W; Mandal, Swadhin K; Oswald, Rainer B; Pal, Aritra; Herbst-Irmer, Regine; Noltemeyer, Mathias; Schmidt, Hans-Georg Soluble molecular compounds with the Mg-O-Al structural motif: a model approach for the fixation of organometallics on a MgO surface. Journal of the American Chemical Society 128(40) (2006) 13056-13057
Space group: P 1 21/c 1
Cell volume: 6537.3
Cell parameters: 16.067; 23.113; 18.001; 90; 102.06; 90;  

COD ID: 4101374
CIF file Formula: - C19 H6 Cl F36 O7 P2 Rh -
Comments: Yanagisawa, Shuichi; Sudo, Tomoko; Noyori, Ryoji; Itami, Kenichiro Direct C-H arylation of (hetero)arenes with aryl iodides via rhodium catalysis. Journal of the American Chemical Society 128(36) (2006) 11748-11749
Space group: C 1 2/c 1
Cell volume: 7717.8
Cell parameters: 33.05; 17.903; 13.525; 90; 105.332; 90;  

COD ID: 4101375
CIF file Formula: - C23 H21 N2 O -
Comments: Wang, Ying; Wang, Hongmei; Liu, Yunqi; Di, Chong-An; Sun, Yanming; Wu, Weiping; Yu, Gui; Zhang, Deqing; Zhu, Daoben 1-Imino nitroxide pyrene for high performance organic field-effect transistors with low operating voltage. Journal of the American Chemical Society 128(40) (2006) 13058-13059
Space group: P 1 21/n 1
Cell volume: 1804
Cell parameters: 10.392; 7.2494; 24.22; 90; 98.63; 90;  

COD ID: 4101376
CIF file Formula: - C71 H90 B2 Ir2 N14 -
Comments: Alvarez, Eleuterio; Conejero, Salvador; Paneque, Margarita; Petronilho, Ana; Poveda, Manuel L; Serrano, Oracio; Carmona, Ernesto Iridium(III)-induced isomerization of 2-substituted pyridines to N-heterocyclic carbenes. Journal of the American Chemical Society 128(40) (2006) 13060-13061
Space group: P 1 21/n 1
Cell volume: 3379.95
Cell parameters: 10.3293; 25.2058; 13.1798; 90; 99.941; 90;  

COD ID: 4101377
CIF file Formula: - C39 H43 B Cl2 Ir N7 -
Comments: Alvarez, Eleuterio; Conejero, Salvador; Paneque, Margarita; Petronilho, Ana; Poveda, Manuel L; Serrano, Oracio; Carmona, Ernesto Iridium(III)-induced isomerization of 2-substituted pyridines to N-heterocyclic carbenes. Journal of the American Chemical Society 128(40) (2006) 13060-13061
Space group: C 1 2/c 1
Cell volume: 7464.1
Cell parameters: 40.2432; 10.1628; 18.6214; 90; 101.456; 90;  

COD ID: 4101378
CIF file Formula: - C17 H18 Br N O2 -
Comments: Akiyama, Takahiko; Morita, Hisashi; Fuchibe, Kohei Chiral Brønsted acid-catalyzed inverse electron-demand aza Diels-Alder reaction. Journal of the American Chemical Society 128(40) (2006) 13070-13071
Space group: P 21 21 21
Cell volume: 1585.19
Cell parameters: 8.268; 9.505; 20.171; 90; 90; 90;  

COD ID: 4101379
CIF file Formula: - C17 H16 Br N O2 -
Comments: Akiyama, Takahiko; Morita, Hisashi; Fuchibe, Kohei Chiral Brønsted acid-catalyzed inverse electron-demand aza Diels-Alder reaction. Journal of the American Chemical Society 128(40) (2006) 13070-13071
Space group: P 21 21 21
Cell volume: 1474
Cell parameters: 8.208; 9.538; 18.83; 90; 90; 90;  

COD ID: 4101380
CIF file Formula: - C32 H63 Cl2 N O Os P2 -
Comments: Esteruelas, Miguel A; Fernandez-Alvarez, Francisco J; Oñate, Enrique Stabilization of NH tautomers of quinolines by osmium and ruthenium. Journal of the American Chemical Society 128(40) (2006) 13044-13045
Space group: P n m a
Cell volume: 3845.4
Cell parameters: 20.858; 21.39; 8.6191; 90; 90; 90;  

COD ID: 4101381
CIF file Formula: - C28 H51 Cl2 N P2 Ru -
Comments: Esteruelas, Miguel A; Fernandez-Alvarez, Francisco J; Oñate, Enrique Stabilization of NH tautomers of quinolines by osmium and ruthenium. Journal of the American Chemical Society 128(40) (2006) 13044-13045
Space group: P 1 21/c 1
Cell volume: 3151.9
Cell parameters: 12.2063; 12.9403; 20.1081; 90; 97.084; 90;  

COD ID: 4101382
CIF file Formula: - C31 H35 Ir N2 O2 S -
Comments: Heiden, Zachariah M; Rauchfuss, Thomas B Proton-induced lewis acidity of unsaturated iridium amides. Journal of the American Chemical Society 128(40) (2006) 13048-13049
Space group: P 1 21/c 1
Cell volume: 2758.3
Cell parameters: 12.1618; 12.818; 18.106; 90; 102.234; 90;  

COD ID: 4101383
CIF file Formula: - C73 H75 B F24 Ir N2 O5.5 S -
Comments: Heiden, Zachariah M; Rauchfuss, Thomas B Proton-induced lewis acidity of unsaturated iridium amides. Journal of the American Chemical Society 128(40) (2006) 13048-13049
Space group: P 1 21/c 1
Cell volume: 8258
Cell parameters: 21.585; 25.611; 15.358; 90; 103.43; 90;  

COD ID: 4101384
CIF file Formula: - C51 H45 Cl2 N2 O3 Ru -
Comments: Samec, Joseph S M; Ell, Alida H; Aberg, Jenny B; Privalov, Timofei; Eriksson, Lars; Bäckvall, Jan-E Mechanistic study of hydrogen transfer to imines from a hydroxycyclopentadienyl ruthenium hydride. Experimental support for a mechanism involving coordination of imine to ruthenium prior to hydrogen transfer. Journal of the American Chemical Society 128(44) (2006) 14293-14305
Space group: P -1
Cell volume: 2194.7
Cell parameters: 9.723; 10.737; 21.644; 100.49; 90.74; 98.62;  

COD ID: 4101385
CIF file Formula: - C102 H90 Cl4 N4 O6 Ru2 -
Comments: Samec, Joseph S M; Ell, Alida H; Aberg, Jenny B; Privalov, Timofei; Eriksson, Lars; Bäckvall, Jan-E Mechanistic study of hydrogen transfer to imines from a hydroxycyclopentadienyl ruthenium hydride. Experimental support for a mechanism involving coordination of imine to ruthenium prior to hydrogen transfer. Journal of the American Chemical Society 128(44) (2006) 14293-14305
Space group: P 1 21/a 1
Cell volume: 9098.9
Cell parameters: 23.9275; 14.7281; 25.8285; 90.033; 91.522; 90.048;  

COD ID: 4101386
CIF file Formula: - C37 H34 N3 O3 P -
Comments: Liu, Yan; Sandoval, Christian A; Yamaguchi, Yoshiki; Zhang, Xue; Wang, Zheng; Kato, Koichi; Ding, Kuiling Hydrogen bonding makes a difference in the rhodium-catalyzed enantioselective hydrogenation using monodentate phosphoramidites. Journal of the American Chemical Society 128(44) (2006) 14212-14213
Space group: P 21 21 21
Cell volume: 6510.1
Cell parameters: 11.8569; 19.6421; 27.9528; 90; 90; 90;  

COD ID: 4101387
CIF file Formula: - C20 H39.5 Co K N5.5 O4 -
Comments: Lucas, Robie L; Zart, Matthew K; Mukherjee, Jhumpa; Murkerjee, Jhumpa; Sorrell, Thomas N; Powell, Douglas R; Borovik, A S A modular approach toward regulating the secondary coordination sphere of metal ions: differential dioxygen activation assisted by intramolecular hydrogen bonds. Journal of the American Chemical Society 128(48) (2006) 15476-15489
Space group: P -1
Cell volume: 5389
Cell parameters: 10.918; 16.9; 29.431; 88.622; 83.727; 86.822;  

COD ID: 4101388
CIF file Formula: - C23 H47 Co K N6 O4 -
Comments: Lucas, Robie L; Zart, Matthew K; Mukherjee, Jhumpa; Murkerjee, Jhumpa; Sorrell, Thomas N; Powell, Douglas R; Borovik, A S A modular approach toward regulating the secondary coordination sphere of metal ions: differential dioxygen activation assisted by intramolecular hydrogen bonds. Journal of the American Chemical Society 128(48) (2006) 15476-15489
Space group: P n a 21
Cell volume: 5821.3
Cell parameters: 21.116; 10.467; 26.338; 90; 90; 90;  

COD ID: 4101389
CIF file Formula: - C18 H34 Co K N5 O4 -
Comments: Lucas, Robie L; Zart, Matthew K; Mukherjee, Jhumpa; Murkerjee, Jhumpa; Sorrell, Thomas N; Powell, Douglas R; Borovik, A S A modular approach toward regulating the secondary coordination sphere of metal ions: differential dioxygen activation assisted by intramolecular hydrogen bonds. Journal of the American Chemical Society 128(48) (2006) 15476-15489
Space group: P -1
Cell volume: 1187.9
Cell parameters: 8.568; 10.355; 14.392; 69.514; 84.273; 84.687;  

COD ID: 4101390
CIF file Formula: - C36 H77 Co N7 O4 -
Comments: Lucas, Robie L; Zart, Matthew K; Mukherjee, Jhumpa; Murkerjee, Jhumpa; Sorrell, Thomas N; Powell, Douglas R; Borovik, A S A modular approach toward regulating the secondary coordination sphere of metal ions: differential dioxygen activation assisted by intramolecular hydrogen bonds. Journal of the American Chemical Society 128(48) (2006) 15476-15489
Space group: P 1 21/n 1
Cell volume: 4028
Cell parameters: 11.738; 31.298; 12.271; 90; 116.696; 90;  

COD ID: 4101391
CIF file Formula: - C70 H144 Cl12 N4 Ni O12 Re3 -
Comments: Martínez-Lillo, José; Armentano, Donatella; De Munno, Giovanni; Wernsdorfer, Wolfgang; Julve, Miguel; Lloret, Francesc; Faus, Juan A Heterotetranuclear [NiIIReIV3] single-molecule magnet. Journal of the American Chemical Society 128(44) (2006) 14218-14219
Space group: P -1
Cell volume: 5051.1
Cell parameters: 10.2288; 16.9751; 30.7998; 76.139; 80.669; 78.504;  

COD ID: 4101392
CIF file Formula: - C20 H22 N2 -
Comments: Pastine, Stefan J; Gribkov, Denis V; Sames, Dalibor sp3 C-H bond arylation directed by amidine protecting group: alpha-arylation of pyrrolidines and piperidines. Journal of the American Chemical Society 128(44) (2006) 14220-14221
Space group: P 1 21/c 1
Cell volume: 1601.93
Cell parameters: 5.8809; 16.6533; 16.5795; 90; 99.4; 90;  

COD ID: 4101393
CIF file Formula: - C17 H31 B F4 Fe N4 S -
Comments: Krishnamurthy, Divya; Kasper, Gary D; Namuswe, Frances; Kerber, William D; Narducci Sarjeant, Amy A; Moënne-Loccoz, Pierre; Goldberg, David P A low-spin alkylperoxo-iron(III) complex with weak Fe-O and O-O bonds: implications for the mechanism of superoxide reductase. Journal of the American Chemical Society 128(44) (2006) 14222-14223
Space group: P 1 21/c 1
Cell volume: 2122.5
Cell parameters: 12.4027; 10.128; 16.9164; 90; 92.727; 90;  

COD ID: 4101394
CIF file Formula: - Br2 Fe2 O10 Te4 -
Comments: Becker, Richard; Johnsson, Mats; Kremer, Reinhard K; Klauss, Hans-Henning; Lemmens, Peter Crystal structure and magnetic properties of FeTe2O5X (X=Cl, Br): a frustrated spin cluster compound with a new Te(IV) coordination polyhedron. Journal of the American Chemical Society 128(48) (2006) 15469-15475
Space group: P 1 21/c 1
Cell volume: 1200.18
Cell parameters: 13.3964; 6.5966; 14.2897; 90; 108.118; 90;  

COD ID: 4101395
CIF file Formula: - Br Cl Fe2 O10 Te4 -
Comments: Becker, Richard; Johnsson, Mats; Kremer, Reinhard K; Klauss, Hans-Henning; Lemmens, Peter Crystal structure and magnetic properties of FeTe2O5X (X=Cl, Br): a frustrated spin cluster compound with a new Te(IV) coordination polyhedron. Journal of the American Chemical Society 128(48) (2006) 15469-15475
Space group: P 1 21/c 1
Cell volume: 1185.15
Cell parameters: 13.2722; 6.5965; 14.2351; 90; 108.02; 90;  

COD ID: 4101396
CIF file Formula: - Cl2 Fe2 O10 Te4 -
Comments: Becker, Richard; Johnsson, Mats; Kremer, Reinhard K; Klauss, Hans-Henning; Lemmens, Peter Crystal structure and magnetic properties of FeTe2O5X (X=Cl, Br): a frustrated spin cluster compound with a new Te(IV) coordination polyhedron. Journal of the American Chemical Society 128(48) (2006) 15469-15475
Space group: P 1 21/c 1
Cell volume: 1161.73
Cell parameters: 13.1526; 6.595; 14.1454; 90; 108.771; 90;  

COD ID: 4101397
CIF file Formula: - C79 H3 Cl2 La S2 -
Comments: Wakahara, Takatsugu; Nikawa, Hidefumi; Kikuchi, Takashi; Nakahodo, Tsukasa; Rahman, G M Aminur; Tsuchiya, Takahiro; Maeda, Yutaka; Akasaka, Takeshi; Yoza, Kenji; Horn, Ernst; Yamamoto, Kazunori; Mizorogi, Naomi; Slanina, Zdenek; Nagase, Shigeru La@C72 having a non-IPR carbon cage. Journal of the American Chemical Society 128(44) (2006) 14228-14229
Space group: P 1 21/c 1
Cell volume: 4059.7
Cell parameters: 13.651; 14.36; 21.424; 90; 104.829; 90;  

COD ID: 4101398
CIF file Formula: - C79 H3 Cl2 La S2 -
Comments: Wakahara, Takatsugu; Nikawa, Hidefumi; Kikuchi, Takashi; Nakahodo, Tsukasa; Rahman, G M Aminur; Tsuchiya, Takahiro; Maeda, Yutaka; Akasaka, Takeshi; Yoza, Kenji; Horn, Ernst; Yamamoto, Kazunori; Mizorogi, Naomi; Slanina, Zdenek; Nagase, Shigeru La@C72 having a non-IPR carbon cage. Journal of the American Chemical Society 128(44) (2006) 14228-14229
Space group: P 1 21/c 1
Cell volume: 3990
Cell parameters: 13.54; 14.31; 21.24; 90; 104.04; 90;  

COD ID: 4101399
CIF file Formula: - C79 H3 Cl2 La S2 -
Comments: Wakahara, Takatsugu; Nikawa, Hidefumi; Kikuchi, Takashi; Nakahodo, Tsukasa; Rahman, G M Aminur; Tsuchiya, Takahiro; Maeda, Yutaka; Akasaka, Takeshi; Yoza, Kenji; Horn, Ernst; Yamamoto, Kazunori; Mizorogi, Naomi; Slanina, Zdenek; Nagase, Shigeru La@C72 having a non-IPR carbon cage. Journal of the American Chemical Society 128(44) (2006) 14228-14229
Space group: P 1 21/c 1
Cell volume: 4017.2
Cell parameters: 13.603; 14.2882; 21.3771; 90; 104.791; 90;  

COD ID: 4101400
CIF file Formula: - C79 H3 Cl2 La S2 -
Comments: Wakahara, Takatsugu; Nikawa, Hidefumi; Kikuchi, Takashi; Nakahodo, Tsukasa; Rahman, G M Aminur; Tsuchiya, Takahiro; Maeda, Yutaka; Akasaka, Takeshi; Yoza, Kenji; Horn, Ernst; Yamamoto, Kazunori; Mizorogi, Naomi; Slanina, Zdenek; Nagase, Shigeru La@C72 having a non-IPR carbon cage. Journal of the American Chemical Society 128(44) (2006) 14228-14229
Space group: P 1 21/c 1
Cell volume: 4021.5
Cell parameters: 13.6044; 14.3066; 21.3763; 90; 104.851; 90;  

COD ID: 4101401
CIF file Formula: - C79 H3 Cl2 La S2 -
Comments: Wakahara, Takatsugu; Nikawa, Hidefumi; Kikuchi, Takashi; Nakahodo, Tsukasa; Rahman, G M Aminur; Tsuchiya, Takahiro; Maeda, Yutaka; Akasaka, Takeshi; Yoza, Kenji; Horn, Ernst; Yamamoto, Kazunori; Mizorogi, Naomi; Slanina, Zdenek; Nagase, Shigeru La@C72 having a non-IPR carbon cage. Journal of the American Chemical Society 128(44) (2006) 14228-14229
Space group: P 1 21/c 1
Cell volume: 3982
Cell parameters: 13.5538; 14.2455; 21.335; 90; 104.836; 90;  

COD ID: 4101402
CIF file Formula: - Pb3.82 Sb0.12 Te4 -
Comments: Poudeu, Pierre F P; D'Angelo, Jonathan; Kong, Huijun; Downey, Adam; Short, Jarrod L; Pcionek, Robert; Hogan, Timothy P; Uher, Ctirad; Kanatzidis, Mercouri G Nanostructures versus solid solutions: low lattice thermal conductivity and enhanced thermoelectric figure of merit in Pb9.6Sb0.2Te10-xSex bulk materials. Journal of the American Chemical Society 128(44) (2006) 14347-14355
Space group: P m -3 m
Cell volume: 267.09
Cell parameters: 6.44; 6.44; 6.44; 90; 90; 90;  

COD ID: 4101403
CIF file Formula: - C34 H34 B2 Cu2 F8 N4 O4 -
Comments: Lim, Mi Hee; Wong, Brian A; Pitcock, Jr, William H; Mokshagundam, Deepa; Baik, Mu-Hyun; Lippard, Stephen J Direct nitric oxide detection in aqueous solution by copper(II) fluorescein complexes. Journal of the American Chemical Society 128(44) (2006) 14364-14373
Space group: P 1 21/n 1
Cell volume: 7098.2
Cell parameters: 18.9017; 11.5733; 33.382; 90; 103.584; 90;  

COD ID: 4101404
CIF file Formula: - C34 H32 B2 Cu F8 N4 O4 -
Comments: Lim, Mi Hee; Wong, Brian A; Pitcock, Jr, William H; Mokshagundam, Deepa; Baik, Mu-Hyun; Lippard, Stephen J Direct nitric oxide detection in aqueous solution by copper(II) fluorescein complexes. Journal of the American Chemical Society 128(44) (2006) 14364-14373
Space group: P 1 21/n 1
Cell volume: 1730.9
Cell parameters: 8.1902; 11.6112; 18.2776; 90; 95.235; 90;  

COD ID: 4101405
CIF file Formula: - C26 H20 F5 N O8 -
Comments: Gorske, Benjamin C; Blackwell, Helen E Tuning peptoid secondary structure with pentafluoroaromatic functionality: a new design paradigm for the construction of discretely folded peptoid structures. Journal of the American Chemical Society 128(44) (2006) 14378-14387
Space group: P 21 21 21
Cell volume: 5238.9
Cell parameters: 7.8885; 23.735; 27.98; 90; 90; 90;  

COD ID: 4101406
CIF file Formula: - C24 H49 Cl P2 Ru -
Comments: Kuznetsov, Vladimir F; Abdur-Rashid, Kamaluddin; Lough, Alan J; Gusev, Dmitry G Carbene vs olefin products of C-H activation on ruthenium via competing alpha- and beta-H elimination. Journal of the American Chemical Society 128(44) (2006) 14388-14396
Space group: P 1 21/c 1
Cell volume: 2710.06
Cell parameters: 11.489; 15.318; 15.526; 90; 97.331; 90;  

COD ID: 4101407
CIF file Formula: - C24 H51 Cl P2 Ru -
Comments: Kuznetsov, Vladimir F; Abdur-Rashid, Kamaluddin; Lough, Alan J; Gusev, Dmitry G Carbene vs olefin products of C-H activation on ruthenium via competing alpha- and beta-H elimination. Journal of the American Chemical Society 128(44) (2006) 14388-14396
Space group: P 1 21/c 1
Cell volume: 2745.7
Cell parameters: 11.516; 15.5247; 15.4937; 90; 97.595; 90;  

COD ID: 4101408
CIF file Formula: - C19 H43 Cl N2 P2 Ru -
Comments: Kuznetsov, Vladimir F; Abdur-Rashid, Kamaluddin; Lough, Alan J; Gusev, Dmitry G Carbene vs olefin products of C-H activation on ruthenium via competing alpha- and beta-H elimination. Journal of the American Chemical Society 128(44) (2006) 14388-14396
Space group: P -1
Cell volume: 2457.05
Cell parameters: 12.8009; 13.543; 15.061; 98.874; 107.448; 90.431;  

COD ID: 4101409
CIF file Formula: - C13 Ge12.5 N5 O30 -
Comments: Christensen, Kirsten E; Shi, Lei; Conradsson, Tony; Ren, Tie-zhen; Dadachov, Mike S; Zou, Xiaodong Design of open-framework germanates by combining different building units. Journal of the American Chemical Society 128(44) (2006) 14238-14239
Space group: P 1 21/c 1
Cell volume: 4343
Cell parameters: 12.075; 19.235; 18.72; 90; 92.72; 90;  

COD ID: 4101410
CIF file Formula: - C38.4 Ge53.9 N13.3 O142.6 -
Comments: Christensen, Kirsten E; Shi, Lei; Conradsson, Tony; Ren, Tie-zhen; Dadachov, Mike S; Zou, Xiaodong Design of open-framework germanates by combining different building units. Journal of the American Chemical Society 128(44) (2006) 14238-14239
Space group: P -1
Cell volume: 5376.4
Cell parameters: 11.9831; 20.1886; 22.2361; 88.24; 89.308; 90.352;  

COD ID: 4101411
CIF file Formula: - C18 H16 Br N O3 -
Comments: Dong, Zhenzhen; Karpowicz, Jr, Richard J; Bai, Shi; Yap, Glenn P A; Fox, Joseph M Control of absolute helicity in single-stranded abiotic metallofoldamers. Journal of the American Chemical Society 128(44) (2006) 14242-14243
Space group: P 21 21 2
Cell volume: 1629.9
Cell parameters: 10.556; 23.464; 6.581; 90; 90; 90;  

COD ID: 4101412
CIF file Formula: - C78 H90 N6 Ni O8 -
Comments: Dong, Zhenzhen; Karpowicz, Jr, Richard J; Bai, Shi; Yap, Glenn P A; Fox, Joseph M Control of absolute helicity in single-stranded abiotic metallofoldamers. Journal of the American Chemical Society 128(44) (2006) 14242-14243
Space group: P 43 21 2
Cell volume: 6975
Cell parameters: 14.646; 14.646; 32.517; 90; 90; 90;  

COD ID: 4101413
CIF file Formula: - C80 H90 N6 Ni O12 -
Comments: Dong, Zhenzhen; Karpowicz, Jr, Richard J; Bai, Shi; Yap, Glenn P A; Fox, Joseph M Control of absolute helicity in single-stranded abiotic metallofoldamers. Journal of the American Chemical Society 128(44) (2006) 14242-14243
Space group: P 43 21 2
Cell volume: 6983
Cell parameters: 14.755; 14.755; 32.076; 90; 90; 90;  

COD ID: 4101414
CIF file Formula: ?
Comments: Jiang, Chunjie; Lesbani, Aldes; Kawamoto, Ryosuke; Uchida, Sayaka; Mizuno, Noritaka Channel-selective independent sorption and collection of hydrophilic and hydrophobic molecules by Cs2[Cr3O(OOCC2H5)6(H2O)3]2[alpha-SiW12O40] ionic crystal. Journal of the American Chemical Society 128(44) (2006) 14240-14241
Space group: C 1 2/c 1
Cell volume: 9667.35
Cell parameters: 15.8737; 19.9906; 30.4654; 90; 90.2212; 90;  

COD ID: 4101415
CIF file Formula: - C45 H28 Cl4 F4 N4 O5 S2 -
Comments: Nolan, Elizabeth M; Ryu, Jubin W; Jaworski, Jacek; Feazell, Rodney P; Sheng, Morgan; Lippard, Stephen J Zinspy sensors with enhanced dynamic range for imaging neuronal cell zinc uptake and mobilization. Journal of the American Chemical Society 128(48) (2006) 15517-15528
Space group: P -1
Cell volume: 2176.8
Cell parameters: 13.0106; 13.7993; 14.1006; 73.977; 78.881; 63.853;  

COD ID: 4101416
CIF file Formula: - C81 H68 Cl2 F12 N8 O17 S8 Zn4 -
Comments: Nolan, Elizabeth M; Ryu, Jubin W; Jaworski, Jacek; Feazell, Rodney P; Sheng, Morgan; Lippard, Stephen J Zinspy sensors with enhanced dynamic range for imaging neuronal cell zinc uptake and mobilization. Journal of the American Chemical Society 128(48) (2006) 15517-15528
Space group: P -1
Cell volume: 2306.1
Cell parameters: 10.8605; 13.0832; 17.4505; 79.564; 72.575; 79.716;  

COD ID: 4101417
CIF file Formula: - C38 H42 B2 Cu2 F8.19 N4 O4 S2 -
Comments: Nolan, Elizabeth M; Ryu, Jubin W; Jaworski, Jacek; Feazell, Rodney P; Sheng, Morgan; Lippard, Stephen J Zinspy sensors with enhanced dynamic range for imaging neuronal cell zinc uptake and mobilization. Journal of the American Chemical Society 128(48) (2006) 15517-15528
Space group: P 1 21/n 1
Cell volume: 2035.4
Cell parameters: 10.1101; 15.761; 13.0036; 90; 100.8; 90;  

COD ID: 4101418
CIF file Formula: - C40 H60 Lu2 -
Comments: Evans, William J; Champagne, Timothy M; Ziller, Joseph W Organolutetium vinyl and tuck-over complexes via C-H bond activation. Journal of the American Chemical Society 128(44) (2006) 14270-14271
Space group: P -1
Cell volume: 1792.9
Cell parameters: 10.4914; 12.8272; 13.8975; 76.451; 80.45; 87.137;  

COD ID: 4101419
CIF file Formula: - C30 H43 Lu -
Comments: Evans, William J; Champagne, Timothy M; Ziller, Joseph W Organolutetium vinyl and tuck-over complexes via C-H bond activation. Journal of the American Chemical Society 128(44) (2006) 14270-14271
Space group: P -1
Cell volume: 1315.2
Cell parameters: 8.606; 9.714; 16.544; 83.991; 89.722; 73.047;  

COD ID: 4101420
CIF file Formula: - C33 H39 B F3 N O3 S -
Comments: Chiu, Ching-Wen; Gabbaï, François P Fluoride ion capture from water with a cationic borane. Journal of the American Chemical Society 128(44) (2006) 14248-14249
Space group: P -1
Cell volume: 3110.2
Cell parameters: 14.135; 15.099; 16.702; 65.97; 72.914; 81.375;  

COD ID: 4101421
CIF file Formula: - C32 H39 B F N -
Comments: Chiu, Ching-Wen; Gabbaï, François P Fluoride ion capture from water with a cationic borane. Journal of the American Chemical Society 128(44) (2006) 14248-14249
Space group: P 21 21 21
Cell volume: 2617
Cell parameters: 8.4633; 17.444; 17.727; 90; 90; 90;  

COD ID: 4101422
CIF file Formula: - C31 H56 Ir N P2 -
Comments: Ben-Ari, Eyal; Leitus, Gregory; Shimon, Linda J W; Milstein, David Metal-ligand cooperation in C-H and H2 activation by an electron-rich PNP Ir(I) system: facile ligand dearomatization-aromatization as key steps. Journal of the American Chemical Society 128(48) (2006) 15390-15391
Space group: P 1 21/c 1
Cell volume: 3393.2
Cell parameters: 16.908; 10.789; 18.933; 90; 100.75; 90;  

COD ID: 4101423
CIF file Formula: - C29 H48 Ir N P2 -
Comments: Ben-Ari, Eyal; Leitus, Gregory; Shimon, Linda J W; Milstein, David Metal-ligand cooperation in C-H and H2 activation by an electron-rich PNP Ir(I) system: facile ligand dearomatization-aromatization as key steps. Journal of the American Chemical Society 128(48) (2006) 15390-15391
Space group: P 1 21/c 1
Cell volume: 2876.8
Cell parameters: 10.725; 13.444; 20.495; 90; 103.22; 90;  

COD ID: 4101424
CIF file Formula: - C29 H50 Ir N P2 -
Comments: Ben-Ari, Eyal; Leitus, Gregory; Shimon, Linda J W; Milstein, David Metal-ligand cooperation in C-H and H2 activation by an electron-rich PNP Ir(I) system: facile ligand dearomatization-aromatization as key steps. Journal of the American Chemical Society 128(48) (2006) 15390-15391
Space group: P 1 21/c 1
Cell volume: 2884
Cell parameters: 10.782; 13.335; 20.62; 90; 103.4; 90;  

COD ID: 4101425
CIF file Formula: - C62.65 H47.3 Au2 Cl5.3 F6 N2 O4 P2 -
Comments: Wheaton, Craig A; Eisler, Dana J; Jennings, Michael C; Puddephatt, Richard J Self-assembly of coordination polymers: evidence for dynamic exchange between oligomers in solution and the isolation of a homochiral decagold(I) oligomer. Journal of the American Chemical Society 128(48) (2006) 15370-15371
Space group: P 1 21/c 1
Cell volume: 6225.4
Cell parameters: 16.9939; 18.6105; 20.5133; 90; 106.347; 90;  

COD ID: 4101426
CIF file Formula: - C66 H56 Au2 F6 N2 O7 P2 -
Comments: Wheaton, Craig A; Eisler, Dana J; Jennings, Michael C; Puddephatt, Richard J Self-assembly of coordination polymers: evidence for dynamic exchange between oligomers in solution and the isolation of a homochiral decagold(I) oligomer. Journal of the American Chemical Society 128(48) (2006) 15370-15371
Space group: P 21 21 21
Cell volume: 6683.4
Cell parameters: 14.9319; 16.5595; 27.0293; 90; 90; 90;  

COD ID: 4101427
CIF file Formula: - C319.5 H235 Au10 Cl15 F30 N12 O20 P10 -
Comments: Wheaton, Craig A; Eisler, Dana J; Jennings, Michael C; Puddephatt, Richard J Self-assembly of coordination polymers: evidence for dynamic exchange between oligomers in solution and the isolation of a homochiral decagold(I) oligomer. Journal of the American Chemical Society 128(48) (2006) 15370-15371
Space group: P 32 2 1
Cell volume: 57294
Cell parameters: 36.405; 36.405; 49.917; 90; 90; 120;  

COD ID: 4101428
CIF file Formula: - C15 H18 Br N O3 -
Comments: Mattson, Anita E; Zuhl, Andrea M; Reynolds, Troy E; Scheidt, Karl A Direct nucleophilic acylation of nitroalkenes promoted by a fluoride anion/thiourea combination. Journal of the American Chemical Society 128(15) (2006) 4932-4933
Space group: P 21 21 21
Cell volume: 1466
Cell parameters: 5.8906; 12.736; 19.54; 90; 90; 90;  

COD ID: 4101429
CIF file Formula: - C86 H94 Li2 O10 Sn2 -
Comments: Haga, Ryuta; Saito, Masaichi; Yoshioka, Michikazu Reversible redox behavior between stannole dianion and bistannole-1,2-dianion. Journal of the American Chemical Society 128(15) (2006) 4934-4935
Space group: C 1 2/c 1
Cell volume: 7619.8
Cell parameters: 35.223; 11.1137; 25.776; 90; 130.96; 90;  

COD ID: 4101430
CIF file Formula: - C117 H239 Cl3 Cu2 N8 O103 -
Comments: Fu, Heng; Zhou, Ying-Hua; Chen, Wei-Lin; Deqing, Zhuo-Ga; Tong, Ming-Liang; Ji, Liang-Nian; Mao, Zong-Wan Complexation, structure, and superoxide dismutase activity of the imidazolate-bridged dinuclear copper moiety with beta-cyclodextrin and its guanidinium-containing derivative. Journal of the American Chemical Society 128(15) (2006) 4924-4925
Space group: P 41 2 2
Cell volume: 17324.5
Cell parameters: 18.1536; 18.1536; 52.57; 90; 90; 90;  

COD ID: 4101431
CIF file Formula: - C39 H59 Al N2 Si2 -
Comments: Zhu, Hongping; Oswald, Rainer B; Fan, Hongjun; Roesky, Herbert W; Ma, Qingjun; Yang, Zhi; Schmidt, Hans-Georg; Noltemeyer, Mathias; Starke, Kerstin; Hosmane, Narayan S Aluminacyclopropene: syntheses, characterization, and reactivity toward terminal alkynes. Journal of the American Chemical Society 128(15) (2006) 5100-5108
Space group: P c a 21
Cell volume: 7754
Cell parameters: 40.07; 18.332; 10.556; 90; 90; 90;  

COD ID: 4101432
CIF file Formula: - C45 H53 Al N2 -
Comments: Zhu, Hongping; Oswald, Rainer B; Fan, Hongjun; Roesky, Herbert W; Ma, Qingjun; Yang, Zhi; Schmidt, Hans-Georg; Noltemeyer, Mathias; Starke, Kerstin; Hosmane, Narayan S Aluminacyclopropene: syntheses, characterization, and reactivity toward terminal alkynes. Journal of the American Chemical Society 128(15) (2006) 5100-5108
Space group: P -1
Cell volume: 1904.2
Cell parameters: 11.118; 12.44; 15.279; 73.57; 75.6; 72.74;  

COD ID: 4101433
CIF file Formula: - C45 H53 Al N2 -
Comments: Zhu, Hongping; Oswald, Rainer B; Fan, Hongjun; Roesky, Herbert W; Ma, Qingjun; Yang, Zhi; Schmidt, Hans-Georg; Noltemeyer, Mathias; Starke, Kerstin; Hosmane, Narayan S Aluminacyclopropene: syntheses, characterization, and reactivity toward terminal alkynes. Journal of the American Chemical Society 128(15) (2006) 5100-5108
Space group: P 1 21/n 1
Cell volume: 3779.8
Cell parameters: 15.768; 12.973; 18.678; 90; 98.39; 90;  

COD ID: 4101434
CIF file Formula: - C54 H64 Al N2 -
Comments: Zhu, Hongping; Oswald, Rainer B; Fan, Hongjun; Roesky, Herbert W; Ma, Qingjun; Yang, Zhi; Schmidt, Hans-Georg; Noltemeyer, Mathias; Starke, Kerstin; Hosmane, Narayan S Aluminacyclopropene: syntheses, characterization, and reactivity toward terminal alkynes. Journal of the American Chemical Society 128(15) (2006) 5100-5108
Space group: P 1 21/n 1
Cell volume: 4587.7
Cell parameters: 14.641; 19.674; 16.162; 90; 99.78; 90;  

COD ID: 4101435
CIF file Formula: - C12 H16 Na7 O36 Ru4 -
Comments: Wong, Ella Lai-Ming; Sun, Raymond Wai-Yin; Chung, Nancy P-Y; Lin, Chen-Lung Steve; Zhu, Nianyong; Che, Chi-Ming A mixed-valent ruthenium-oxo oxalato cluster Na7[Ru4(mu3-O)4(C2O4)6] with potent anti-HIV activities. Journal of the American Chemical Society 128(15) (2006) 4938-4939
Space group: C 1 2/c 1
Cell volume: 3419.6
Cell parameters: 16.879; 12.292; 17.093; 90; 105.37; 90;  

COD ID: 4101436
CIF file Formula: - C6 H7 Na3 O15.5 Ru -
Comments: Wong, Ella Lai-Ming; Sun, Raymond Wai-Yin; Chung, Nancy P-Y; Lin, Chen-Lung Steve; Zhu, Nianyong; Che, Chi-Ming A mixed-valent ruthenium-oxo oxalato cluster Na7[Ru4(mu3-O)4(C2O4)6] with potent anti-HIV activities. Journal of the American Chemical Society 128(15) (2006) 4938-4939
Space group: C 1 2/c 1
Cell volume: 3059.1
Cell parameters: 18.78; 14.609; 12.213; 90; 114.08; 90;  

COD ID: 4101437
CIF file Formula: - C20 H25 N O3 -
Comments: Ma, Shengming; Gu, Zhenhua Sequential rearrangement of 1,2,4Z,7-tetraenes involving [1,5]-hydrogen migration and electrocyclization: an efficient synthesis of eight-membered cyclic compounds. Journal of the American Chemical Society 128(15) (2006) 4942-4943
Space group: P b c a
Cell volume: 3437
Cell parameters: 13.6546; 12.7382; 19.7605; 90; 90; 90;  

COD ID: 4101438
CIF file Formula: - C18 H18 O2 -
Comments: Ma, Shengming; Gu, Zhenhua Sequential rearrangement of 1,2,4Z,7-tetraenes involving [1,5]-hydrogen migration and electrocyclization: an efficient synthesis of eight-membered cyclic compounds. Journal of the American Chemical Society 128(15) (2006) 4942-4943
Space group: P 1 21/c 1
Cell volume: 1481.1
Cell parameters: 6.7357; 19.494; 11.5301; 90; 101.969; 90;  

COD ID: 4101439
CIF file Formula: - C32 H22 -
Comments: Vicario, Javier; Walko, Martin; Meetsma, Auke; Feringa, Ben L Fine tuning of the rotary motion by structural modification in light-driven unidirectional molecular motors. Journal of the American Chemical Society 128(15) (2006) 5127-5135
Space group: P c a 21
Cell volume: 4254.7
Cell parameters: 20.526; 8.1237; 25.516; 90; 90; 90;  

COD ID: 4101440
CIF file Formula: - C30 H26 -
Comments: Vicario, Javier; Walko, Martin; Meetsma, Auke; Feringa, Ben L Fine tuning of the rotary motion by structural modification in light-driven unidirectional molecular motors. Journal of the American Chemical Society 128(15) (2006) 5127-5135
Space group: P c a 21
Cell volume: 2155.9
Cell parameters: 23.32; 8.89; 10.399; 90; 90; 90;  

COD ID: 4101441
CIF file Formula: - C18 H21 Br O3 -
Comments: Lee, Ai-Lan; Malcolmson, Steven J; Puglisi, Alessandra; Schrock, Richard R; Hoveyda, Amir H Enantioselective synthesis of cyclic enol ethers and all-carbon quaternary stereogenic centers through catalytic asymmetric ring-closing metathesis. Journal of the American Chemical Society 128(15) (2006) 5153-5157
Space group: C 1 2 1
Cell volume: 1712.6
Cell parameters: 18.56; 5.8676; 15.887; 90; 98.155; 90;  

COD ID: 4101442
CIF file Formula: - C28 H42 Ge O2 -
Comments: Gerung, Henry; Boyle, Timothy J; Tribby, Louis J; Bunge, Scott D; Brinker, C Jeffrey; Han, Sang M Solution synthesis of germanium nanowires using a Ge2+ alkoxide precursor. Journal of the American Chemical Society 128(15) (2006) 5244-5250
Space group: P 1 21/n 1
Cell volume: 2631.3
Cell parameters: 13.62; 13.81; 14.056; 90; 95.534; 90;  

COD ID: 4101443
CIF file Formula: - C43 H78 O6 Si2 -
Comments: Smith, 3rd, Amos B; Mesaros, Eugen F; Meyer, Emmanuel A Evolution of a total synthesis of (-)-kendomycin exploiting a Petasis-Ferrier rearrangement/ring-closing olefin metathesis strategy. Journal of the American Chemical Society 128(15) (2006) 5292-5299
Space group: P 21 21 21
Cell volume: 4650.8
Cell parameters: 12.6576; 14.0938; 26.0706; 90; 90; 90;  

COD ID: 4101444
CIF file Formula: - C36 H58 O6 Si -
Comments: Smith, 3rd, Amos B; Mesaros, Eugen F; Meyer, Emmanuel A Evolution of a total synthesis of (-)-kendomycin exploiting a Petasis-Ferrier rearrangement/ring-closing olefin metathesis strategy. Journal of the American Chemical Society 128(15) (2006) 5292-5299
Space group: P 21 21 21
Cell volume: 3649
Cell parameters: 8.1245; 18.086; 24.834; 90; 90; 90;  

COD ID: 4101445
CIF file Formula: - C54 H96 B2 Cl2 Fe2 N4 P2 -
Comments: Thomas, Christine M; Mankad, Neal P; Peters, Jonas C Characterization of the terminal iron(IV) imides [[PhBP(t)(Bu)2(pz')]Fe(IV)NAd]+. Journal of the American Chemical Society 128(15) (2006) 4956-4957
Space group: P -1
Cell volume: 1464.43
Cell parameters: 10.343; 10.5536; 14.0707; 87.428; 83.364; 73.736;  

COD ID: 4101446
CIF file Formula: - C37 H63 B Fe N3 P2 -
Comments: Thomas, Christine M; Mankad, Neal P; Peters, Jonas C Characterization of the terminal iron(IV) imides [[PhBP(t)(Bu)2(pz')]Fe(IV)NAd]+. Journal of the American Chemical Society 128(15) (2006) 4956-4957
Space group: P 1 21/c 1
Cell volume: 7379.1
Cell parameters: 10.8828; 20.2565; 33.573; 90; 94.412; 90;  

COD ID: 4101447
CIF file Formula: - C42.75 H36.75 B0.75 Fe0.75 N2.25 P1.5 -
Comments: Thomas, Christine M; Mankad, Neal P; Peters, Jonas C Characterization of the terminal iron(IV) imides [[PhBP(t)(Bu)2(pz')]Fe(IV)NAd]+. Journal of the American Chemical Society 128(15) (2006) 4956-4957
Space group: P 1 21/c 1
Cell volume: 7379.1
Cell parameters: 10.8828; 20.2565; 33.573; 90; 94.412; 90;  

COD ID: 4101448
CIF file Formula: - C39 H65 B Fe N3 P2 -
Comments: Thomas, Christine M; Mankad, Neal P; Peters, Jonas C Characterization of the terminal iron(IV) imides [[PhBP(t)(Bu)2(pz')]Fe(IV)NAd]+. Journal of the American Chemical Society 128(15) (2006) 4956-4957
Space group: P -1
Cell volume: 3845
Cell parameters: 10.886; 17.39; 21.104; 83.777; 75.874; 85.19;  

COD ID: 4101449
CIF file Formula: - C81 H121 B F24 Fe N3 O3 P2 -
Comments: Thomas, Christine M; Mankad, Neal P; Peters, Jonas C Characterization of the terminal iron(IV) imides [[PhBP(t)(Bu)2(pz')]Fe(IV)NAd]+. Journal of the American Chemical Society 128(15) (2006) 4956-4957
Space group: P 1 21 1
Cell volume: 4224.7
Cell parameters: 12.2246; 27.556; 12.862; 90; 102.822; 90;  

COD ID: 4101450
CIF file Formula: - C79 H93 B2 F24 Fe N3 O2 P2 -
Comments: Thomas, Christine M; Mankad, Neal P; Peters, Jonas C Characterization of the terminal iron(IV) imides [[PhBP(t)(Bu)2(pz')]Fe(IV)NAd]+. Journal of the American Chemical Society 128(15) (2006) 4956-4957
Space group: P 1 21/c 1
Cell volume: 8104
Cell parameters: 19.438; 18.86; 22.418; 90; 99.66; 90;  

COD ID: 4101451
CIF file Formula: - C11 H21 B11 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P c a 21
Cell volume: 6529.3
Cell parameters: 17.1638; 12.4968; 30.4408; 90; 90; 90;  

COD ID: 4101452
CIF file Formula: - C10 H19 B11 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P c a 21
Cell volume: 3088.5
Cell parameters: 29.9835; 6.9576; 14.8049; 90; 90; 90;  

COD ID: 4101453
CIF file Formula: - C11 H29 B11 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P n m a
Cell volume: 1830
Cell parameters: 13.549; 10.789; 12.519; 90; 90; 90;  

COD ID: 4101454
CIF file Formula: - C5 H11 B11 Br6 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P b c a
Cell volume: 3797.3
Cell parameters: 12.4353; 17.434; 17.516; 90; 90; 90;  

COD ID: 4101455
CIF file Formula: - C42 H106 B22 Li4 O12 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P c a 21
Cell volume: 6713.4
Cell parameters: 26.847; 11.2688; 22.1902; 90; 90; 90;  

COD ID: 4101456
CIF file Formula: - C27 H53 B11 Na2 O4 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P 1 21/n 1
Cell volume: 3641
Cell parameters: 15.322; 11.64; 20.559; 90; 96.728; 90;  

COD ID: 4101457
CIF file Formula: - C26 H51 B11 Na2 O4 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P b c a
Cell volume: 6956.7
Cell parameters: 11.7337; 24.0688; 24.6327; 90; 90; 90;  

COD ID: 4101458
CIF file Formula: - C28 H53 B11 Na2 O5 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P 1 21/n 1
Cell volume: 3799.1
Cell parameters: 10.6621; 28.285; 12.8219; 90; 100.73; 90;  

COD ID: 4101459
CIF file Formula: - C25 H57 B11 Ca O5 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P 1 21/c 1
Cell volume: 3457.9
Cell parameters: 9.8243; 19.2794; 18.2812; 90; 92.967; 90;  

COD ID: 4101460
CIF file Formula: - C43 H65 B11 Ni O3 P2 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P -1
Cell volume: 2380.1
Cell parameters: 11.0023; 11.6631; 20.3879; 81.851; 77.994; 68.843;  

COD ID: 4101461
CIF file Formula: - C43 H63 B11 Ni O3 P2 -
Comments: Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei Synthesis, structure, and reactivity of 13-vertex carboranes and 14-vertex metallacarboranes. Journal of the American Chemical Society 128(15) (2006) 5219-5230
Space group: P -1
Cell volume: 2389.9
Cell parameters: 10.9613; 11.7026; 20.509; 82.866; 80.038; 67.554;  

COD ID: 4101462
CIF file Formula: - C53 H48 O4 -
Comments: Menger, Fredric M; Sorrells, Jennifer L A non-steroidal facial amphiphile. Journal of the American Chemical Society 128(15) (2006) 4960-4961
Space group: C 1 2/c 1
Cell volume: 9370
Cell parameters: 33.299; 8.7863; 35.011; 90; 113.836; 90;  

COD ID: 4101463
CIF file Formula: - C42 H84 Cl2 P2 Pd -
Comments: Nawara, Agnieszka J; Shima, Takanori; Hampel, Frank; Gladysz, J A Gyroscope-like molecules consisting of PdX2/PtX2 rotators encased in three-spoke stators: synthesis via alkene metathesis, and facile substitution and demetalation. Journal of the American Chemical Society 128(15) (2006) 4962-4963
Space group: P 1 21/n 1
Cell volume: 4510.31
Cell parameters: 16.2233; 13.7836; 20.1744; 90; 91.207; 90;  

COD ID: 4101464
CIF file Formula: - C59 H106 P2 Pt -
Comments: Nawara, Agnieszka J; Shima, Takanori; Hampel, Frank; Gladysz, J A Gyroscope-like molecules consisting of PdX2/PtX2 rotators encased in three-spoke stators: synthesis via alkene metathesis, and facile substitution and demetalation. Journal of the American Chemical Society 128(15) (2006) 4962-4963
Space group: P -1
Cell volume: 2930.44
Cell parameters: 11.9863; 16.467; 16.9113; 67.387; 72.547; 79.382;  

COD ID: 4101465
CIF file Formula: - C33 H36 Br F3 O7 -
Comments: Kurdyumov, Aleksey V; Hsung, Richard P An unusual cationic [2 + 2] cycloaddition in a divergent total synthesis of hongoquercin A and rhododaurichromanic acid A. Journal of the American Chemical Society 128(19) (2006) 6272-6273
Space group: P -1
Cell volume: 1626.1
Cell parameters: 11.2376; 11.682; 13.9798; 106.609; 107.792; 97.506;  

COD ID: 4101466
CIF file Formula: - C44 H58 Cl8 P2 Pd2 -
Comments: Christmann, Ute; Pantazis, Dimitrios A; Benet-Buchholz, Jordi; McGrady, John E; Maseras, Feliu; Vilar, Ramón Experimental and theoretical investigations of new dinuclear palladium complexes as precatalysts for the amination of aryl chlorides. Journal of the American Chemical Society 128(19) (2006) 6376-6390
Space group: P -1
Cell volume: 1212.6
Cell parameters: 9.3825; 11.4433; 11.5409; 98.579; 96.178; 94.445;  

COD ID: 4101467
CIF file Formula: - C22 H32 Cl2 N P Pd2 -
Comments: Christmann, Ute; Pantazis, Dimitrios A; Benet-Buchholz, Jordi; McGrady, John E; Maseras, Feliu; Vilar, Ramón Experimental and theoretical investigations of new dinuclear palladium complexes as precatalysts for the amination of aryl chlorides. Journal of the American Chemical Society 128(19) (2006) 6376-6390
Space group: C 1 c 1
Cell volume: 2302.9
Cell parameters: 18.9087; 11.3204; 11.4261; 90; 109.683; 90;  

COD ID: 4101468
CIF file Formula: - C22 H31 Br2 N P Pd -
Comments: Christmann, Ute; Pantazis, Dimitrios A; Benet-Buchholz, Jordi; McGrady, John E; Maseras, Feliu; Vilar, Ramón Experimental and theoretical investigations of new dinuclear palladium complexes as precatalysts for the amination of aryl chlorides. Journal of the American Chemical Society 128(19) (2006) 6376-6390
Space group: P n m a
Cell volume: 2248.96
Cell parameters: 18.8461; 12.1995; 9.7818; 90; 90; 90;  

COD ID: 4101469
CIF file Formula: - C35 H36 N4 O6 -
Comments: Tamaoki, Nobuyuki; Wada, Momoyo Dynamic control of racemization rate through E-Z photoisomerization of azobenzene and subsequent partial photoresolution under circular polarized light. Journal of the American Chemical Society 128(19) (2006) 6284-6285
Space group: P -1
Cell volume: 1579.8
Cell parameters: 8.2553; 12.2943; 16.4607; 102.663; 103.627; 91.036;  

COD ID: 4101470
CIF file Formula: - C39 H44 N4 O8 -
Comments: Tamaoki, Nobuyuki; Wada, Momoyo Dynamic control of racemization rate through E-Z photoisomerization of azobenzene and subsequent partial photoresolution under circular polarized light. Journal of the American Chemical Society 128(19) (2006) 6284-6285
Space group: P 1 21/n 1
Cell volume: 3577.4
Cell parameters: 10.1518; 16.2374; 21.7024; 90; 90.229; 90;  

COD ID: 4101471
CIF file Formula: - C35 H36 N4 O6 -
Comments: Tamaoki, Nobuyuki; Wada, Momoyo Dynamic control of racemization rate through E-Z photoisomerization of azobenzene and subsequent partial photoresolution under circular polarized light. Journal of the American Chemical Society 128(19) (2006) 6284-6285
Space group: P -1
Cell volume: 1487.2
Cell parameters: 11.7081; 11.9876; 11.9931; 67.339; 76.286; 75.921;  

COD ID: 4101472
CIF file Formula: - C43 H52 N4 O9 -
Comments: Tamaoki, Nobuyuki; Wada, Momoyo Dynamic control of racemization rate through E-Z photoisomerization of azobenzene and subsequent partial photoresolution under circular polarized light. Journal of the American Chemical Society 128(19) (2006) 6284-6285
Space group: P 1 21/c 1
Cell volume: 3961.1
Cell parameters: 10.3665; 32.825; 11.868; 90; 101.224; 90;  

COD ID: 4101473
CIF file Formula: - C17 H23 N O2 S -
Comments: Wender, Paul A; Haustedt, Lars O; Lim, Jaehong; Love, Jennifer A; Williams, Travis J; Yoon, Joo-Yong Asymmetric catalysis of the [5 + 2] cycloaddition reaction of vinylcyclopropanes and pi-systems. Journal of the American Chemical Society 128(19) (2006) 6302-6303
Space group: P -1
Cell volume: 1613.2
Cell parameters: 6.5195; 14.0366; 19.108; 107.401; 99.129; 98.266;  

COD ID: 4101474
CIF file Formula: - C107.75 H23.5 N2 S4.5 Sc3 -
Comments: Cai, Ting; Slebodnick, Carla; Xu, Liaosa; Harich, Kim; Glass, Thomas E; Chancellor, Christopher; Fettinger, James C; Olmstead, Marilyn M; Balch, Alan L; Gibson, Harry W; Dorn, Harry C A pirouette on a metallofullerene sphere: interconversion of isomers of N-tritylpyrrolidino I(h) Sc3N@C80. Journal of the American Chemical Society 128(19) (2006) 6486-6492
Space group: P -1
Cell volume: 3080
Cell parameters: 11.0127; 16.387; 18.7355; 99.521; 106.034; 102.488;  

COD ID: 4101475
CIF file Formula: - C115.65 H36.1 N2 Sc3 -
Comments: Cai, Ting; Slebodnick, Carla; Xu, Liaosa; Harich, Kim; Glass, Thomas E; Chancellor, Christopher; Fettinger, James C; Olmstead, Marilyn M; Balch, Alan L; Gibson, Harry W; Dorn, Harry C A pirouette on a metallofullerene sphere: interconversion of isomers of N-tritylpyrrolidino I(h) Sc3N@C80. Journal of the American Chemical Society 128(19) (2006) 6486-6492
Space group: P -1
Cell volume: 3177.2
Cell parameters: 11.0242; 16.5046; 18.8995; 74.045; 77.655; 76.84;  

COD ID: 4101476
CIF file Formula: - C12 H28 I3 N4 Pt -
Comments: Takaishi, Shinya; Kawakami, Daisuke; Yamashita, Masahiro; Sasaki, Mari; Kajiwara, Takashi; Miyasaka, Hitoshi; Sugiura, Ken-Ichi; Wakabayashi, Yusuke; Sawa, Hiroshi; Matsuzaki, Hiroyuki; Kishida, Hideo; Okamoto, Hiroshi; Watanabe, Harutaka; Tanaka, Hisaaki; Marumoto, Kazuhiro; Ito, Hiroshi; Kuroda, Shin-Ichi Dynamical valence fluctuation at the charge-density-wave phase boundary in iodide-bridged Pt compound [Pt(chxn)2I]I2. Journal of the American Chemical Society 128(19) (2006) 6420-6425
Space group: I 2 2 2
Cell volume: 969
Cell parameters: 23.443; 5.6718; 7.288; 90; 90; 90;  

COD ID: 4101477
CIF file Formula: - C30 H56 Si4 Zr -
Comments: Bradley, Christopher A; Lobkovsky, Emil; Keresztes, Ivan; Chirik, Paul J Synthesis of bis(indenyl)zirconium dihydrides and subsequent rearrangement to eta5,eta3-4,5-dihydroindenediyl ligands: evidence for intermediates during the hydrogenation to tetrahydroindenyl derivatives. Journal of the American Chemical Society 128(19) (2006) 6454-6467
Space group: P -1
Cell volume: 1745.27
Cell parameters: 10.2537; 12.326; 14.6483; 84.445; 81.887; 72.518;  

COD ID: 4101478
CIF file Formula: - C30 H40 Zr -
Comments: Bradley, Christopher A; Lobkovsky, Emil; Keresztes, Ivan; Chirik, Paul J Synthesis of bis(indenyl)zirconium dihydrides and subsequent rearrangement to eta5,eta3-4,5-dihydroindenediyl ligands: evidence for intermediates during the hydrogenation to tetrahydroindenyl derivatives. Journal of the American Chemical Society 128(19) (2006) 6454-6467
Space group: P 1 21/c 1
Cell volume: 2506.8
Cell parameters: 10.9586; 13.292; 17.4629; 90; 99.763; 90;  

COD ID: 4101479
CIF file Formula: - C15 H20 Zr0.5 -
Comments: Bradley, Christopher A; Lobkovsky, Emil; Keresztes, Ivan; Chirik, Paul J Synthesis of bis(indenyl)zirconium dihydrides and subsequent rearrangement to eta5,eta3-4,5-dihydroindenediyl ligands: evidence for intermediates during the hydrogenation to tetrahydroindenyl derivatives. Journal of the American Chemical Society 128(19) (2006) 6454-6467
Space group: C 1 2/c 1
Cell volume: 2633.08
Cell parameters: 16.1719; 9.563; 17.0533; 90; 93.25; 90;  

COD ID: 4101480
CIF file Formula: - C30 H40 Zr -
Comments: Bradley, Christopher A; Lobkovsky, Emil; Keresztes, Ivan; Chirik, Paul J Synthesis of bis(indenyl)zirconium dihydrides and subsequent rearrangement to eta5,eta3-4,5-dihydroindenediyl ligands: evidence for intermediates during the hydrogenation to tetrahydroindenyl derivatives. Journal of the American Chemical Society 128(19) (2006) 6454-6467
Space group: P 1 21/c 1
Cell volume: 2492.1
Cell parameters: 10.8829; 13.5285; 17.1963; 90; 100.158; 90;  

COD ID: 4101481
CIF file Formula: - C15 H22 Cl N Pd -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: P 1 21/c 1
Cell volume: 1517.04
Cell parameters: 8.7756; 13.9797; 12.4209; 90; 95.397; 90;  

COD ID: 4101482
CIF file Formula: - C26 H28 Cl N2 Pd -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: P -1
Cell volume: 1143.6
Cell parameters: 8.1918; 10.394; 14.768; 83.97; 76.233; 69.495;  

COD ID: 4101483
CIF file Formula: - C19 H17 Cl N2 Pd -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: P b c a
Cell volume: 3411.69
Cell parameters: 13.2654; 13.3187; 19.3102; 90; 90; 90;  

COD ID: 4101484
CIF file Formula: - C34 H49 Cl N P Pd -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: P -1
Cell volume: 1701.87
Cell parameters: 10.3658; 12.3444; 14.4307; 91.696; 109.563; 100.612;  

COD ID: 4101485
CIF file Formula: - C54 H79 Cl P2 Pd2 -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: P 1 21/n 1
Cell volume: 4851.6
Cell parameters: 17.481; 16.598; 17.74; 90; 109.518; 90;  

COD ID: 4101486
CIF file Formula: - C45 H37 Cl P2 Pd2 -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: C 1 c 1
Cell volume: 3654.35
Cell parameters: 13.8689; 14.2117; 19.1372; 90; 104.345; 90;  

COD ID: 4101487
CIF file Formula: - C25 H42 Cl2 N P Pd -
Comments: Sui-Seng, Christine; Enright, Gary D; Zargarian, Davit New palladium(II)-(eta(3/5)- or eta1-indenyl) and dipalladium(I)-(mu,eta3-indenyl) complexes. Journal of the American Chemical Society 128(19) (2006) 6508-6519
Space group: P 1 21/c 1
Cell volume: 2634.09
Cell parameters: 17.0179; 9.4258; 18.1497; 90; 115.208; 90;  

COD ID: 4101488
CIF file Formula: - C16 H28 N3 Ni O4 Rh S2 -
Comments: Green, Kayla N; Jeffery, Stephen P; Reibenspies, Joseph H; Darensbourg, Marcetta Y A nickel tripeptide as a metallodithiolate ligand anchor for resin-bound organometallics. Journal of the American Chemical Society 128(19) (2006) 6493-6498
Space group: C 1 2/c 1
Cell volume: 17336
Cell parameters: 27.95; 23.526; 28.457; 90; 112.113; 90;  

COD ID: 4101489
CIF file Formula: - C12 H20 F6 N2 Ni O2 Rh S3 -
Comments: Green, Kayla N; Jeffery, Stephen P; Reibenspies, Joseph H; Darensbourg, Marcetta Y A nickel tripeptide as a metallodithiolate ligand anchor for resin-bound organometallics. Journal of the American Chemical Society 128(19) (2006) 6493-6498
Space group: P 21 21 21
Cell volume: 1943.7
Cell parameters: 9.991; 11.55; 16.844; 90; 90; 90;  

COD ID: 4101490
CIF file Formula: - C39 H68 Lu N3 Si3 -
Comments: Jantunen, Kimberly C; Scott, Brian L; Hay, P Jeffrey; Gordon, John C; Kiplinger, Jaqueline L Dearomatization and functionalization of terpyridine by lutetium(III) alkyl complexes. Journal of the American Chemical Society 128(19) (2006) 6322-6323
Space group: P -1
Cell volume: 2296.4
Cell parameters: 12.1805; 12.6262; 15.275; 90.928; 99.04; 97.883;  

COD ID: 4101491
CIF file Formula: - C45 H72 Lu N3 Si2 -
Comments: Jantunen, Kimberly C; Scott, Brian L; Hay, P Jeffrey; Gordon, John C; Kiplinger, Jaqueline L Dearomatization and functionalization of terpyridine by lutetium(III) alkyl complexes. Journal of the American Chemical Society 128(19) (2006) 6322-6323
Space group: P -1
Cell volume: 2339.4
Cell parameters: 10.7538; 11.8122; 20.525; 98.937; 92.135; 113.937;  

COD ID: 4101492
CIF file Formula: - C12 H16 Br N O3 -
Comments: Yeung, Ying-Yeung; Hong, Sungwoo; Corey, E J A short enantioselective pathway for the synthesis of the anti-influenza neuramidase inhibitor oseltamivir from 1,3-butadiene and acrylic acid. Journal of the American Chemical Society 128(19) (2006) 6310-6311
Space group: P -1
Cell volume: 630.6
Cell parameters: 8.137; 9.213; 9.283; 71.34; 87.737; 73.338;  

COD ID: 4101493
CIF file Formula: - C16 H25 Br Cl2 N2 O5 -
Comments: Yeung, Ying-Yeung; Hong, Sungwoo; Corey, E J A short enantioselective pathway for the synthesis of the anti-influenza neuramidase inhibitor oseltamivir from 1,3-butadiene and acrylic acid. Journal of the American Chemical Society 128(19) (2006) 6310-6311
Space group: C 1 c 1
Cell volume: 2147.8
Cell parameters: 10.836; 23.767; 9.844; 90; 122.091; 90;  

COD ID: 4101494
CIF file Formula: - C15 H18 N2 O -
Comments: Shintani, Ryo; Hayashi, Tamio Palladium-catalyzed [3 + 3] cycloaddition of trimethylenemethane with azomethine imines. Journal of the American Chemical Society 128(19) (2006) 6330-6331
Space group: P -1
Cell volume: 659.7
Cell parameters: 7.076; 7.693; 12.82; 77.94; 84.96; 75.35;  

COD ID: 4101495
CIF file Formula: - C49 H38.5 B F4 N6.5 O2 -
Comments: Lainé, Philippe P; Bedioui, Fethi; Loiseau, Frédérique; Chiorboli, Claudio; Campagna, Sebastiano Conformationally gated photoinduced processes within photosensitizer-acceptor dyads based on osmium(II) complexes with triarylpyridinio-functionalized terpyridyl ligands: insights from experimental study. Journal of the American Chemical Society 128(23) (2006) 7510-7521
Space group: P -1
Cell volume: 2092.4
Cell parameters: 10.2735; 14.111; 15.4467; 102.224; 105.077; 94.414;  

COD ID: 4101496
CIF file Formula: - C63 H95 N11 O45.5 -
Comments: Grotenbreg, Gijsbert M; Buizert, Annelies E M; Llamas-Saiz, Antonio L; Spalburg, Emile; van Hooft, Peter A V; de Neeling, Albert J; Noort, Daan; van Raaij, Mark J; van der Marel, Gijsbert A; Overkleeft, Herman S; Overhand, Mark Beta-turn modified gramicidin S analogues containing arylated sugar amino acids display antimicrobial and hemolytic activity comparable to the natural product. Journal of the American Chemical Society 128(23) (2006) 7559-7565
Space group: P 65 2 2
Cell volume: 41497.9
Cell parameters: 40.8437; 40.8437; 28.724; 90; 90; 120;  

COD ID: 4101497
CIF file Formula: - C8 H8 Cl N O -
Comments: Wan, Xiaobing; Ma, Zhongxun; Li, Bijie; Zhang, Keya; Cao, Shaokui; Zhang, Shiwei; Shi, Zhangjie Highly selective C-H functionalization/halogenation of acetanilide. Journal of the American Chemical Society 128(23) (2006) 7416-7417
Space group: P b c a
Cell volume: 1674.9
Cell parameters: 10.516; 9.554; 16.67; 90; 90; 90;  

COD ID: 4101498
CIF file Formula: - C9 H9 Cl N O2 -
Comments: Wan, Xiaobing; Ma, Zhongxun; Li, Bijie; Zhang, Keya; Cao, Shaokui; Zhang, Shiwei; Shi, Zhangjie Highly selective C-H functionalization/halogenation of acetanilide. Journal of the American Chemical Society 128(23) (2006) 7416-7417
Space group: P 1 21/c 1
Cell volume: 953
Cell parameters: 9.3602; 12.29; 8.59; 90; 105.34; 90;  

COD ID: 4101499
CIF file Formula: - C10 H11 F N2 O4 -
Comments: Lu, Shao-Feng; Du, Da-Ming; Xu, Jiaxi; Zhang, Shi-Wei Asymmetric Michael addition of nitroalkanes to nitroalkenes catalyzed by C2-symmetric tridentate bis(oxazoline) and bis(thiazoline) zinc complexes. Journal of the American Chemical Society 128(23) (2006) 7418-7419
Space group: P 1 21 1
Cell volume: 1135.6
Cell parameters: 7.5315; 19.034; 8.174; 90; 104.27; 90;  

COD ID: 4101500
CIF file Formula: - C10 H11 Cl N2 O4 -
Comments: Lu, Shao-Feng; Du, Da-Ming; Xu, Jiaxi; Zhang, Shi-Wei Asymmetric Michael addition of nitroalkanes to nitroalkenes catalyzed by C2-symmetric tridentate bis(oxazoline) and bis(thiazoline) zinc complexes. Journal of the American Chemical Society 128(23) (2006) 7418-7419
Space group: P 21 21 21
Cell volume: 1200.7
Cell parameters: 5.9181; 7.2067; 28.153; 90; 90; 90;  

COD ID: 4101501
CIF file Formula: - C376 H324 N47 O16 Zn6 -
Comments: Kamada, Taisuke; Aratani, Naoki; Ikeda, Toshiaki; Shibata, Naoki; Higuchi, Yoshiki; Wakamiya, Atsushi; Yamaguchi, Shigehiro; Kim, Kil Suk; Yoon, Zin Seok; Kim, Dongho; Osuka, Atsuhiro High fidelity self-sorting assembling of meso-cinchomeronimide appended meso-meso linked Zn(II) diporphyrins. Journal of the American Chemical Society 128(23) (2006) 7670-7678
Space group: R -3 :H
Cell volume: 27150
Cell parameters: 22.8553; 22.8553; 60.016; 90; 90; 120;  

COD ID: 4101502
CIF file Formula: - C522 H722 N60 O20 Zn10 -
Comments: Kamada, Taisuke; Aratani, Naoki; Ikeda, Toshiaki; Shibata, Naoki; Higuchi, Yoshiki; Wakamiya, Atsushi; Yamaguchi, Shigehiro; Kim, Kil Suk; Yoon, Zin Seok; Kim, Dongho; Osuka, Atsuhiro High fidelity self-sorting assembling of meso-cinchomeronimide appended meso-meso linked Zn(II) diporphyrins. Journal of the American Chemical Society 128(23) (2006) 7670-7678
Space group: P 1 21 1
Cell volume: 46062
Cell parameters: 29.95; 54.46; 30.26; 90; 111.06; 90;  

COD ID: 4101503
CIF file Formula: - C23 H22 Fe O2 -
Comments: Gregson, Charlotte K A; Gibson, Vernon C; Long, Nicholas J; Marshall, Edward L; Oxford, Phillip J; White, Andrew J P Redox control within single-site polymerization catalysts. Journal of the American Chemical Society 128(23) (2006) 7410-7411
Space group: P 1 21/c 1
Cell volume: 1835.3
Cell parameters: 8.1123; 20.867; 10.8576; 90; 93.051; 90;  

COD ID: 4101504
CIF file Formula: - C23 I O3 Si -
Comments: Bian, Jianwei; Van Wingerden, Matthew; Ready, Joseph M Enantioselective total synthesis of (+)- and (-)-nigellamine A2. Journal of the American Chemical Society 128(23) (2006) 7428-7429
Space group: P 1 21/n 1
Cell volume: 5154.2
Cell parameters: 12.665; 20.524; 19.944; 90; 96.16; 90;  

COD ID: 4101505
CIF file Formula: - C15 H15 I O3 -
Comments: Bian, Jianwei; Van Wingerden, Matthew; Ready, Joseph M Enantioselective total synthesis of (+)- and (-)-nigellamine A2. Journal of the American Chemical Society 128(23) (2006) 7428-7429
Space group: P 32
Cell volume: 1257.1
Cell parameters: 15.831; 15.831; 5.792; 90; 90; 120;  

COD ID: 4101506
CIF file Formula: - C31 H33 N2 O5 -
Comments: Bian, Jianwei; Van Wingerden, Matthew; Ready, Joseph M Enantioselective total synthesis of (+)- and (-)-nigellamine A2. Journal of the American Chemical Society 128(23) (2006) 7428-7429
Space group: P 21 21 21
Cell volume: 2843
Cell parameters: 8.878; 12.732; 25.155; 90; 90; 90;  

COD ID: 4101507
CIF file Formula: - C14 H19 I O4 -
Comments: Bian, Jianwei; Van Wingerden, Matthew; Ready, Joseph M Enantioselective total synthesis of (+)- and (-)-nigellamine A2. Journal of the American Chemical Society 128(23) (2006) 7428-7429
Space group: C 1 2 1
Cell volume: 1535
Cell parameters: 18.5; 8.743; 11.512; 90; 124.481; 90;  

COD ID: 4101508
CIF file Formula: - C14 H19 I O4 -
Comments: Bian, Jianwei; Van Wingerden, Matthew; Ready, Joseph M Enantioselective total synthesis of (+)- and (-)-nigellamine A2. Journal of the American Chemical Society 128(23) (2006) 7428-7429
Space group: C 1 2 1
Cell volume: 1531.8
Cell parameters: 18.482; 8.7351; 11.511; 90; 124.485; 90;  

COD ID: 4101509
CIF file Formula: - C19 H20 O2 -
Comments: Shi, Min; Liu, Le-Ping; Tang, Jie Palladium-catalyzed ring enlargement of aryl-substituted methylenecyclopropanes to cyclobutenes. Journal of the American Chemical Society 128(23) (2006) 7430-7431
Space group: P -1
Cell volume: 766.7
Cell parameters: 7.3656; 8.1841; 13.2944; 98.814; 93.413; 103.371;  

COD ID: 4101510
CIF file Formula: - C24 H42 Li N O2 Zn -
Comments: Clegg, William; Dale, Sophie H; Drummond, Allison M; Hevia, Eva; Honeyman, Gordon W; Mulvey, Robert E Alkali-metal-mediated zincation of anisole: synthesis and structures of three instructive ortho-zincated complexes. Journal of the American Chemical Society 128(23) (2006) 7434-7435
Space group: P 1 21/c 1
Cell volume: 2501.8
Cell parameters: 12.1007; 11.1744; 19.3198; 90; 106.728; 90;  

COD ID: 4101511
CIF file Formula: - C27 H40 Li N O3 Zn -
Comments: Clegg, William; Dale, Sophie H; Drummond, Allison M; Hevia, Eva; Honeyman, Gordon W; Mulvey, Robert E Alkali-metal-mediated zincation of anisole: synthesis and structures of three instructive ortho-zincated complexes. Journal of the American Chemical Society 128(23) (2006) 7434-7435
Space group: P 1 21/n 1
Cell volume: 2666.1
Cell parameters: 14.47; 11.4161; 16.167; 90; 93.35; 90;  

COD ID: 4101512
CIF file Formula: - C27 H42 Li N O2 Zn -
Comments: Clegg, William; Dale, Sophie H; Drummond, Allison M; Hevia, Eva; Honeyman, Gordon W; Mulvey, Robert E Alkali-metal-mediated zincation of anisole: synthesis and structures of three instructive ortho-zincated complexes. Journal of the American Chemical Society 128(23) (2006) 7434-7435
Space group: P -1
Cell volume: 1341.7
Cell parameters: 10.399; 11.205; 11.914; 88.22; 75.45; 87.077;  

COD ID: 4101513
CIF file Formula: - C13 H15 F Mo O2 -
Comments: Huang, Hui; Hughes, Russell P; Landis, Clark R; Rheingold, Arnold L The simplest binary fluorocarbon as a ligand. Synthetic, spectroscopic, crystallographic, and computational studies of a molybdenum complex of terminally ligated carbon monofluoride (fluoromethylidyne). Journal of the American Chemical Society 128(23) (2006) 7454-7455
Space group: P 1 21/m 1
Cell volume: 655.29
Cell parameters: 6.9746; 12.471; 7.7054; 90; 102.12; 90;  

COD ID: 4101514
CIF file Formula: - C19 H15 Co2 F Mo O8 -
Comments: Huang, Hui; Hughes, Russell P; Landis, Clark R; Rheingold, Arnold L The simplest binary fluorocarbon as a ligand. Synthetic, spectroscopic, crystallographic, and computational studies of a molybdenum complex of terminally ligated carbon monofluoride (fluoromethylidyne). Journal of the American Chemical Society 128(23) (2006) 7454-7455
Space group: P 1 21/c 1
Cell volume: 2188.6
Cell parameters: 8.84; 11.1894; 22.168; 90; 93.529; 90;  

COD ID: 4101515
CIF file Formula: - C65.5 H104.5 N2.5 S3 U -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: C 1 2/c 1
Cell volume: 12654.1
Cell parameters: 45.505; 11.4419; 31.3536; 90; 129.181; 90;  

COD ID: 4101516
CIF file Formula: - C36 H83 N3 S Si6 U -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/n 1
Cell volume: 4853.2
Cell parameters: 11.937; 20.7998; 19.5467; 90; 90.212; 90;  

COD ID: 4101517
CIF file Formula: - C90 H134 S4 U -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: C 1 2/c 1
Cell volume: 8443.8
Cell parameters: 13.9906; 32.6564; 19.4059; 90; 107.758; 90;  

COD ID: 4101518
CIF file Formula: - C54 H87 S3 U -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/n 1
Cell volume: 5396.5
Cell parameters: 10.1653; 37.649; 14.3213; 90; 100.07; 90;  

COD ID: 4101519
CIF file Formula: - C54 H87 La S3 -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/n 1
Cell volume: 5413.7
Cell parameters: 10.1325; 37.693; 14.3913; 90; 99.949; 90;  

COD ID: 4101520
CIF file Formula: - C54 H87 La S3 -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/c 1
Cell volume: 10730.1
Cell parameters: 16.0518; 37.544; 18.9539; 90; 110.052; 90;  

COD ID: 4101521
CIF file Formula: - C54 H87 Ce S3 -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/n 1
Cell volume: 5383.3
Cell parameters: 10.1207; 37.6; 14.3679; 90; 100.07; 90;  

COD ID: 4101522
CIF file Formula: - C54 H87 Pr S3 -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/n 1
Cell volume: 5396.7
Cell parameters: 10.1384; 37.698; 14.3383; 90; 100.008; 90;  

COD ID: 4101523
CIF file Formula: - C54 H87 Nd S3 -
Comments: Roger, Mathieu; Barros, Noémi; Arliguie, Thérèse; Thuéry, Pierre; Maron, Laurent; Ephritikhine, Michel U(SMes*)n, (n = 3, 4) and Ln(SMes*)3 (Ln = La, Ce, Pr, Nd): lanthanide(III)/actinide(III) differentiation in agostic interactions and an unprecedented eta3 ligation mode of the arylthiolate ligand, from X-ray diffraction and DFT analysis. Journal of the American Chemical Society 128(27) (2006) 8790-8802
Space group: P 1 21/n 1
Cell volume: 5388.7
Cell parameters: 10.1528; 37.6336; 14.3232; 90; 100.054; 90;  

COD ID: 4101524
CIF file Formula: - C21 H44 Li N O Zn -
Comments: Uchiyama, Masanobu; Matsumoto, Yotaro; Nobuto, Daisuke; Furuyama, Taniyuki; Yamaguchi, Kentaro; Morokuma, Keiji Structure and reaction pathway of TMP-Zincate: amido base or alkyl base? Journal of the American Chemical Society 128(27) (2006) 8748-8750
Space group: P n m a
Cell volume: 2453
Cell parameters: 19.967; 10.206; 12.039; 90; 90; 90;  

COD ID: 4101525
CIF file Formula: - C32 H44 O2 P2 Si2 -
Comments: Wright, Vincent A; Patrick, Brian O; Schneider, Celine; Gates, Derek P Phosphorus copies of PPV: pi-conjugated polymers and molecules composed of alternating phenylene and phosphaalkene moieties. Journal of the American Chemical Society 128(27) (2006) 8836-8844
Space group: P -1
Cell volume: 1648.4
Cell parameters: 8.1006; 12.2801; 17.1807; 101.513; 93.354; 98.714;  

COD ID: 4101526
CIF file Formula: - C30 H40 O2 P2 Si2 -
Comments: Wright, Vincent A; Patrick, Brian O; Schneider, Celine; Gates, Derek P Phosphorus copies of PPV: pi-conjugated polymers and molecules composed of alternating phenylene and phosphaalkene moieties. Journal of the American Chemical Society 128(27) (2006) 8836-8844
Space group: P 1 21/n 1
Cell volume: 1548.7
Cell parameters: 9.769; 9.0886; 17.49; 90; 94.19; 90;  

COD ID: 4101527
CIF file Formula: - C19 H25 O P Si -
Comments: Wright, Vincent A; Patrick, Brian O; Schneider, Celine; Gates, Derek P Phosphorus copies of PPV: pi-conjugated polymers and molecules composed of alternating phenylene and phosphaalkene moieties. Journal of the American Chemical Society 128(27) (2006) 8836-8844
Space group: P 1 21/n 1
Cell volume: 1900
Cell parameters: 7.806; 16.799; 14.801; 90; 101.78; 90;  

COD ID: 4101528
CIF file

HKL data

Formula: - O38 Si19 -
Comments: Dorset, Douglas L; Kennedy, Gordon J; Strohmaier, Karl G; Diaz-Cabañas, Maria J; Rey, Fernando; Corma, Avelino P-derived organic cations as structure-directing agents: synthesis of a high-silica zeolite (ITQ-27) with a two-dimensional 12-ring channel system. Journal of the American Chemical Society 128(27) (2006) 8862-8867
Space group: F m m m
Cell volume: 9682.3
Cell parameters: 27.7508; 25.2969; 13.7923; 90; 90; 90;  

COD ID: 4101529
CIF file Formula: - Cs H10.84 K N2.71 Rb1.29 S17 Sn5 Zn4 -
Comments: Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17]. Journal of the American Chemical Society 128(27) (2006) 8875-8883
Space group: I -4 m 2
Cell volume: 1918.19
Cell parameters: 13.8184; 13.8184; 10.0456; 90; 90; 90;  

COD ID: 4101530
CIF file Formula: - H5.64 K4.59 N1.41 S17 Sn5 Zn4 -
Comments: Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17]. Journal of the American Chemical Society 128(27) (2006) 8875-8883
Space group: I -4 m 2
Cell volume: 1876
Cell parameters: 13.829; 13.829; 9.81; 90; 90; 90;  

COD ID: 4101531
CIF file Formula: - H4 K5 N S17 Sn5 Zn4 -
Comments: Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17]. Journal of the American Chemical Society 128(27) (2006) 8875-8883
Space group: I -4 m 2
Cell volume: 1847.7
Cell parameters: 13.8142; 13.8142; 9.6824; 90; 90; 90;  

COD ID: 4101532
CIF file Formula: - Cs K5 S17 Sn5 Zn4 -
Comments: Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17]. Journal of the American Chemical Society 128(27) (2006) 8875-8883
Space group: I -4 m 2
Cell volume: 1856.8
Cell parameters: 13.843; 13.843; 9.69; 90; 90; 90;  

COD ID: 4101533
CIF file Formula: - H20 K N5 S17 Sn5 Zn4 -
Comments: Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17]. Journal of the American Chemical Society 128(27) (2006) 8875-8883
Space group: I -4 m 2
Cell volume: 1931
Cell parameters: 13.8455; 13.8455; 10.0731; 90; 90; 90;  

COD ID: 4101534
CIF file Formula: - C128 H56 Ce N5 Ni Sc2 -
Comments: Wang, Xuelei; Zuo, Tianming; Olmstead, Marilyn M; Duchamp, James C; Glass, Thomas E; Cromer, Frank; Balch, Alan L; Dorn, Harry C Preparation and structure of CeSc2N@C80: an icosahedral carbon cage enclosing an acentric CeSc2N unit with buried f electron spin. Journal of the American Chemical Society 128(27) (2006) 8884-8889
Space group: C 1 2/c 1
Cell volume: 14891.9
Cell parameters: 25.3588; 14.9668; 39.4062; 90; 95.315; 90;  

COD ID: 4101535
CIF file Formula: - C36 H36 N2 O10 S4 -
Comments: Lukin, Oleg; Gramlich, Volker; Kandre, Ramchandra; Zhun, Igor; Felder, Thorsten; Schalley, Christoph A; Dolgonos, Grigoriy Designer dendrimers: branched oligosulfonimides with controllable molecular architectures. Journal of the American Chemical Society 128(27) (2006) 8964-8974
Space group: P b c a
Cell volume: 7347.8
Cell parameters: 19.8805; 11.7498; 31.4557; 90; 90; 90;  

COD ID: 4101536
CIF file Formula: - C44 H44 N3 O10 S4 -
Comments: Lukin, Oleg; Gramlich, Volker; Kandre, Ramchandra; Zhun, Igor; Felder, Thorsten; Schalley, Christoph A; Dolgonos, Grigoriy Designer dendrimers: branched oligosulfonimides with controllable molecular architectures. Journal of the American Chemical Society 128(27) (2006) 8964-8974
Space group: P -1
Cell volume: 2157.7
Cell parameters: 6.9331; 18.493; 19.158; 114.416; 99.884; 96.367;  

COD ID: 4101537
CIF file Formula: - C46 H8 Cl2 Mn3 N24 O12 -
Comments: Dinca, Mircea; Yu, Anta F; Long, Jeffrey R Microporous metal-organic frameworks incorporating 1,4-benzeneditetrazolate: syntheses, structures, and hydrogen storage properties. Journal of the American Chemical Society 128(27) (2006) 8904-8913
Space group: C 1 2/m 1
Cell volume: 3274
Cell parameters: 20.353; 14.477; 12.291; 90; 115.3; 90;  

COD ID: 4101538
CIF file Formula: - C84 H12 Mn4 N36 O15 -
Comments: Dinca, Mircea; Yu, Anta F; Long, Jeffrey R Microporous metal-organic frameworks incorporating 1,4-benzeneditetrazolate: syntheses, structures, and hydrogen storage properties. Journal of the American Chemical Society 128(27) (2006) 8904-8913
Space group: P -1
Cell volume: 3153.8
Cell parameters: 10.491; 16.446; 19.412; 74.64; 82.81; 78.35;  

COD ID: 4101539
CIF file Formula: - C40 H55 N29 O8 Zn3 -
Comments: Dinca, Mircea; Yu, Anta F; Long, Jeffrey R Microporous metal-organic frameworks incorporating 1,4-benzeneditetrazolate: syntheses, structures, and hydrogen storage properties. Journal of the American Chemical Society 128(27) (2006) 8904-8913
Space group: P -1
Cell volume: 1567.4
Cell parameters: 11.5713; 11.736; 13.619; 92.869; 114.443; 107.988;  


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