Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1506253 | CIF | C25 H22 O2 | P 1 21/n 1 | 6.0057; 12.2328; 25.351 90; 90.591; 90 | 1862.4 | Wang, Yi; Burton, Donald J. Site-specific preparation of 2-carboalkoxy-4-substituted naphthalenes and 9-alkylphenanthrenes and evidence for an allene intermediate in the novel base-catalyzed cyclization of 2-alkynylbiphenyls. Organic letters, 2006, 8, 5295-5298 |
| 1506254 | CIF | C27 H22 Cl Cu N5 O4 | P 21 21 21 | 9.4787; 9.6895; 27.4742 90; 90; 90 | 2523.34 | Preston, Adam J.; Gallucci, Judith C.; Parquette, Jon R. Structural impact of coordinating a helical 2,6-pyridyl diamide with divalent metals. Organic letters, 2006, 8, 5259-5262 |
| 1506255 | CIF | C28 H23 Cl4 N5 Ni O4 | P 21 21 21 | 10.0378; 17.8225; 19.2315 90; 90; 90 | 3440.49 | Preston, Adam J.; Gallucci, Judith C.; Parquette, Jon R. Structural impact of coordinating a helical 2,6-pyridyl diamide with divalent metals. Organic letters, 2006, 8, 5259-5262 |
| 1506256 | CIF | C36 H29 D3 N6 O4 S Zn | P 1 21 1 | 14.489; 9.618; 23.916 90; 91.48; 90 | 3331.7 | Preston, Adam J.; Gallucci, Judith C.; Parquette, Jon R. Structural impact of coordinating a helical 2,6-pyridyl diamide with divalent metals. Organic letters, 2006, 8, 5259-5262 |
| 1506257 | CIF | C75 H58 D8 N10 O8 S2 Zn2 | P 1 21 1 | 9.3015; 15.645; 23.0613 90; 95.222; 90 | 3342 | Preston, Adam J.; Gallucci, Judith C.; Parquette, Jon R. Structural impact of coordinating a helical 2,6-pyridyl diamide with divalent metals. Organic letters, 2006, 8, 5259-5262 |
| 1506258 | CIF | C38 H50 O14 | P 65 | 23.446; 23.446; 14.036 90; 90; 120 | 6682 | Yin, Sheng; Fan, Cheng-Qi; Wang, Xiao-Ning; Lin, Li-Ping; Ding, Jian; Yue, Jian-Min Xylogranatins A-D: novel tetranortriterpenoids with an unusual 9,10-seco scaffold from marine mangrove Xylocarpus granatum. Organic letters, 2006, 8, 4935-4938 |
| 1506259 | CIF | C34 H41 N2 O11 | P -1 | 10.9275; 11.0354; 14.5086 92.193; 100.377; 96.85 | 1705.5 | Zhang, Aimin; Ferguson, Joseph S.; Yamato, Kazuhiro; Zheng, Chong; Gong, Bing Improving foldamer synthesis through protecting group induced unfolding of aromatic oligoamides. Organic letters, 2006, 8, 5117-5120 |
| 1506260 | CIF | C88 H118 N4 O24 | C 1 c 1 | 19.514; 16.3891; 27.727 90; 101.243; 90 | 8697.4 | Zhang, Aimin; Ferguson, Joseph S.; Yamato, Kazuhiro; Zheng, Chong; Gong, Bing Improving foldamer synthesis through protecting group induced unfolding of aromatic oligoamides. Organic letters, 2006, 8, 5117-5120 |
| 1506261 | CIF | C12 H19 N O2 | P b c a | 11.177; 14.03; 14.477 90; 90; 90 | 2270.2 | Gu, Peiming; Zhao, Yu-Ming; Tu, Yong Qiang; Ma, Yufei; Zhang, Fumin Tandem semipinacol/Schmidt reaction leading to a versatile and efficient approach to azaquaternary alkaloid skeletons. Organic letters, 2006, 8, 5271-5273 |
| 1506262 | CIF | C12 H19 N O2 | P 1 21/c 1 | 8.192; 7.778; 17.823 90; 99.82; 90 | 1119 | Gu, Peiming; Zhao, Yu-Ming; Tu, Yong Qiang; Ma, Yufei; Zhang, Fumin Tandem semipinacol/Schmidt reaction leading to a versatile and efficient approach to azaquaternary alkaloid skeletons. Organic letters, 2006, 8, 5271-5273 |
| 1506263 | CIF | C23 H32 N2 O5 | C 1 2/c 1 | 27.369; 6.226; 25.329 90; 90.231; 90 | 4316 | Arnott, Gareth; Clayden, Jonathan; Hamilton, Stuart D. Azabicyclic amino acids by stereoselective dearomatizing cyclization of the enolates of N-nicotinoyl glycine derivatives. Organic letters, 2006, 8, 5325-5328 |
| 1506264 | CIF | C23 H26 Cl3 F3 N2 O6 S | P 21 21 21 | 6.4308; 14.8616; 29.0316 90; 90; 90 | 2774.6 | Arnott, Gareth; Clayden, Jonathan; Hamilton, Stuart D. Azabicyclic amino acids by stereoselective dearomatizing cyclization of the enolates of N-nicotinoyl glycine derivatives. Organic letters, 2006, 8, 5325-5328 |
| 1506265 | CIF | C53 H69 Cl3 O12 | P -1 | 12.0169; 15.9703; 16.131 63.823; 70.256; 78.903 | 2611.45 | Salorinne, Kirsi; Nissinen, Maija Novel tetramethoxy resorcinarene bis-crown ethers. Organic letters, 2006, 8, 5473-5476 |
| 1506266 | CIF | C62 H85 N3 O14 | P -1 | 14.0187; 14.4583; 16.5822 65.075; 75.326; 77.921 | 2928.34 | Salorinne, Kirsi; Nissinen, Maija Novel tetramethoxy resorcinarene bis-crown ethers. Organic letters, 2006, 8, 5473-5476 |
| 1506267 | CIF | C60 H84 F12 K2 N2 O15 P2 | P 1 21/c 1 | 17.3738; 15.9352; 24.4132 90; 91.8; 90 | 6755.6 | Salorinne, Kirsi; Nissinen, Maija Novel tetramethoxy resorcinarene bis-crown ethers. Organic letters, 2006, 8, 5473-5476 |
| 1506268 | CIF | C62 H88 F6 Na O16 P | C 1 2/c 1 | 33.394; 15.559; 24.951 90; 101.11; 90 | 12721 | Salorinne, Kirsi; Nissinen, Maija Novel tetramethoxy resorcinarene bis-crown ethers. Organic letters, 2006, 8, 5473-5476 |
| 1506269 | CIF | C62 H88 Cl Na O20 | C 1 2/c 1 | 33.607; 15.5535; 24.7751 90; 101.153; 90 | 12705.5 | Salorinne, Kirsi; Nissinen, Maija Novel tetramethoxy resorcinarene bis-crown ethers. Organic letters, 2006, 8, 5473-5476 |
| 1506270 | CIF | C36 H26 | P 1 21/c 1 | 14.792; 10.495; 16.383 90; 95.915; 90 | 2529.8 | Lu, Jian-Mei; Shi, Min Lewis acid catalyzed reaction of arylvinylidenecyclopropanes with acetals: a facile synthetic protocol for the preparation of indene derivatives. Organic letters, 2006, 8, 5317-5320 |
| 1506271 | CIF | C38 H30 | P 1 21/c 1 | 13.4196; 11.1258; 18.781 90; 93.243; 90 | 2799.6 | Lu, Jian-Mei; Shi, Min Lewis acid catalyzed reaction of arylvinylidenecyclopropanes with acetals: a facile synthetic protocol for the preparation of indene derivatives. Organic letters, 2006, 8, 5317-5320 |
| 1506272 | CIF | C30 H37 O3 P | P -1 | 10.675; 11.455; 12.152 94.968; 95.671; 117.303 | 1299.3 | Zhang, Dong; Gao, Ruomei; Afzal, Shabana; Vargas, Mario; Sharma, Shantanu; McCurdy, Alison; Yousufuddin, Muhammed; Stewart, Timothy; Bau, Robert; Selke, Matthias Intramolecular arene epoxidation by phosphadioxiranes. Organic letters, 2006, 8, 5125-5128 |
| 1506273 | CIF | C30 H24 N O2 P | P 1 21/n 1 | 10.999; 11.201; 21.538 90; 100.571; 90 | 2608 | Zhang, Dong; Gao, Ruomei; Afzal, Shabana; Vargas, Mario; Sharma, Shantanu; McCurdy, Alison; Yousufuddin, Muhammed; Stewart, Timothy; Bau, Robert; Selke, Matthias Intramolecular arene epoxidation by phosphadioxiranes. Organic letters, 2006, 8, 5125-5128 |
| 1506274 | CIF | C24 H18 N2 O | P -1 | 7.2566; 8.17537; 16.3566 92.313; 100.627; 103.381 | 924.32 | Paravidino, Monica; Bon, Robin S.; Scheffelaar, Rachel; Vugts, Danielle J.; Znabet, Anass; Schmitz, Rob F.; de Kanter, Frans J. J.; Lutz, Martin; Spek, Anthony L.; Groen, Marinus B.; Orru, Romano V. A. Diastereoselective multicomponent synthesis of dihydropyridones with an isocyanide functionality. Organic letters, 2006, 8, 5369-5372 |
| 1506275 | CIF | C11 H10 F N S | P 1 21/c 1 | 6.5663; 7.983; 20.8615 90; 98.819; 90 | 1080.61 | Xu, Wei; Abboud, Khalil A.; Ghiviriga, Ion; Dolbier, Jr, William R; Rapp, Magdalena; Wnuk, Stanislaw F. An unexpected reaction of trimethylsilyl fluorosulfonyldifluoroacetate (TFDA) with imidazoles. Formation of N-difluoromethylthioureas. Organic letters, 2006, 8, 5549-5551 |
| 1506276 | CIF | C16 H20 Cl4 O | P 1 21/n 1 | 12.3111; 10.7924; 14.003 90; 114.56; 90 | 1692.2 | Banwell, Martin G.; Phillis, Andrew T.; Willis, Anthony C. Exploitation of cyclopropane ring-cleavage reactions for the rapid assembly of tetracyclic frameworks related to gibberellins. Organic letters, 2006, 8, 5341-5344 |
| 1506277 | CIF | C16 H20 Cl4 O | P -1 | 6.6694; 10.1604; 12.2442 100.632; 94.9445; 94.3746 | 808.83 | Banwell, Martin G.; Phillis, Andrew T.; Willis, Anthony C. Exploitation of cyclopropane ring-cleavage reactions for the rapid assembly of tetracyclic frameworks related to gibberellins. Organic letters, 2006, 8, 5341-5344 |
| 1506278 | CIF | C16 H19 Cl3 O | P 1 21/n 1 | 6.6142; 12.218; 19.1863 90; 92.6086; 90 | 1548.88 | Banwell, Martin G.; Phillis, Andrew T.; Willis, Anthony C. Exploitation of cyclopropane ring-cleavage reactions for the rapid assembly of tetracyclic frameworks related to gibberellins. Organic letters, 2006, 8, 5341-5344 |
| 1506279 | CIF | C17 H21 Cl3 O | P 1 21/n 1 | 15.7868; 6.466; 16.3562 90; 99.0435; 90 | 1648.84 | Banwell, Martin G.; Phillis, Andrew T.; Willis, Anthony C. Exploitation of cyclopropane ring-cleavage reactions for the rapid assembly of tetracyclic frameworks related to gibberellins. Organic letters, 2006, 8, 5341-5344 |
| 1506280 | CIF | C18 H21 Cl5 O | P -1 | 6.6052; 16.5809; 19.2553 111.316; 93.605; 99.927 | 1916.96 | Banwell, Martin G.; Phillis, Andrew T.; Willis, Anthony C. Exploitation of cyclopropane ring-cleavage reactions for the rapid assembly of tetracyclic frameworks related to gibberellins. Organic letters, 2006, 8, 5341-5344 |
| 1506281 | CIF | C15 H6 F6 S3 | P 1 21/a 1 | 15.461; 5.7223; 17.076 90; 96.684; 90 | 1500.49 | Ie, Yutaka; Umemoto, Yoshikazu; Kaneda, Takahiro; Aso, Yoshio Electronegative oligothiophenes based on a hexafluorocyclopentene-annelated thiophene unit. Organic letters, 2006, 8, 5381-5384 |
| 1506282 | CIF | C30 H10 F12 S6 | C 1 2/c 1 | 34.977; 5.7994; 15.474 90; 110.238; 90 | 2945.1 | Ie, Yutaka; Umemoto, Yoshikazu; Kaneda, Takahiro; Aso, Yoshio Electronegative oligothiophenes based on a hexafluorocyclopentene-annelated thiophene unit. Organic letters, 2006, 8, 5381-5384 |
| 1506283 | CIF | C30 H20 N3 O3 | P 21 21 21 | 8.463; 9.365; 26.305 90; 90; 90 | 2084.8 | Jiao, Rui H.; Xu, Shu; Liu, Jun Y.; Ge, Hui M.; Ding, Hui; Xu, Chen; Zhu, Hai L.; Tan, Ren X. Chaetominine, a cytotoxic alkaloid produced by endophytic Chaetomium sp. IFB-E015. Organic letters, 2006, 8, 5709-5712 |
| 1506284 | CIF | C20 H20 N2 O3 | P 1 21/c 1 | 12.087; 7.895; 19.07 90; 106.047; 90 | 1748.9 | Du, Yunfei; Liu, Renhe; Linn, Gregory; Zhao, Kang Synthesis of N-substituted indole derivatives via PIFA-mediated intramolecular cyclization. Organic letters, 2006, 8, 5919-5922 |
| 1506285 | CIF | C37 H52 N2 O7 | P 1 21 1 | 7.942; 10.334; 19.787 90; 92.16; 90 | 1622.8 | Kushiro, Tetsuo; Hoshino, Masaki; Tsutsumi, Takehiko; Kawai, Ken-ichi; Shiro, Motoo; Shibuya, Masaaki; Ebizuka, Yutaka Stereochemical course in water addition during LUP1-catalyzed triterpene cyclization. Organic letters, 2006, 8, 5589-5592 |
| 1506286 | CIF | C5.33 H6.22 N2.67 O0.89 S0.89 | P 1 21/c 1 | 9.397; 13.512; 13.991 90; 100.976; 90 | 1743.97 | Basheer, Ahmad; Rappoport, Zvi The first example of isomeric solid amide and its enol. Organic letters, 2006, 8, 5931-5934 |
| 1506287 | CIF | C6 H9 N3 O S | P 1 21/n 1 | 6.4264; 9.4444; 13.293 90; 96.777; 90 | 801.16 | Basheer, Ahmad; Rappoport, Zvi The first example of isomeric solid amide and its enol. Organic letters, 2006, 8, 5931-5934 |
| 1506288 | CIF | C7 H10 Cl3 N3 O S | P n a 21 | 9.2416; 8.772; 15.567 90; 90; 90 | 1262 | Basheer, Ahmad; Rappoport, Zvi The first example of isomeric solid amide and its enol. Organic letters, 2006, 8, 5931-5934 |
| 1506289 | CIF | C36 H26 N8 | P -1 | 5.646; 8.78; 14.507 104.262; 91.69; 96.25 | 691.6 | Cerna, Igor; Pohl, Radek; Klepetarová, Blanka; Hocek, Michal Direct C-H arylation of purines: development of methodology and its use in regioselective synthesis of 2,6,8-trisubstituted purines. Organic letters, 2006, 8, 5389-5392 |
| 1506290 | CIF | C25 H20 N4 | P -1 | 10.1257; 10.4037; 11.2572 101.247; 114.349; 106.926 | 963.7 | Cerna, Igor; Pohl, Radek; Klepetarová, Blanka; Hocek, Michal Direct C-H arylation of purines: development of methodology and its use in regioselective synthesis of 2,6,8-trisubstituted purines. Organic letters, 2006, 8, 5389-5392 |
| 1506291 | CIF | C29 H30 N4 O5 S | P 1 21/c 1 | 13.641; 16.424; 12.005 90; 94.29; 90 | 2682.1 | Kaiser, Hanns Martin; Lo, Wei Fun; Riahi, Abdol Majid; Spannenberg, Anke; Beller, Matthias; Tse, Man Kin New synthetic protocols for the preparation of unsymmetrical bisindoles Organic letters, 2006, 8, 5761-5764 |
| 1506292 | CIF | C17 H21 F3 O6 | P 21 21 21 | 9.6694; 13.3238; 13.8318 90; 90; 90 | 1781.99 | Sterk, Damjan; Stephan, Michel; Mohar, Barbara Highly enantioselective transfer hydrogenation of fluoroalkyl ketones. Organic letters, 2006, 8, 5935-5938 |
| 1506293 | CIF | C9 H10 F3 N O | P 21 21 21 | 6.6648; 8.1816; 18.7439 90; 90; 90 | 1022.08 | Sterk, Damjan; Stephan, Michel; Mohar, Barbara Highly enantioselective transfer hydrogenation of fluoroalkyl ketones. Organic letters, 2006, 8, 5935-5938 |
| 1506294 | CIF | C88 H16 F40 O8 | P 1 21/c 1 | 16.871; 22.046; 22.462 90; 103.148; 90 | 8135 | Reddy, J. Sreedhar; Mandal, Sukhendu; Anand, Venkataramanarao G. Cyclic oligofurans: one-pot synthesis of 30pi and 40pi expanded porphyrinoids. Organic letters, 2006, 8, 5541-5543 |
| 1506295 | CIF | C12 H9 N3 | P 21 21 21 | 5.1126; 13.096; 14.347 90; 90; 90 | 960.6 | Shibahara, Fumitoshi; Kitagawa, Asumi; Yamaguchi, Eiji; Murai, Toshiaki Synthesis of 2-azaindolizines by using an iodine-mediated oxidative desulfurization promoted cyclization of N-2-pyridylmethyl thioamides and an investigation of their photophysical properties. Organic letters, 2006, 8, 5621-5624 |
| 1506296 | CIF | C24 H16 N6 S | P -1 | 8.049; 10.286; 12.388 90.925; 101.862; 98.595 | 991.3 | Shibahara, Fumitoshi; Kitagawa, Asumi; Yamaguchi, Eiji; Murai, Toshiaki Synthesis of 2-azaindolizines by using an iodine-mediated oxidative desulfurization promoted cyclization of N-2-pyridylmethyl thioamides and an investigation of their photophysical properties. Organic letters, 2006, 8, 5621-5624 |
| 1506297 | CIF | C17 H14 N2 O S | P -1 | 9.642; 9.953; 16.2792 97.093; 92.531; 97.689 | 1533.44 | Singh, C. B.; Murru, Siva; Kavala, Veerababurao; Patel, Bhisma K. It is "thiazolidene-2-imine" and not imidazole-2-thione as the reaction product of 1-benzoyl-3-phenylthiourea with Br(2)/enolizable ketone. Organic letters, 2006, 8, 5397-5399 |
| 1506298 | CIF | C22 H16 N2 O S | P 1 21/n 1 | 10.4679; 15.2299; 11.7243 90; 101.491; 90 | 1831.7 | Singh, C. B.; Murru, Siva; Kavala, Veerababurao; Patel, Bhisma K. It is "thiazolidene-2-imine" and not imidazole-2-thione as the reaction product of 1-benzoyl-3-phenylthiourea with Br(2)/enolizable ketone. Organic letters, 2006, 8, 5397-5399 |
| 1506299 | CIF | C17 H13 Br N2 O S | P 1 21/c 1 | 16.059; 13.4006; 7.6695 90; 98.68; 90 | 1631.6 | Singh, C. B.; Murru, Siva; Kavala, Veerababurao; Patel, Bhisma K. It is "thiazolidene-2-imine" and not imidazole-2-thione as the reaction product of 1-benzoyl-3-phenylthiourea with Br(2)/enolizable ketone. Organic letters, 2006, 8, 5397-5399 |
| 1506300 | CIF | C12 H15 N O3 | P 1 21/n 1 | 10.9577; 9.0799; 11.3076 90; 96.931; 90 | 1116.8 | Malona, John A.; Colbourne, Jessica M.; Frontier, Alison J. A general method for the catalytic nazarov cyclization of heteroaromatic compounds. Organic letters, 2006, 8, 5661-5664 |
| 1506301 | CIF | C21 H24 O6 | P 1 21/c 1 | 11.0511; 20.5371; 9.0441 90; 96.047; 90 | 2041.2 | Duan, Xin-Hua; Guo, Li-Na; Bi, Hai-Peng; Liu, Xue-Yuan; Liang, Yong-Min Highly regioselective synthesis of 2,3-disubstituted indenes via a novel palladium-catalyzed cyclization reaction of propargylic carbonates with carbon nucleophiles. Organic letters, 2006, 8, 5777-5780 |
| 1506302 | CIF | C15 H16 O5 | P -1 | 8.193; 8.974; 18.504 89.169; 81.157; 72.754 | 1283.2 | Pittelkow, Michael; Boas, Ulrik; Christensen, Jørn B Carbocations in action. Design, synthesis, and evaluation of a highly acid-sensitive naphthalene-based backbone amide linker for solid-phase synthesis. Organic letters, 2006, 8, 5817-5820 |
| 1506303 | CIF | C19 H16 O5 | P 1 21/c 1 | 7.764; 21.989; 8.721 90; 94.738; 90 | 1483.8 | Dahl, Bart J.; Branchaud, Bruce P. 180 degree unidirectional bond rotation in a biaryl lactone artificial molecular motor prototype. Organic letters, 2006, 8, 5841-5844 |
| 1506304 | CIF | C22 H18 F6 N4 O8 Pd2 S2 | P -1 | 7.7003; 12.9161; 14.763 87.536; 84.658; 74.544 | 1408.8 | Zhao, Baowei; Lu, Xiyan Cationic palladium(II)-catalyzed addition of arylboronic acids to nitriles. One-step synthesis of benzofurans from phenoxyacetonitriles. Organic letters, 2006, 8, 5987-5990 |
| 1506305 | CIF | C46.38 H37 Cl2.76 N10 O2 | P -1 | 16.654; 17.694; 17.91 77.62; 64.1; 89.91 | 4612 | Wang, Qi-Qiang; Wang, De-Xian; Ma, Hong-Wei; Wang, Mei-Xiang Synthesis of tetraazacalix[2]arene[2]triazines: tuning the cavity by the substituents on the bridging nitrogen atoms. Organic letters, 2006, 8, 5967-5970 |
| 1506306 | CIF | C33.5 H27.5 Cl2 N10.5 O2.5 | P -1 | 13.477; 15.305; 16.878 76.66; 89.07; 88.22 | 3385.6 | Wang, Qi-Qiang; Wang, De-Xian; Ma, Hong-Wei; Wang, Mei-Xiang Synthesis of tetraazacalix[2]arene[2]triazines: tuning the cavity by the substituents on the bridging nitrogen atoms. Organic letters, 2006, 8, 5967-5970 |
| 1506307 | CIF | C32 H24 Cl2 N10 | P n a 21 | 13.007; 14.042; 16.794 90; 90; 90 | 3067.3 | Wang, Qi-Qiang; Wang, De-Xian; Ma, Hong-Wei; Wang, Mei-Xiang Synthesis of tetraazacalix[2]arene[2]triazines: tuning the cavity by the substituents on the bridging nitrogen atoms. Organic letters, 2006, 8, 5967-5970 |
| 1506308 | CIF | C51 H50 Cl2 N12 O4 | C 1 2/c 1 | 26.598; 9.4281; 20.033 90; 110.21; 90 | 4714.4 | Wang, Qi-Qiang; Wang, De-Xian; Ma, Hong-Wei; Wang, Mei-Xiang Synthesis of tetraazacalix[2]arene[2]triazines: tuning the cavity by the substituents on the bridging nitrogen atoms. Organic letters, 2006, 8, 5967-5970 |
| 1506309 | CIF | C46 H36 Cl2 N10 O | P 1 21/n 1 | 16.54; 8.832; 30.088 90; 104.33; 90 | 4258.5 | Wang, Qi-Qiang; Wang, De-Xian; Ma, Hong-Wei; Wang, Mei-Xiang Synthesis of tetraazacalix[2]arene[2]triazines: tuning the cavity by the substituents on the bridging nitrogen atoms. Organic letters, 2006, 8, 5967-5970 |
| 1506310 | CIF | C30 H36 N2 O3 | P 1 21/c 1 | 11.1854; 34.814; 7.0886 90; 106.175; 90 | 2651.1 | Hopkins, Chad D.; Malinakova, Helena C. Allylpalladium umpolung in the three-component coupling synthesis of homoallylic amines. Organic letters, 2006, 8, 5971-5974 |
| 1506311 | CIF | C105.5 H143 N8 O8.5 | C 1 2/c 1 | 24.468; 24.214; 19.3043 90; 102.267; 90 | 11176 | Ishibashi, Koichi; Tsue, Hirohito; Tokita, Satoshi; Matsui, Kazuhiro; Takahashi, Hiroki; Tamura, Rui Regioselectively N-methylated azacalix[8]arene octamethyl ether prepared by catalytic aryl amination reaction using a temporal N-silylation protocol. Organic letters, 2006, 8, 5991-5994 |
| 1506312 | CIF | C26 H26 N2 | P 21 21 21 | 5.762; 9.213; 38.396 90; 90; 90 | 2038.3 | Williams, Amie L.; Srinivasan, Jayasree M.; Johnston, Jeffrey N. Synthesis of an advanced intermediate en route to the mitomycin natural products. Organic letters, 2006, 8, 6047-6049 |
| 1506313 | CIF | C14 H17 N O3 | P 21 21 21 | 8.6454; 10.7876; 13.704 90; 90; 90 | 1278.1 | Pansare, Sunil V.; Adsool, Vikrant A. Enantioselective synthesis of functionalized medium-sized oxacycles. Organic letters, 2006, 8, 5897-5899 |
| 1506314 | CIF | C30 H34 Cl N3 O6 | C 1 2 1 | 29.6799; 6.1328; 16.0196 90; 96.368; 90 | 2897.91 | Mizoguchi, Jun-ichi; Kawanami, Yuko; Wada, Takehiko; Kodama, Kazuya; Anzai, Kinsei; Yanagi, Toshiharu; Inoue, Yoshihisa Enantiodifferentiating photocyclodimerization of 2-anthracenecarboxylic acid using a chiral N-(2-hydroxymethyl-4- pyrrolidinyl)benzamide template. Organic letters, 2006, 8, 6051-6054 |
| 1506315 | CIF | C24 H17 Cl N2 O2 | P 1 c 1 | 8.7336; 7.8955; 14.484 90; 95.04; 90 | 994.9 | Liang, Yong; Jiao, Lei; Wang, Yuanyuan; Chen, Yuanyuan; Ma, Linge; Xu, Jiaxi; Zhang, Shiwei; Yu, Zhi-Xiang Nitrene equivalent mediated metal-free ring expansions of alkylidenecyclopropanes and an alkylidenecyclobutane. Organic letters, 2006, 8, 5877-5879 |
| 1506316 | CIF | C32 H26 | P 1 21/c 1 | 9.544; 11.546; 10.453 90; 107.808; 90 | 1096.7 | Ohkubo, Kei; Iwata, Ryosuke; Miyazaki, Soushi; Kojima, Takahiko; Fukuzumi, Shunichi Photocatalytic formation of dimethyllepidopterene from 9,10-dimethylanthracene via electron-transfer oxidation. Organic letters, 2006, 8, 6079-6082 |
| 1506317 | CIF | C104 H39 Cl9 N2 O16 | P -1 | 16.235; 18.066; 18.447 104.899; 114.991; 93.152 | 4655.7 | Chuang, Shih-Ching; Khan, Saeed I.; Rubin, Yves Switch of electronic reactivity in fullerene C60: activation of three trans-4 positions via temporary saturation of the cis-1 positions. Organic letters, 2006, 8, 6075-6078 |
| 1506318 | CIF | C9 H10 F2 N2 O4 S | P 1 21 1 | 6.4138; 10.5196; 17.152 90; 99.808; 90 | 1140.34 | Zheng, Feng; Zhang, Xiao-Hua; Qiu, Xiao-Long; Zhang, Xingang; Qing, Feng-Ling Synthesis of L-beta-3'-deoxy-3',3'-difluoro-4'-thionucleosides. Organic letters, 2006, 8, 6083-6086 |
| 1506319 | CIF | C14 H18.38 F2.63 O2.63 P0.88 S3 | C 1 2/c 1 | 24.442; 13.34; 13.024 90; 95.52; 90 | 4226.9 | Durben, Stefan; Dienes, Yvonne; Baumgartner, Thomas Cationic dithieno[3,2-b:2',3'-d]phospholes: a new building block for luminescent, conjugated polyelectrolytes. Organic letters, 2006, 8, 5893-5896 |
| 1506320 | CIF | C40 H43 N3 O4 | P 65 | 23.721; 23.721; 12.93 90; 90; 120 | 6300.8 | Crisma, Marco; Toniolo, Claudio; Royo, Soledad; Jiménez, Ana I; Cativiela, Carlos A helical, aromatic, peptide nanotube. Organic letters, 2006, 8, 6091-6094 |
| 1506321 | CIF | C18 H16 Br F3 O4 | P 21 21 21 | 5.9829; 7.272; 41.691 90; 90; 90 | 1813.9 | Zhao, Jun-Ling; Liu, Li; Sui, Yong; Liu, Yu-Liang; Wang, Dong; Chen, Yong-Jun Catalytic and highly enantioselective Friedel-Crafts alkylation of aromatic ethers with trifluoropyruvate under solvent-free conditions. Organic letters, 2006, 8, 6127-6130 |
| 1506322 | CIF | C22 H30 Cl2 Cu N6 O2 | P 21 21 21 | 9.8623; 10.1661; 24.4608 90; 90; 90 | 2452.5 | Rasappan, Ramesh; Hager, Markus; Gissibl, Anja; Reiser, Oliver Highly enantioselective michael additions of indole to benzylidene malonate using simple bis(oxazoline) ligands: importance of metal/ligand ratio. Organic letters, 2006, 8, 6099-6102 |
| 1506323 | CIF | C56 H78 Cl4 Cu2 N18 O21 | P 1 | 12.0986; 12.7138; 13.3209 77.309; 81.44; 74.732 | 1919.4 | Rasappan, Ramesh; Hager, Markus; Gissibl, Anja; Reiser, Oliver Highly enantioselective michael additions of indole to benzylidene malonate using simple bis(oxazoline) ligands: importance of metal/ligand ratio. Organic letters, 2006, 8, 6099-6102 |
| 1506324 | CIF | C33 H56 F6 O P3 Rh | P 32 | 11.1077; 11.1077; 24.942 90; 90; 120 | 2665.1 | Yamamoto, Yoshikazu; Koizumi, Toru; Katagiri, Kosuke; Furuya, Yui; Danjo, Hiroshi; Imamoto, Tsuneo; Yamaguchi, Kentaro Facile synthesis of highly congested 1,2-diphosphinobenzenes from bis(phosphine)boronium salts. Organic letters, 2006, 8, 6103-6106 |
| 1506325 | CIF | C9 H17 Cl N2 | P 1 21/n 1 | 8.4032; 11.7073; 10.7526 90; 90.529; 90 | 1057.78 | Andre, M.; Loidl, J.; Laus, G.; Schottenberger, H.; Bentivoglio, G.; Wurst, K.; Ongania, K.-H. Ionic liquids as advantageous solvents for headspace gas chromatography of compounds with low vapor pressure. Analytical chemistry, 2005, 77, 702-705 |
| 1506326 | CIF | C9 H17 Cl N2 | R -3 :H | 28.3013; 28.3013; 7.1646 90; 90; 120 | 4969.8 | Andre, M.; Loidl, J.; Laus, G.; Schottenberger, H.; Bentivoglio, G.; Wurst, K.; Ongania, K.-H. Ionic liquids as advantageous solvents for headspace gas chromatography of compounds with low vapor pressure. Analytical chemistry, 2005, 77, 702-705 |
| 1506327 | CIF | C22 H27 N2 O11 Re | P 21 21 21 | 7.2693; 9.9472; 34.2689 90; 90; 90 | 2477.96 | Dumas, Cécile; Petrig, Jeannine; Frei, Luzia; Spingler, Bernhard; Schibli, Roger Functionalization of Glucose at Position C-3 for Transition Metal Coordination: Organo-Rhenium Complexes with Carbohydrate Skeletons Bioconjugate Chemistry, 2005, 16, 421 |
| 1506328 | CIF | C15 H20 N7 Re S2 | P 1 21/c 1 | 8.0008; 20.5058; 11.6366 90; 90.958; 90 | 1908.87 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506329 | CIF | C18.5 H15.5 Cl2 N7 O Re S2 | P 1 c 1 | 8.1375; 15.0204; 19.429 90; 95.29; 90 | 2364.66 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506330 | CIF | C14 H18 Cl N6 Re S3 | P -1 | 8.1062; 14.6072; 17.0107 82.086; 82.556; 83.238 | 1967.96 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506331 | CIF | C16 H15 Cl N7 Re S | P 1 21/c 1 | 14.7905; 14.7131; 8.4637 90; 91.068; 90 | 1841.5 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506332 | CIF | C28 H26 Cl N16 O Re2 S2 | P 1 21/c 1 | 10.7229; 15.3323; 20.6857 90; 91.622; 90 | 3399.5 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506333 | CIF | C12.5 H14 Cl4 N6 O5 Re | P 1 21/c 1 | 14.024; 13.1938; 13.2801 90; 112.906; 90 | 2263.5 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506334 | CIF | C24 H21 N8 O4 Re S2 | P -1 | 9.3544; 9.7712; 15.1811 104.631; 100.939; 99.008 | 1287.3 | Banerjee, Sangeeta R.; Maresca, Kevin P.; Stephenson, Karin A.; Valliant, John F.; Babich, John W.; Graham, Wendy A.; Barzana, Marlene; Dong, Qing; Fischman, Alan J.; Zubieta, Jon N,N-Bis(2-mercaptoethyl)methylamine: A New Coligand for Tc-99m Labeling of Hydrazinonicotinamide Peptides Bioconjugate Chemistry, 2005, 16, 885 |
| 1506335 | CIF | C7 H15 Cu N O6 | P c a 21 | 19.837; 7.084; 14.896 90; 90; 90 | 2093.3 | Skorik, Yury A.; Gomes, Carlos A. R.; Podberezskaya, Nina V.; Romanenko, Galina V.; Pinto, Luiz F.; Yatluk, Yury G. Complexation Models ofN-(2-Carboxyethyl)chitosans with Copper(II) Ions Biomacromolecules, 2005, 6, 189 |
| 1506336 | CIF | C25 H26 N2 O | P -1 | 9.9752; 10.434; 11.2679 90.172; 109.741; 109.322 | 1032.9 | Li, Weiwei; Lam, Yulin A Facile Solid-Phase Synthesis of 1,2,4,5-Tetrasubstituted Imidazoles Using Sodium Benzenesulfinate as a Traceless Linker Journal of Combinatorial Chemistry, 2005, 7, 644 |
| 1506337 | CIF | C16 H15 N3 O | P -1 | 8.7569; 12.5075; 12.7422 74.569; 86.623; 81.9 | 1331.55 | Li, Weiwei; Lam, Yulin A Facile Solid-Phase Synthesis of 1,2,4,5-Tetrasubstituted Imidazoles Using Sodium Benzenesulfinate as a Traceless Linker Journal of Combinatorial Chemistry, 2005, 7, 644 |
| 1506338 | CIF | C20 H20 N2 O | P -1 | 8.8589; 9.5619; 11.5289 111.301; 90.111; 115.935 | 803.03 | Li, Weiwei; Lam, Yulin A Facile Solid-Phase Synthesis of 1,2,4,5-Tetrasubstituted Imidazoles Using Sodium Benzenesulfinate as a Traceless Linker Journal of Combinatorial Chemistry, 2005, 7, 644 |
| 1506339 | CIF | C19 H16 N2 O2 S | P -1 | 7.706; 10.338; 12.191 109.742; 95.779; 111.614 | 821.2 | Le Bas, Marie-Delphine H.; McKinley, Neola F.; Hogan, Anne-Marie L.; O'Shea, Donal F. Imidazo[5,1-b]thiazol-3-ones/thiazin-4-ones: Synthesis and Reactivity Investigation for Library Generation Journal of Combinatorial Chemistry, 2005, 7, 503 |
| 1506340 | CIF | C19 H26 N4 O2 | P 1 21/c 1 | 17.164; 8.4372; 13.333 90; 99.752; 90 | 1902.9 | Fu, Han; Lam, Yulin Traceless Solid-Phase Synthesis of N1,N7-Disubstituted Purines Journal of Combinatorial Chemistry, 2005, 7, 734 |
| 1506341 | CIF | C17 H27 Br N4 O3 | P -1 | 11.841; 13.069; 13.905 74.71; 78.79; 86.66 | 2036 | Fu, Han; Lam, Yulin Traceless Solid-Phase Synthesis of N1,N7-Disubstituted Purines Journal of Combinatorial Chemistry, 2005, 7, 734 |
| 1506342 | CIF | C22 H17 F6 N3 O3 P Re | P 1 21/n 1 | 8.9203; 12.925; 21.104 90; 90.521; 90 | 2433.1 | Stoyanov, Stanislav R.; Villegas, John M.; Cruz, Arvin J.; Lockyear, Loranelle L.; Reibenspies, Joseph H.; Rillema, D. Paul Computational and Spectroscopic Studies of Re(I) Bipyridyl Complexes Containing 2,6-Dimethylphenylisocyanide (CNx) Ligand Journal of Chemical Theory and Computation, 2005, 1, 95 |
| 1506343 | CIF | C3 H1.5 Cl1.5 O1.5 | P 1 21/m 1 | 7.88; 6.795; 8.835 90; 115.02; 90 | 428.67 | Gong, Huijuan; You, Zhen; Xian, Qiming; Shen, Xing; Zou, Huixian; Huan, Fei; Xu, X. Study on the Structure and Mutagenicity of a New Disinfection Byproduct in Chlorinated Drinking Water Environmental Science & Technology, 2005, 39, 7499 |
| 1506344 | CIF | C19 H29 N O5 | P 1 21 1 | 6.866; 19.559; 7.04 90; 97.132; 90 | 938.1 | Simoni, Daniele; Rossi, Marcello; Bertolasi, Valerio; Roberti, Marinella; Pizzirani, Daniela; Rondanin, Riccardo; Baruchello, Riccardo; Invidiata, Francesco Paolo; Tolomeo, Manlio; Grimaudo, Stefania; Merighi, Stefania; Varani, Katia; Gessi, Stefania; Borea, Pier Andrea; Marino, Silvia; Cavallini, Sabrina; Bianchi, Clementina; Siniscalchi, Anna Synthesis and pharmacology of 6-substituted benztropines: discovery of novel dopamine uptake inhibitors possessing low binding affinity to the dopamine transporter. Journal of medicinal chemistry, 2005, 48, 3337-3343 |
| 1506345 | CIF | C30 H32 Cl3 N8 O2 Ru | C 1 c 1 | 17.681; 11.082; 16.738 90; 102.46; 90 | 3202.4 | Jakupec, Michael A.; Reisner, Erwin; Eichinger, Anna; Pongratz, Martina; Arion, Vladimir B.; Galanski, Markus; Hartinger, Christian G.; Keppler, Bernhard K. Redox-active antineoplastic ruthenium complexes with indazole: correlation of in vitro potency and reduction potential. Journal of medicinal chemistry, 2005, 48, 2831-2837 |
| 1506346 | CIF | C34 H36 Cl2 N8 O2 Ru | P -1 | 10.891; 13.279; 14.399 65.66; 69.04; 68.36 | 1710.8 | Jakupec, Michael A.; Reisner, Erwin; Eichinger, Anna; Pongratz, Martina; Arion, Vladimir B.; Galanski, Markus; Hartinger, Christian G.; Keppler, Bernhard K. Redox-active antineoplastic ruthenium complexes with indazole: correlation of in vitro potency and reduction potential. Journal of medicinal chemistry, 2005, 48, 2831-2837 |
| 1506347 | CIF | C21 H28 O3 | P 21 21 21 | 10.405; 16.508; 20.85 90; 90; 90 | 3581.3 | Veleiro, Adriana S.; Pecci, Adali; Monteserín, María C; Baggio, Ricardo; Garland, María T; Lantos, Carlos P.; Burton, Gerardo 6,19-Sulfur-bridged progesterone analogues with antiimmunosuppressive activity. Journal of medicinal chemistry, 2005, 48, 5675-5683 |
| 1506348 | CIF | C21 H28 O2 S | P 21 21 21 | 11.153; 12.65; 12.94 90; 90; 90 | 1825.6 | Veleiro, Adriana S.; Pecci, Adali; Monteserín, María C; Baggio, Ricardo; Garland, María T; Lantos, Carlos P.; Burton, Gerardo 6,19-Sulfur-bridged progesterone analogues with antiimmunosuppressive activity. Journal of medicinal chemistry, 2005, 48, 5675-5683 |
| 1506349 | CIF | C14 H16 Cu Fe N10 O5 S | P 1 21/n 1 | 13.157; 13.641; 14.205 90; 115.98; 90 | 2291.8 | Belicchi-Ferrari, Marisa; Bisceglie, Franco; Casoli, Claudio; Durot, Stéphanie; Morgenstern-Badarau, Irène; Pelosi, Giorgio; Pilotti, Elisabetta; Pinelli, Silvana; Tarasconi, Pieralberto Copper(II) and cobalt(III) pyridoxal thiosemicarbazone complexes with nitroprusside as counterion: syntheses, electronic properties, and antileukemic activity. Journal of medicinal chemistry, 2005, 48, 1671-1675 |
| 1506350 | CIF | C23 H34 Cu2 Fe N14 O11 S2 | P 1 21/n 1 | 13.946; 7.163; 18.389 90; 93.37; 90 | 1833.8 | Belicchi-Ferrari, Marisa; Bisceglie, Franco; Casoli, Claudio; Durot, Stéphanie; Morgenstern-Badarau, Irène; Pelosi, Giorgio; Pilotti, Elisabetta; Pinelli, Silvana; Tarasconi, Pieralberto Copper(II) and cobalt(III) pyridoxal thiosemicarbazone complexes with nitroprusside as counterion: syntheses, electronic properties, and antileukemic activity. Journal of medicinal chemistry, 2005, 48, 1671-1675 |
| 1506351 | CIF | C41 H60 Co2 Fe N22 O17 S4 | P -1 | 15.278; 13.533; 7.977 84.4; 76.78; 77.22 | 1563.9 | Belicchi-Ferrari, Marisa; Bisceglie, Franco; Casoli, Claudio; Durot, Stéphanie; Morgenstern-Badarau, Irène; Pelosi, Giorgio; Pilotti, Elisabetta; Pinelli, Silvana; Tarasconi, Pieralberto Copper(II) and cobalt(III) pyridoxal thiosemicarbazone complexes with nitroprusside as counterion: syntheses, electronic properties, and antileukemic activity. Journal of medicinal chemistry, 2005, 48, 1671-1675 |
| 1506352 | CIF | C28 H38 N O6 P | P 1 | 6.413; 13.141; 17.092 82.02; 86.3; 76.29 | 1385.1 | Albert, Rainer; Hinterding, Klaus; Brinkmann, Volker; Guerini, Danilo; Müller-Hartwieg, Constanze; Knecht, Helmut; Simeon, Corinne; Streiff, Markus; Wagner, Trixie; Welzenbach, Karl; Zécri, Frédéric; Zollinger, Markus; Cooke, Nigel; Francotte, Eric Novel immunomodulator FTY720 is phosphorylated in rats and humans to form a single stereoisomer. Identification, chemical proof, and biological characterization of the biologically active species and its enantiomer. Journal of medicinal chemistry, 2005, 48, 5373-5377 |
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