Crystallography Open Database

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7151958 CIFC9 H17 Cl4 Cu N5P -17.6673; 7.8804; 13.4349
101.599; 91.479; 91.095
794.67Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal
Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.
Organic & biomolecular chemistry, 2011, 9, 5703-5713
7151959 CIFC9 H17 Cl4 N5 ZnP -17.8356; 13.1475; 15.8482
76.546; 84.994; 81.751
1568.96Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal
Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.
Organic & biomolecular chemistry, 2011, 9, 5703-5713
7151960 CIFC26 H35 N5 O11 SP 21 21 218.5748; 14.9184; 23.0172
90; 90; 90
2944.4Shen, Fengjuan; Li, Xiaoliu; Zhang, Xiaoyuan; Yin, Qingmei; Qin, Zhanbin; Chen, Hua; Zhang, Jinchao; Ma, Zhaipu
Microwave-assisted synthesis of dinucleoside analogues containing a thiazolidin-4-one linkage via one-pot tandem Staudinger/aza-Wittig/cyclization.
Organic & biomolecular chemistry, 2011, 9, 5766-5772
7151961 CIFC25 H27 Br N2 OP 1 21/c 116.0335; 9.3932; 15.1
90; 109.749; 90
2140.4Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.
Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.
Organic & biomolecular chemistry, 2011, 9, 5104-5108
7151962 CIFC25 H27 Br N2 OP 1 21/c 18.197; 22.507; 12.208
90; 101.368; 90
2208.1Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.
Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.
Organic & biomolecular chemistry, 2011, 9, 5104-5108
7151963 CIFC27 H27 Br N2 O2 SP 1 21/c 113.9702; 9.4045; 18.4052
90; 94.432; 90
2410.9Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.
Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.
Organic & biomolecular chemistry, 2011, 9, 5104-5108
7151964 CIFC50 H62 N4 O9P 1 2/n 113.7253; 10.4969; 16.7159
90; 102.557; 90
2350.7Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.
Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.
Organic & biomolecular chemistry, 2011, 9, 5104-5108
7151965 CIFC24 H23 N3 O4P 21 21 219.903; 10.8311; 19.231
90; 90; 90
2062.7Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.
Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.
Organic & biomolecular chemistry, 2011, 9, 5104-5108
7151966 CIFC20 H28 N2 O6P 21 21 2111.3829; 12.3833; 13.4311
90; 90; 90
1893.2Chen, Jia; Chen, Jian-Jun; Yao, Xiaojun; Gao, Kun
Kopsihainanines A and B, two unusual alkaloids from Kopsia hainanensis.
Organic & biomolecular chemistry, 2011, 9, 5334-5336
7151967 CIFC37 H69 N5 O6 Si4P 21 21 219.84534; 13.7667; 35.643
90; 90; 90
4830.98Meng, Xiangtai; Moriuchi, Toshiyuki; Tohnai, Norimitsu; Miyata, Mikiji; Kawahata, Masatoshi; Yamaguchi, Kentaro; Hirao, Toshikazu
Synthesis and assembling properties of bioorganometallic cyclometalated Au(iii) alkynyls bearing guanosine moieties.
Organic & biomolecular chemistry, 2011, 9, 5633-5636
7151968 CIFC32 H42 N O2 P SiP b c n46.284; 12.2793; 11.1201
90; 90; 90
6319.9Oberg, Elisabet; Geng, Xue-Li; Santoni, Marie-Pierre; Ott, Sascha
C,C-Diacetylenic phosphaalkenes in palladium-catalyzed cross-coupling reactions.
Organic & biomolecular chemistry, 2011, 9, 6246-6255
7151969 CIFC22 H38 Cl2 Si4P 1 21/c 111.502; 11.404; 23.465
90; 93.2; 90
3073.1Oberg, Elisabet; Geng, Xue-Li; Santoni, Marie-Pierre; Ott, Sascha
C,C-Diacetylenic phosphaalkenes in palladium-catalyzed cross-coupling reactions.
Organic & biomolecular chemistry, 2011, 9, 6246-6255
7151970 CIFC10 H12 O4C 1 2/c 118.725; 10.407; 12.115
90; 122.302; 90
1995.5Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.
Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.
Organic & biomolecular chemistry, 2011, 9, 6312-6322
7151971 CIFC11 H16 O4P 1 21/n 16.1283; 8.0991; 22.952
90; 92.622; 90
1138Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.
Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.
Organic & biomolecular chemistry, 2011, 9, 6312-6322
7151972 CIFC7 H8 O4P 1 21/c 15.0397; 14.3513; 10.316
90; 98.118; 90
738.64Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.
Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.
Organic & biomolecular chemistry, 2011, 9, 6312-6322
7151973 CIFC11 H16 O4P 1 21/c 110.4595; 8.2649; 13.4821
90; 110.602; 90
1090.95Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.
Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.
Organic & biomolecular chemistry, 2011, 9, 6312-6322
7151974 CIFC87 H123 N7 O9P 1 21/c 116.1331; 37.634; 17.1581
90; 98.715; 90
10297.3Cornut, Damien; Marrot, Jérôme; Wouters, Johan; Jabin, Ivan
Acid-base modulation of a versatile heteroditopic calix[6]arene based receptor.
Organic & biomolecular chemistry, 2011, 9, 6373-6384
7151975 CIFC72 H70 N4 O2P 1 21/c 115.853; 15.5929; 25.462
90; 115.951; 90
5659.4Keller, Stephan; Yi, Chenyi; Li, Chen; Liu, Shi-Xia; Blum, Carmen; Frei, Gabriela; Sereda, Olha; Neels, Antonia; Wandlowski, Thomas; Decurtins, Silvio
Synthesis, structures, redox and photophysical properties of benzodifuran-functionalised pyrene and anthracene fluorophores.
Organic & biomolecular chemistry, 2011, 9, 6410-6416
7151976 CIFC68 H70 N4 O2P 1 21/c 113.7947; 9.0999; 22.2042
90; 105.631; 90
2684.2Keller, Stephan; Yi, Chenyi; Li, Chen; Liu, Shi-Xia; Blum, Carmen; Frei, Gabriela; Sereda, Olha; Neels, Antonia; Wandlowski, Thomas; Decurtins, Silvio
Synthesis, structures, redox and photophysical properties of benzodifuran-functionalised pyrene and anthracene fluorophores.
Organic & biomolecular chemistry, 2011, 9, 6410-6416
7151977 CIFC68 H70 N4 O2P 1 21/c 112.0856; 17.2822; 16.4631
90; 129.164; 90
2666.1Keller, Stephan; Yi, Chenyi; Li, Chen; Liu, Shi-Xia; Blum, Carmen; Frei, Gabriela; Sereda, Olha; Neels, Antonia; Wandlowski, Thomas; Decurtins, Silvio
Synthesis, structures, redox and photophysical properties of benzodifuran-functionalised pyrene and anthracene fluorophores.
Organic & biomolecular chemistry, 2011, 9, 6410-6416
7151978 CIFC97 H28 Cl6P -114.5009; 16.212; 14.5134
97.198; 99.991; 86.541
3331.1Hashiguchi, Masahiko; Watanabe, Kazuhiro; Matsuo, Yutaka
Facile fullerene modification: FeCl(3)-mediated quantitative conversion of C(60) to polyarylated fullerenes containing pentaaryl(chloro)[60]fullerenes.
Organic & biomolecular chemistry, 2011, 9, 6417-6421
7151979 CIFC25 H24 Br N O3R 3 :H20.3125; 20.3125; 15.9673
90; 90; 120
5705.4Ni, Cheng-Yan; Kan, Sha-Sha; Liu, Quan-Zhong; Kang, Tai-Ran
Diastereoselective and enantioselective capture of chiral zinc enolate using nitroolefins: a rapid access to chiral γ-nitro carbonyl compounds.
Organic & biomolecular chemistry, 2011, 9, 6211-6214
7151980 CIFC32 H33 N O2 SP 21 21 217.4163; 14.0432; 25.9274
90; 90; 90
2700.3Ni, Cheng-Yan; Kan, Sha-Sha; Liu, Quan-Zhong; Kang, Tai-Ran
Diastereoselective and enantioselective capture of chiral zinc enolate using nitroolefins: a rapid access to chiral γ-nitro carbonyl compounds.
Organic & biomolecular chemistry, 2011, 9, 6211-6214
7151981 CIFC14 H10 N2 OC 1 2/c 119.4658; 7.8017; 15.153
90; 110.941; 90
2149.23Molnár, Annamária; Kapros, Anita; Párkányi, László; Mucsi, Zoltán; Vlád, Gábor; Hermecz, István
Suzuki-Miyaura cross-coupling reactions of halo derivatives of 4H-pyrido[1,2-a]pyrimidin-4-ones.
Organic & biomolecular chemistry, 2011, 9, 6559-6565
7151982 CIFC63 H66 F9 N3 O9C 1 c 116.3465; 23.3116; 17.2917
90; 116.247; 90
5909.9Ni, Xin-Long; Rahman, Shofuir; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko
Novel ion-pair receptors based on hexahomotrioxacalix[3]arene derivatives.
Organic & biomolecular chemistry, 2011, 9, 6535-6541
7151983 CIFC60 H66 F3 N3 O9P -111.411; 15.482; 16.504
92.63; 97.69; 106.65
2757.4Ni, Xin-Long; Rahman, Shofuir; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko
Novel ion-pair receptors based on hexahomotrioxacalix[3]arene derivatives.
Organic & biomolecular chemistry, 2011, 9, 6535-6541
7151984 CIFC33 H42 Cl2 O17P 21 21 2111.2799; 15.1788; 21.4815
90; 90; 90
3678Nepogodiev, Sergey A.; Fais, Margherita; Hughes, David L.; Field, Robert A.
Synthesis of apiose-containing oligosaccharide fragments of the plant cell wall: fragments of rhamnogalacturonan-II side chains A and B, and apiogalacturonan.
Organic & biomolecular chemistry, 2011, 9, 6670-6684
7151985 CIFC159 H215 N8 O50.5 Rh4P 21 21 228.965; 36.811; 15.395
90; 90; 90
16415Mattiza, Jens T.; Fohrer, Joerg G. G.; Duddeck, Helmut; Gardiner, Michael G.; Ghanem, Ashraf
Optimizing dirhodium(ii) tetrakiscarboxylates as chiral NMR auxiliaries.
Organic & biomolecular chemistry, 2011, 9, 6542-6550
7151986 CIFC18 H15 Cl2 N O3P 1 21/c 19.823; 11.349; 15.262
90; 97.43; 90
1687.1Xie, Peizhong; Huang, You; Lai, Wenqing; Meng, Xiangtai; Chen, Ruyu
Bifunctional phosphine-catalyzed cross-Rauhut-Currier/Michael/aldol condensation triple domino reaction: synthesis of functionalized cyclohexenes.
Organic & biomolecular chemistry, 2011, 9, 6707-6714
7151987 CIFC18 H15 Cl2 N O3P -16.9697; 9.891; 13.577
91.1; 103.89; 109.35
852.3Xie, Peizhong; Huang, You; Lai, Wenqing; Meng, Xiangtai; Chen, Ruyu
Bifunctional phosphine-catalyzed cross-Rauhut-Currier/Michael/aldol condensation triple domino reaction: synthesis of functionalized cyclohexenes.
Organic & biomolecular chemistry, 2011, 9, 6707-6714
7151988 CIFC23 H22 N2 O4P 659.7445; 9.7445; 37.3937
90; 90; 120
3075.02Cowley, Andrew R.; Hill, Thomas J.; Kocis, Petr; Moloney, Mark G.; Stevenson, Robert D.; Thompson, Amber L.
Spirocyclic systems derived from pyroglutamic acid.
Organic & biomolecular chemistry, 2011, 9, 7042-7056
7151989 CIFC17 H18 N2 O4P 1 21 110.5991; 6.3352; 11.6093
90; 93.8504; 90
777.77Cowley, Andrew R.; Hill, Thomas J.; Kocis, Petr; Moloney, Mark G.; Stevenson, Robert D.; Thompson, Amber L.
Spirocyclic systems derived from pyroglutamic acid.
Organic & biomolecular chemistry, 2011, 9, 7042-7056
7151990 CIFC15 H27 N O4P 1 21 110.34; 9.733; 18.073
90; 106.331; 90
1745.5Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.
Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.
Organic & biomolecular chemistry, 2011, 9, 6566-6574
7151991 CIFC17 H30 N2 O5P 113.3376; 14.03; 17.956
88.064; 70.67; 73.874
3039.6Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.
Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.
Organic & biomolecular chemistry, 2011, 9, 6566-6574
7151992 CIFC13 H24 N O4P 1 21/c 110.669; 9.092; 15.882
90; 90.923; 90
1540.4Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.
Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.
Organic & biomolecular chemistry, 2011, 9, 6566-6574
7151993 CIFC15 H27 N O4P 21 21 2110.153; 10.273; 16.191
90; 90; 90
1688.7Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.
Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.
Organic & biomolecular chemistry, 2011, 9, 6566-6574
7151994 CIFC23 H40 N2 O5P 15.053; 9.812; 13.498
73.64; 84.653; 78.566
628.9Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.
Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.
Organic & biomolecular chemistry, 2011, 9, 6566-6574
7151995 CIFC14 H25 N O4P 21 21 219.978; 10.083; 16.904
90; 90; 90
1700.7Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.
Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.
Organic & biomolecular chemistry, 2011, 9, 6566-6574
7151996 CIFC21 H14 N2C 1 2/c 127.199; 6.8079; 16.539
90; 107.39; 90
2922.5Alajarin, Mateo; Bonillo, Baltasar; Ortin, Maria-Mar; Orenes, Raul-Angel; Vidal, Angel
Unprecedented intramolecular [3 + 2] cycloadditions of azido-ketenimines and azido-carbodiimides. Synthesis of indolo[1,2-a]quinazolines and tetrazolo[5,1-b]quinazolines.
Organic & biomolecular chemistry, 2011, 9, 6741-6749
7151997 CIFC43 H34 Cl2 N4 O2C 1 2/c 119.4794; 12.5963; 13.921
90; 98.538; 90
3377.9Alajarin, Mateo; Bonillo, Baltasar; Ortin, Maria-Mar; Orenes, Raul-Angel; Vidal, Angel
Unprecedented intramolecular [3 + 2] cycloadditions of azido-ketenimines and azido-carbodiimides. Synthesis of indolo[1,2-a]quinazolines and tetrazolo[5,1-b]quinazolines.
Organic & biomolecular chemistry, 2011, 9, 6741-6749
7151998 CIFC21 H20 N2 O6P 1 21/n 111.7115; 14.9304; 11.9095
90; 118.098; 90
1837Dou, Guolan; Shi, Daqing
One pot synthesis of cis-bispyrimidodiazepinone derivatives via low-valent titanium reagent (TiCl(4)/Sm).
Organic & biomolecular chemistry, 2011, 9, 7065-7070
7151999 CIFC15 H19 O6 PP -17.779; 8.9198; 12.746
99.79; 105.99; 107.38
780.1Yu, Jipan; Zhao, Xiaona; Miao, Zhiwei; Chen, Ruyu
Highly diastereoselective vinylogous Mukaiyama aldol reaction of α-keto phosphonates with 2-(trimethylsilyloxy)furan catalyzed by Cu(OTf)(2).
Organic & biomolecular chemistry, 2011, 9, 6721-6726
7152000 CIFC43 H44 N4 Ni O6 SP 1 21 19.859; 17.767; 12.361
90; 91.25; 90
2164.7Song, Guowei; Jin, Meihong; Li, Zhenjiang; Ouyang, Pingkai
Asymmetric synthesis of α,β-diamino acid derivates via Mannich-type reactions of a chiral Ni(ii) complex of glycine with N-tosyl imines.
Organic & biomolecular chemistry, 2011, 9, 7144-7150
7152001 CIFC32 H23 F17 GeP -16.09459; 7.56496; 33.7307
84.8926; 87.4794; 88.9974
1547.35Carr, James L.; Sejberg, Jimmy J. P.; Saab, Fabienne; Holdom, Mary D.; Davies, Anna M.; White, Andrew J. P.; Leatherbarrow, Robin J.; Beavil, Andrew J.; Sutton, Brian J.; Lindell, Stephen D.; Spivey, Alan C.
Synthesis of the C19 methyl ether of aspercyclide A via germyl-Stille macrocyclisation and ELISA evaluation of both enantiomers following optical resolution.
Organic & biomolecular chemistry, 2011, 9, 6814-6824
7152002 CIFC38 H40 O4 S6P 1 21/c 15.8122; 17.1465; 36.266
90; 93.295; 90
3608.3Das, Soumyajit; Bedi, Anjan; Krishna, G. Rama; Reddy, C. Malla; Zade, Sanjio S.
Cyclopenta[c]selenophene based cooligomers and their polymers: comparative study with thiophene analogues.
Organic & biomolecular chemistry, 2011, 9, 6963-6972
7152003 CIFC19 H18 Br2 O2 S2 SeP 1 21/n 15.7974; 17.042; 41.927
90; 90.92; 90
4141.8Das, Soumyajit; Bedi, Anjan; Krishna, G. Rama; Reddy, C. Malla; Zade, Sanjio S.
Cyclopenta[c]selenophene based cooligomers and their polymers: comparative study with thiophene analogues.
Organic & biomolecular chemistry, 2011, 9, 6963-6972
7152004 CIFC25 H18 N2 O5P 1 21/c 116.814; 13.493; 8.7591
90; 100.732; 90
1952.4Kudale, Amit A.; Miller, David O.; Dawe, Louise N.; Bodwell, Graham J.
Intramolecular Povarov reactions involving 3-aminocoumarins.
Organic & biomolecular chemistry, 2011, 9, 7196-7206
7152005 CIFC51 H62 Br2 O10C 2 2 2116.4686; 16.933; 36.391
90; 90; 90
10148Liu, Luzhi; Cao, Derong; Jin, Yi; Tao, Hongqi; Kou, Yuhui; Meier, Herbert
Efficient synthesis of copillar[5]arenes and their host-guest properties with dibromoalkanes.
Organic & biomolecular chemistry, 2011, 9, 7007-7010
7152006 CIFC28 H34 N2 O12P b c a7.6651; 13.1131; 29.874
90; 90; 90
3002.7Wang, Liang; Xia, Xu-Dong; Guo, Wei; Chen, Jia-Rong; Xiao, Wen-Jing
Palladium-catalyzed C-H acetoxylation of 2-methoxyimino-2-aryl-acetates and acetamides.
Organic & biomolecular chemistry, 2011, 9, 6895-6898
7152007 CIFC16 H16 N4P -19.636; 9.93; 14.63
88.48; 85.747; 80.272
1375.8Yu, Xingxin; Yang, Qin; Lou, Honglei; Peng, Yiyuan; Wu, Jie
An efficient approach to pyrazolo[5,1-a]isoquinolin-2-amines via a silver(i)-catalyzed three-component reaction of 2-alkynylbenzaldehyde, sulfonohydrazide, and nitrile.
Organic & biomolecular chemistry, 2011, 9, 7033-7037

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