Crystallography Open Database

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7153554 CIFC14 H15 N O2P 1 21/n 17.607; 16.348; 9.994
90; 110.8; 90
1161.8Guo, Jiajia; Sun, Xiaoyang; Yu, Shouyun
Diastereoselective synthesis of epoxide-fused benzoquinolizidine derivatives using intramolecular domino aza-Michael addition/Darzens reaction.
Organic & biomolecular chemistry, 2014, 12, 265-268
7153555 CIFC26 H19 N3P 1 21/c 19.846; 26.3882; 7.7624
90; 105.68; 90
1941.76Zhou, Wang; Yang, Youqing; Wang, Zhiwei; Deng, Guo-Jun
Rhodium-catalyzed intermolecular hydroarylation of internal alkynes with N-1-phenylbenzotriazoles.
Organic & biomolecular chemistry, 2014, 12, 251-254
7153556 CIFC17 H11 Br N2 OP 1 21/c 114.5336; 6.3146; 15.7054
90; 108.49; 90
1366.94Zhang, Xiaofei; He, Qian; Xiang, Haoyue; Song, Shanshan; Miao, Zehong; Yang, Chunhao
Rapid access to α-carbolines via a one-pot tandem reaction of α,β-unsaturated ketones with 2-nitrophenylacetonitrile and the anti-proliferative activities of the products.
Organic & biomolecular chemistry, 2014, 12, 355-361
7153557 CIFC19 H16 N2P -14.8242; 12.372; 12.693
104.81; 95.57; 90.93
728.3Zhang, Xiaofei; He, Qian; Xiang, Haoyue; Song, Shanshan; Miao, Zehong; Yang, Chunhao
Rapid access to α-carbolines via a one-pot tandem reaction of α,β-unsaturated ketones with 2-nitrophenylacetonitrile and the anti-proliferative activities of the products.
Organic & biomolecular chemistry, 2014, 12, 355-361
7153558 CIFC12 H21 O3.5C 1 2/c 125.6423; 6.0433; 16.8338
90; 108.536; 90
2473.3Duplan, Vincent; Serba, Christelle; Garcia, Jose; Valot, Gaëlle; Barluenga, Sofia; Hoerlé, Mélanie; Cuendet, Muriel; Winssinger, Nicolas
Synthesis of sesquiterpene-inspired derivatives designed for covalent binding and their inhibition of the NF-κB pathway.
Organic & biomolecular chemistry, 2014, 12, 370-375
7153559 CIFC30 H33 N4 O2P 1 21 110.3743; 12.098; 11.1576
90; 105.03; 90
1352.5Mahanta, Sanjeev P.; Panda, Pradeepta K.
5,10-Diacylcalix[4]pyrroles: synthesis and anion binding studies.
Organic & biomolecular chemistry, 2014, 12, 278-285
7153560 CIFC8 H11 N O2P -18.37; 10.24; 10.52
95.85; 110.15; 112.75
751Mahanta, Sanjeev P.; Panda, Pradeepta K.
5,10-Diacylcalix[4]pyrroles: synthesis and anion binding studies.
Organic & biomolecular chemistry, 2014, 12, 278-285
7153561 CIFC20 H23 N3 O2P -18.4855; 10.2487; 11.0122
87.534; 76.273; 85.501
927.2Mahanta, Sanjeev P.; Panda, Pradeepta K.
5,10-Diacylcalix[4]pyrroles: synthesis and anion binding studies.
Organic & biomolecular chemistry, 2014, 12, 278-285
7153562 CIFC153 H154 Cl14 Ir4 N8 O12P 1 21/n 124.9384; 12.5149; 26.26
90; 111.146; 90
7643.9Muntaner, Jaime G.; Casarrubios, Luis; Sierra, Miguel A.
Synthesis of new bioorganometallic Ir- and Rh-complexes having β-lactam containing ligands.
Organic & biomolecular chemistry, 2014, 12, 286-297
7153563 CIFC37 H36 Cl N2 O3 RhR -3 :H32.2169; 32.2169; 20.2356
90; 90; 120
18189.2Muntaner, Jaime G.; Casarrubios, Luis; Sierra, Miguel A.
Synthesis of new bioorganometallic Ir- and Rh-complexes having β-lactam containing ligands.
Organic & biomolecular chemistry, 2014, 12, 286-297
7153564 CIFC52 H53 Cl4 Ir2 N3 O2P 1 21/n 119.8758; 12.678; 23.5977
90; 94.222; 90
5930.1Muntaner, Jaime G.; Casarrubios, Luis; Sierra, Miguel A.
Synthesis of new bioorganometallic Ir- and Rh-complexes having β-lactam containing ligands.
Organic & biomolecular chemistry, 2014, 12, 286-297
7153565 CIFC37 H37 Cl3 N2 SP n a 2123.252; 8.8725; 16.3422
90; 90; 90
3371.5Lash, Timothy D.; El-Beck, Jessica A; Ferrence, Gregory M.
Synthesis, structural characterization and reactivity of heteroazuliporphyrins.
Organic & biomolecular chemistry, 2014, 12, 316-329
7153566 CIFC37 H37 Cl3 N2 SeP 1 21/n 18.1545; 26.714; 15.641
90; 104.854; 90
3293.4Lash, Timothy D.; El-Beck, Jessica A; Ferrence, Gregory M.
Synthesis, structural characterization and reactivity of heteroazuliporphyrins.
Organic & biomolecular chemistry, 2014, 12, 316-329
7153567 CIFC7 H5 Br N2 O2P b c a12.8346; 7.4175; 17.3968
90; 90; 90
1656.2Lone, Ali Mohd; Bhat, Bilal Ahmad
Metal free stereoselective synthesis of functionalized enamides.
Organic & biomolecular chemistry, 2014, 12, 242-246
7153568 CIFC36 H38 Cl2 N10 O13C 1 2/c 112.2611; 18.2064; 17.7004
90; 100.734; 90
3882.1Caio, João M; Esteves, Teresa; Carvalho, Silvia; Moiteiro, Cristina; Félix, Vítor
Azacalix[2]arene[2]triazine-based receptors bearing carboxymethyl pendant arms on nitrogen bridges: synthesis and evaluation of their coordination ability towards copper(II).
Organic & biomolecular chemistry, 2014, 12, 589-599
7153569 CIFC38 H48 N12 O9P -110.6377; 12.7007; 15.6556
96.879; 90.055; 106.439
2012.75Caio, João M; Esteves, Teresa; Carvalho, Silvia; Moiteiro, Cristina; Félix, Vítor
Azacalix[2]arene[2]triazine-based receptors bearing carboxymethyl pendant arms on nitrogen bridges: synthesis and evaluation of their coordination ability towards copper(II).
Organic & biomolecular chemistry, 2014, 12, 589-599
7153570 CIFC44 H66 Cl6 N12P 1 21/c 111.5804; 14.7466; 29.1684
90; 90.758; 90
4980.7Caio, João M; Esteves, Teresa; Carvalho, Silvia; Moiteiro, Cristina; Félix, Vítor
Azacalix[2]arene[2]triazine-based receptors bearing carboxymethyl pendant arms on nitrogen bridges: synthesis and evaluation of their coordination ability towards copper(II).
Organic & biomolecular chemistry, 2014, 12, 589-599
7153571 CIFC29 H26 Br N O5P 1 21 19.2088; 11.1545; 13.3119
90; 106.479; 90
1311.23Ramachary, Dhevalapally B.; Prasad, M. Shiva; Laxmi, S. Vijaya; Madhavachary, R.
Asymmetric synthesis of drug-like spiro[chroman-3,3'-indolin]-2'-ones through aminal-catalysis.
Organic & biomolecular chemistry, 2014, 12, 574-580
7153572 CIFC10 H8 F2 OC 1 2/c 137.981; 3.8785; 11.276
90; 97.157; 90
1648.1Zhang, He; Lin, Jin-Hong; Xiao, Ji-Chang; Gu, Yu-Cheng
Rh-catalyzed allylic C-F bond activation: the stereoselective synthesis of trisubstituted monofluoroalkenes and a mechanism study.
Organic & biomolecular chemistry, 2014, 12, 581-588
7153573 CIFC26 H18 I N OP -19.6284; 11.7266; 19.1651
75.073; 77.631; 87.141
2042.31Wang, Li-Jing; Zhu, Hai-Tao; Qiu, Yi-Feng; Liu, Xue-Yuan; Liang, Yong-Min
Electrophilic ipso-iodocyclization of N-benzyl-N-(1-naphthyl)propiolamides: synthesis of complex polycyclic lactams.
Organic & biomolecular chemistry, 2014, 12, 643-650
7153574 CIFC22 H16 I N OP b c a10.5172; 17.5717; 20.0963
90; 90; 90
3713.9Wang, Li-Jing; Zhu, Hai-Tao; Qiu, Yi-Feng; Liu, Xue-Yuan; Liang, Yong-Min
Electrophilic ipso-iodocyclization of N-benzyl-N-(1-naphthyl)propiolamides: synthesis of complex polycyclic lactams.
Organic & biomolecular chemistry, 2014, 12, 643-650
7153575 CIFC28 H38 O8P 1 21/c 19.569; 8.0724; 17.2904
90; 96.872; 90
1326Buccini, Marco; Punch, Kathryn A.; Kaskow, Belinda; Flematti, Gavin R.; Skelton, Brian W.; Abraham, Lawrence J.; Piggott, Matthew J.
Ethynylbenzenoid metabolites of Antrodia camphorata: synthesis and inhibition of TNF expression.
Organic & biomolecular chemistry, 2014, 12, 1100-1113
7153576 CIFC29 H32 O9P 1 21 17.3517; 18.103; 10.012
90; 96.47; 90
1324Buccini, Marco; Punch, Kathryn A.; Kaskow, Belinda; Flematti, Gavin R.; Skelton, Brian W.; Abraham, Lawrence J.; Piggott, Matthew J.
Ethynylbenzenoid metabolites of Antrodia camphorata: synthesis and inhibition of TNF expression.
Organic & biomolecular chemistry, 2014, 12, 1100-1113
7153577 CIFC20 H12 N4 O4 S2P 1 21/c 18.987; 13.788; 15.365
90; 103.787; 90
1849.1Pal, Suman; Hatai, Joydev; Samanta, Mousumi; Shaurya, Alok; Bandyopadhyay, Subhajit
A highly selective chemodosimeter for fast detection and intracellular imaging of Hg(2+) ions based on a dithiocarbamate-isothiocyanate conversion in aqueous ethanol.
Organic & biomolecular chemistry, 2014, 12, 1072-1078
7153578 CIFC46 H46 N4 O5P -18.9744; 18.096; 24.959
97.516; 99.857; 93.864
3942.5Mei, Liang-Yong; Tang, Xiang-Ying; Shi, Min
Rhodium-catalyzed three-component reaction of 3-diazooxindoles with indoles and isatin-derived ketimines: a facile and versatile approach to functionalized 3,3',3''-trisindoles.
Organic & biomolecular chemistry, 2014, 12, 1149-1156
7153579 CIFC32 H24 F6 N2P -110.4678; 11.7231; 11.8283
69.655; 86.031; 80.188
1341Zhang, Lisi; Li, Yajun; Zhang, Li; Wu, Yongming
Vicinal bis(trifluoroacetimidoyl chloride)s: novel building blocks for the synthesis of benzo-fused eight-membered rings via [2 + 2 + 2] cycloadditions.
Organic & biomolecular chemistry, 2014, 12, 1040-1043
7153580 CIFC24 H31 Cl2 Mn N5 OP 1 21 19.567; 15.054; 9.7671
90; 119.292; 90
1226.8Ilyashenko, Gennadiy; De Faveri, Giorgio; Follier, Thomas; Al-Safadi, Rawan; Motevalli, Majid; Watkinson, Michael
Catalytic and mechanistic studies into the epoxidation of styrenes using manganese complexes of structurally similar polyamine ligands.
Organic & biomolecular chemistry, 2014, 12, 1124-1134
7153581 CIFC18 H17 F3 N2 O5P 1 21 19.293; 9.873; 10.265
90; 98.175; 90
932.2Liu, Feng-Lei; Chen, Jia-Rong; Feng, Bin; Hu, Xiao-Qiang; Ye, Li-Hua; Lu, Liang-Qiu; Xiao, Wen-Jing
Enantioselective organocatalytic oxa-Michael addition of oximes to β-CF3-β-disubstituted nitroalkenes: efficient synthesis of β-amino-α-trifluoromethyl alcohols.
Organic & biomolecular chemistry, 2014, 12, 1057-1060
7153582 CIFC16 H13 N OP 1 21/c 19.286; 11.358; 11.827
90; 98.495; 90
1233.7Basavaiah, Deevi; Veeraraghavaiah, Gorre; Badsara, Satpal Singh
Ketones as electrophiles in two component Baylis-Hillman reaction: a facile one-pot synthesis of substituted indolizines.
Organic & biomolecular chemistry, 2014, 12, 1551-1555
7153583 CIFC20 H19 N O2P -19.1844; 9.6681; 10.4799
81.098; 65.775; 79.753
831.62Basavaiah, Deevi; Veeraraghavaiah, Gorre; Badsara, Satpal Singh
Ketones as electrophiles in two component Baylis-Hillman reaction: a facile one-pot synthesis of substituted indolizines.
Organic & biomolecular chemistry, 2014, 12, 1551-1555
7153584 CIFC22 H17 N OP 1 21/c 110.5099; 17.731; 9.3383
90; 115.207; 90
1574.5Basavaiah, Deevi; Veeraraghavaiah, Gorre; Badsara, Satpal Singh
Ketones as electrophiles in two component Baylis-Hillman reaction: a facile one-pot synthesis of substituted indolizines.
Organic & biomolecular chemistry, 2014, 12, 1551-1555
7153585 CIFC12 H13 N O2P b c a14.886; 8.048; 17.59
90; 90; 90
2107.3Basavaiah, Deevi; Veeraraghavaiah, Gorre; Badsara, Satpal Singh
Ketones as electrophiles in two component Baylis-Hillman reaction: a facile one-pot synthesis of substituted indolizines.
Organic & biomolecular chemistry, 2014, 12, 1551-1555
7153586 CIFC16 H19 N O3P 1 21 14.9759; 13.292; 10.625
90; 90.818; 90
702.7Basavaiah, Deevi; Veeraraghavaiah, Gorre; Badsara, Satpal Singh
Ketones as electrophiles in two component Baylis-Hillman reaction: a facile one-pot synthesis of substituted indolizines.
Organic & biomolecular chemistry, 2014, 12, 1551-1555
7153587 CIFC25 H25 N2 O6 PP 21 21 218.901; 12.206; 22.343
90; 90; 90
2427.5George, Jimil; Sridhar, B.; Reddy, B. V. Subba
First example of quinine-squaramide catalyzed enantioselective addition of diphenyl phosphite to ketimines derived from isatins.
Organic & biomolecular chemistry, 2014, 12, 1595-1602
7153588 CIFC15 H11 B F2 O4P 1 21/n 17.3288; 19.338; 10.3913
90; 103.117; 90
1434.3Bai, Guifeng; Yu, Changjiang; Cheng, Chi; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan
Syntheses and photophysical properties of BF2 complexes of curcumin analogues.
Organic & biomolecular chemistry, 2014, 12, 1618-1626
7153589 CIFC23 H19 B F2 O2C 1 2/c 116.957; 11.8082; 9.9913
90; 95.18; 90
1992.4Bai, Guifeng; Yu, Changjiang; Cheng, Chi; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan
Syntheses and photophysical properties of BF2 complexes of curcumin analogues.
Organic & biomolecular chemistry, 2014, 12, 1618-1626
7153590 CIFC19 H28 N2 O4P 1 21 18.999; 8.057; 14.015
90; 105.34; 90
980Sartori, Andrea; Dell'amico, Luca; Battistini, Lucia; Curti, Claudio; Rivara, Silvia; Pala, Daniele; Kerry, Philip S.; Pelosi, Giorgio; Casiraghi, Giovanni; Rassu, Gloria; Zanardi, Franca
Synthesis, structure and inhibitory activity of a stereoisomer of oseltamivir carboxylate.
Organic & biomolecular chemistry, 2014, 12, 1561-1569
7153591 CIFC18 H17 N O3P 21 21 219.3972; 16.1308; 19.6022
90; 90; 90
2971.39Nandakumar, Avanashiappan; Kiruthika, Selvarangam E.; Naveen, Kanagaraj; Perumal, Paramasivan Thirumalai
Pd(0)-catalyzed regio- and stereoselective cyclization of alkynes: selective synthesis of (E)-4-(isobenzofuran-1(3H)-ylidene)-1,2,3,4-tetrahydroisoquinolines and aze/oxepinoindoles.
Organic & biomolecular chemistry, 2014, 12, 876-880
7153592 CIFC78 H80 Cl4 F12 N4 O4 S4 ZnC 1 2/c 134.635; 8.5799; 27.476
90; 92.652; 90
8156.2Ordronneau, Lucie; Boixel, Julien; Aubert, Vincent; Vidal, Matias S.; Moya, Sergio; Aguirre, Pedro; Toupet, Loic; Williams, J. A. Gareth; Le Bozec, Hubert; Guerchais, Véronique
New fluorescent bis-dithienylethene (DTE)-based bipyridines as reverse interrupters: single vs. double photochromism.
Organic & biomolecular chemistry, 2014, 12, 979-992
7153593 CIFC22 H18 O3P -110.8607; 11.4179; 15.2714
83.181; 80.292; 61.859
1644.3Poudel, Tej Narayan; Lee, Yong Rok
An advanced and novel one-pot synthetic method for diverse benzo[c]chromen-6-ones by transition-metal free mild base-promoted domino reactions of substituted 2-hydroxychalcones with β-ketoesters and its application to polysubstituted terphenyls.
Organic & biomolecular chemistry, 2014, 12, 919-930
7153594 CIFC17 H17 NC 1 2/c 159.25; 5.953; 22.55
90; 90.93; 90
7953Thomas, Claudia; Kataeva, Olga; Schmidt, Arndt W.; Knölker, Hans-Joachim
Regioselective prenylation of bromocarbazoles by palladium(0)-catalysed cross coupling - synthesis of O-methylsiamenol, O-methylmicromeline and carquinostatin A.
Organic & biomolecular chemistry, 2014, 12, 872-875
7153595 CIFC36 H56.5 N7 O9 SP 19.5236; 14.224; 16.822
109.168; 92.395; 100.881
2100.47De Poli, Matteo; Clayden, Jonathan
Thionoglycine as a multifunctional spectroscopic reporter of screw-sense preference in helical foldamers.
Organic & biomolecular chemistry, 2014, 12, 836-843
7153596 CIFC34 H53 N7 O9 SP 19.5005; 14.2234; 15.3975
89.612; 84.675; 78.797
2032.06De Poli, Matteo; Clayden, Jonathan
Thionoglycine as a multifunctional spectroscopic reporter of screw-sense preference in helical foldamers.
Organic & biomolecular chemistry, 2014, 12, 836-843
7153597 CIFC29 H20 N2 OP -110.233; 10.817; 10.864
62.661; 78.149; 89.945
1039.4Lu, Hui; Yang, Qin; Zhou, Yirong; Guo, Yanqin; Deng, Zhihong; Ding, Qiuping; Peng, Yiyuan
Cross-coupling/annulations of quinazolones with alkynes for access to fused polycyclic heteroarenes under mild conditions.
Organic & biomolecular chemistry, 2014, 12, 758-764
7153598 CIFC30 H22 N2 O2P -113.242; 13.337; 16.05
67.201; 81.584; 60.973
2281.8Lu, Hui; Yang, Qin; Zhou, Yirong; Guo, Yanqin; Deng, Zhihong; Ding, Qiuping; Peng, Yiyuan
Cross-coupling/annulations of quinazolones with alkynes for access to fused polycyclic heteroarenes under mild conditions.
Organic & biomolecular chemistry, 2014, 12, 758-764
7153599 CIFC24 H18 N2 OP c a 2113.5728; 18.3397; 14.2808
90; 90; 90
3554.8Lu, Hui; Yang, Qin; Zhou, Yirong; Guo, Yanqin; Deng, Zhihong; Ding, Qiuping; Peng, Yiyuan
Cross-coupling/annulations of quinazolones with alkynes for access to fused polycyclic heteroarenes under mild conditions.
Organic & biomolecular chemistry, 2014, 12, 758-764
7153600 CIFC18 H24 O4I 1 2 116.9067; 7.6918; 13.0515
90; 101.576; 90
1662.7Zhang, Hongrui; Li, Haifeng; Xue, Jijun; Chen, Rui; Li, Ying; Tang, Yu; Li, Chunxin
New facile enantio- and diastereo-selective syntheses of (-)-triptonide and (-)-triptolide.
Organic & biomolecular chemistry, 2014, 12, 732-736
7153601 CIFC17 H14 O4P 21 21 218.85; 12.001; 12.727
90; 90; 90
1351.7Zhang, Hongrui; Li, Haifeng; Xue, Jijun; Chen, Rui; Li, Ying; Tang, Yu; Li, Chunxin
New facile enantio- and diastereo-selective syntheses of (-)-triptonide and (-)-triptolide.
Organic & biomolecular chemistry, 2014, 12, 732-736
7153602 CIFC20 H17 Br N2 O4P 1 21 19.24936; 10.4306; 9.62893
90; 99.3592; 90
916.6Kano, Taichi; Takechi, Ryosuke; Kobayashi, Ryohei; Maruoka, Keiji
Chiral Brønsted acid-catalyzed enantioselective addition of indoles to ketimines.
Organic & biomolecular chemistry, 2014, 12, 724-727
7153603 CIFC16 H12 F3 NP -19.5871; 10.4916; 14.112
93.549; 109.31; 95.346
1327.3Das, Bimolendu; Kundu, Priyanka; Chowdhury, Chinmay
Facile synthesis of 2-arylmethylindoles and 2-vinylic indoles through palladium-catalyzed heteroannulations of 2-(2-propynyl)aniline and 2-(2-propynyl)tosylanilide.
Organic & biomolecular chemistry, 2014, 12, 741-748

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