Crystallography Open Database

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7156626 CIFC20 H23 N O3 SP b c a10.1298; 18.7025; 19.0521
90; 90; 90		3609.47Xu, Zhong-Qi; Zheng, Lin-Chuang; Li, Lin; Duan, Lili; Li, Yue-Ming
Metal-free oxysulfonylation and aminosulfonylation of alkenyl oximes: synthesis of sulfonylated isoxazolines and cyclic nitrones.
Organic & biomolecular chemistry, 2019, 17, 898-907
7156627 CIFC27 H20 N2 O2P 1 21/n 110.2176; 22.5674; 10.3343
90; 117.499; 90		2113.7Yang, Yajie; Huang, Jiaqi; Tan, Hailu; Kong, Lingkai; Wang, Mengdan; Yuan, Yang; Li, Yanzhong
Synthesis of cyano-substituted carbazoles via successive C-C/C-H cleavage.
Organic & biomolecular chemistry, 2019, 17, 958-965
7156628 CIFC27 H18 N2 O2P b c a6.9632; 20.434; 28.769
90; 90; 90		4093.4Yang, Yajie; Huang, Jiaqi; Tan, Hailu; Kong, Lingkai; Wang, Mengdan; Yuan, Yang; Li, Yanzhong
Synthesis of cyano-substituted carbazoles via successive C-C/C-H cleavage.
Organic & biomolecular chemistry, 2019, 17, 958-965
7156629 CIFC27 H18 N2 O2C 1 2/c 116.4009; 7.8236; 31.4855
90; 102.498; 90		3944.3Yang, Yajie; Huang, Jiaqi; Tan, Hailu; Kong, Lingkai; Wang, Mengdan; Yuan, Yang; Li, Yanzhong
Synthesis of cyano-substituted carbazoles via successive C-C/C-H cleavage.
Organic & biomolecular chemistry, 2019, 17, 958-965
7156630 CIFC28 H20 Br N O S0P 1 21/n 116.935; 7.2255; 18.475
90; 96.243; 90		2247.3Li, Shengxiao; Wu, Xin-Xing; Chen, Shufeng
Base-promoted direct synthesis of functionalized N-arylindoles via the cascade reactions of allenic ketones with indoles.
Organic & biomolecular chemistry, 2019, 17, 789-793
7156631 CIFC26 H22 O3 SP 1 21/c 110.9451; 7.79; 25.6813
90; 95.0229; 90		2181.24Rajeshkumar, Venkatachalam; Neelamegam, Chinnaraj; Anandan, Sambandam
A one-pot metal-free protocol for the synthesis of chalcogenated furans from 1,4-enediones and thiols.
Organic & biomolecular chemistry, 2019, 17, 982-991
7156632 CIFC17 H20 O2P -112.09; 12.294; 12.543
63.859; 70.176; 61.173		1447.1Yuan, Fu-Ru; Jiang, Fei; Chen, Ke-Wei; Mei, Guang-Jian; Wu, Qiong; Shi, Feng
Phosphine-catalyzed [4 + 2] cyclization of para-quinone methide derivatives with allenes.
Organic & biomolecular chemistry, 2019, 17, 2361-2369
7156633 CIFC15 H13 B N2 O3P 1 21/c 111.2723; 11.6971; 10.6896
90; 101.099; 90		1383.1Pappin, Brighid B.; Garget, Taylor A.; Healy, Peter C.; Simone, Michela I.; Kiefel, Milton J.; Houston, Todd A.
Facile amidinations of 2-aminophenylboronic acid promoted by boronate ester formation.
Organic & biomolecular chemistry, 2019, 17, 803-806
7156634 CIFC15 H16 B2 N2 O3P 1 21/c 111.3834; 10.8026; 12.7677
90; 103.589; 90		1526.1Pappin, Brighid B.; Garget, Taylor A.; Healy, Peter C.; Simone, Michela I.; Kiefel, Milton J.; Houston, Todd A.
Facile amidinations of 2-aminophenylboronic acid promoted by boronate ester formation.
Organic & biomolecular chemistry, 2019, 17, 803-806
7156635 CIFC14 H15 B N2 O3P 1 21/c 17.0763; 9.3343; 20.5929
90; 92.821; 90		1358.56Pappin, Brighid B.; Garget, Taylor A.; Healy, Peter C.; Simone, Michela I.; Kiefel, Milton J.; Houston, Todd A.
Facile amidinations of 2-aminophenylboronic acid promoted by boronate ester formation.
Organic & biomolecular chemistry, 2019, 17, 803-806
7156636 CIFC17 H17 B N2 O4P 1 21/c 114.4042; 9.165; 13.235
90; 113.504; 90		1602.2Pappin, Brighid B.; Garget, Taylor A.; Healy, Peter C.; Simone, Michela I.; Kiefel, Milton J.; Houston, Todd A.
Facile amidinations of 2-aminophenylboronic acid promoted by boronate ester formation.
Organic & biomolecular chemistry, 2019, 17, 803-806
7156637 CIFC51 H46 N2 O2P 1 21 119.3333; 13.2563; 24.6689
90; 108.952; 90		5979.6Gu, Haorui; Huang, Shaoying; Lin, Xufeng
Iron-catalyzed asymmetric intramolecular cyclopropanation reactions using chiral tetramethyl-1,1'-spirobiindane-based bisoxazoline (TMSI-BOX) ligands.
Organic & biomolecular chemistry, 2019, 17, 1154-1162
7156638 CIFC31 H34 Cl4 N2 O3 Ru2P 1 21/c 116.6576; 13.2575; 15.4394
90; 109.2; 90		3220Sundar, Saranya; Rengan, Ramesh
Direct synthesis of 2,4,5-trisubstituted imidazoles from primary alcohols by diruthenium(ii) catalysts under aerobic conditions.
Organic & biomolecular chemistry, 2019, 17, 1402-1409
7156639 CIFC98.25 H44.26 Cl0.77 F40 N8P 1 21/c 114.3847; 13.9665; 45.3662
90; 95.994; 90		9064.4Naito, Wakana; Urakawa, Kazuki; Sato, Ryuma; Shigeta, Yasuteru; Yasuda, Nobuhiro; Maeda, Hiromitsu
Quadruply N-methylated octaphyrin: a helical macrocycle exhibiting chiroptical properties and dynamic conformation changes correlated with helical and inner N-methyl orientations.
Organic & biomolecular chemistry, 2019, 17, 1163-1168
7156640 CIFC14 H14 Br N O6P b c a10.1785; 11.8901; 25.9949
90; 90; 90		3145.99Chen, Huiqing; Xie, Jia; Xing, Dong; Wang, Jinping; Tang, Jie; Yi, Zhengfang; Xia, Fei; Qiu, Wen-Wei; Yang, Fan
Diastereoselective synthesis of 3,3-disubstituted 3-nitro-4-chromanone derivatives as potential antitumor agents.
Organic & biomolecular chemistry, 2019, 17, 1062-1066
7156641 CIFC30 H12 F8 N2 O2P 1 21/c 113.2804; 8.7572; 21.1478
90; 106.224; 90		2361.53Brittain, William D. G.; Cobb, Steven L.
Tetrafluoropyridyl (TFP): a general phenol protecting group readily cleaved under mild conditions.
Organic & biomolecular chemistry, 2019, 17, 2110-2115
7156642 CIFC11 H4 F4 N2 O3P 1 21/c 17.4591; 10.786; 26.797
90; 91.012; 90		2155.6Brittain, William D. G.; Cobb, Steven L.
Tetrafluoropyridyl (TFP): a general phenol protecting group readily cleaved under mild conditions.
Organic & biomolecular chemistry, 2019, 17, 2110-2115
7156643 CIFC14 H9 Br O2P 21 21 216.1663; 11.1767; 16.5802
90; 90; 90		1142.69Carlos, Andressa M. M.; Stieler, Rafael; Lüdtke, Diogo S
Catalytic asymmetric synthesis of 3-aryl phthalides enabled by arylation-lactonization of 2-formylbenzoates.
Organic & biomolecular chemistry, 2019, 17, 283-289
7156644 CIFC31 H23 Br O3 S SeP 1 21/c 114.8543; 12.8156; 16.9743
90; 105.02; 90		3120.95Huang, Shengli; Chen, Zhili; Mao, Hui; Hu, Fangli; Li, Dongmei; Tan, Yu; Yang, Fengqing; Qin, Wenling
Metal-free difunctionalization of alkynes to access tetrasubstituted olefins through spontaneous selenosulfonylation of vinylidene ortho-quinone methide (VQM).
Organic & biomolecular chemistry, 2019, 17, 1121-1129
7156645 CIFC42 H40 N4 O6P -112.3922; 12.8577; 13.0925
81.681; 84.474; 62.506		1829.98Sengupta, Ayon; Maity, Suvendu; Mondal, Animesh; Ghosh, Prasanta; Rudra, Sonali; Mukhopadhyay, Chhanda
Pseudo five component reaction towards densely functionalized spiro[indole-3,2'-pyrrole] by picric acid, an efficient syn-diastereoselective catalyst: insight into the diastereoselection on C(sp<sup>3</sup>)-C(sp<sup>3</sup>) axial conformation.
Organic & biomolecular chemistry, 2019, 17, 1254-1265
7156646 CIFC39 H40 Cl2 N4 O5P -110.6167; 12.0022; 14.9533
101.198; 95.592; 103.53		1796.75Sengupta, Ayon; Maity, Suvendu; Mondal, Animesh; Ghosh, Prasanta; Rudra, Sonali; Mukhopadhyay, Chhanda
Pseudo five component reaction towards densely functionalized spiro[indole-3,2'-pyrrole] by picric acid, an efficient syn-diastereoselective catalyst: insight into the diastereoselection on C(sp<sup>3</sup>)-C(sp<sup>3</sup>) axial conformation.
Organic & biomolecular chemistry, 2019, 17, 1254-1265
7156647 CIFC43 H48 N4 O5P 1 21/n 111.5295; 20.4745; 17.1131
90; 104.29; 90		3914.74Sengupta, Ayon; Maity, Suvendu; Mondal, Animesh; Ghosh, Prasanta; Rudra, Sonali; Mukhopadhyay, Chhanda
Pseudo five component reaction towards densely functionalized spiro[indole-3,2'-pyrrole] by picric acid, an efficient syn-diastereoselective catalyst: insight into the diastereoselection on C(sp<sup>3</sup>)-C(sp<sup>3</sup>) axial conformation.
Organic & biomolecular chemistry, 2019, 17, 1254-1265
7156648 CIFC36 H35 N10 O6.5P 21 21 217.0714; 27.849; 6.8249
90; 90; 90		3244.7Calatrava-Pérez, Elena; Delente, Jason M.; Shanmugaraju, Sankarasekaran; Hawes, Chris S.; Williams, Clive D.; Gunnlaugsson, Thorfinnur; Scanlan, Eoin M.
Glycosylated naphthalimides and naphthalimide Tröger's bases as fluorescent aggregation probes for Con A.
Organic & biomolecular chemistry, 2019, 17, 2116-2125
7156649 CIFC38 H42 N2 O4P 6216.098; 16.098; 10.9326
90; 90; 120		2453.57Cheng, Wen-Fu; Chen, Ling-Yan; Xu, Fang-Fang; Lin, Wei-Yu; Ren, Xinfeng; Li, Ya
Organocatalytic asymmetric Michael addition between 3-subsituted oxindoles and enals catalyzed by camphor sulfonyl hydrazine.
Organic & biomolecular chemistry, 2019, 17, 885-891
7156650 CIFC120 H164 N20 O18F d d 227.0176; 36.9735; 14.7072
90; 90; 90		14691.5Chávez-Riveros, Alejandra; Hernández-Vázquez, Eduardo; Nieto-Camacho, Antonio; Ramírez-Apan, Teresa; Miranda, Luis D.
Synthesis of diphenylamine macrocycles and their anti-inflammatory effects.
Organic & biomolecular chemistry, 2019, 17, 1423-1435
7156651 CIFC11 H10 O3 SP n m a23.014; 6.551; 6.696
90; 90; 90		1009.5Wang, Miao; Tang, Bo-Cheng; Ma, Jin-Tian; Wang, Zi-Xuan; Xiang, Jia-Chen; Wu, Yan-Dong; Wang, Jun-Gang; Wu, An-Xin
I<sub>2</sub>/DMSO-mediated multicomponent reaction of o-hydroxyaryl methyl ketones, rongalite, and DMSO: access to C3-sulfenylated chromones.
Organic & biomolecular chemistry, 2019, 17, 1535-1541
7156652 CIFC16 H11 F N2 OP -18.3168; 9.3791; 18.018
92.69; 99.941; 114.17		1252.1Motornov, Vladimir A.; Tabolin, Andrey A.; Nelyubina, Yulia V.; Nenajdenko, Valentine G.; Ioffe, Sema L.
Copper-mediated oxidative [3 + 2]-annulation of nitroalkenes and pyridinium ylides: general access to functionalized indolizines and efficient synthesis of 1-fluoroindolizines.
Organic & biomolecular chemistry, 2019, 17, 1442-1454
7156653 CIFC38 H40 N PP 1 21 19.371; 13.7203; 11.5632
90; 93.178; 90		1484.43Mino, Takashi; Yamaguchi, Daiki; Masuda, Chihiro; Youda, Junpei; Ebisawa, Toshibumi; Yoshida, Yasushi; Sakamoto, Masami
Synthesis and application of P,olefin type axially chiral ligands with sec-alkyl groups.
Organic & biomolecular chemistry, 2019, 17, 1455-1465
7156654 CIFC42 H41 Cl3 N PP 21 21 2110.1412; 17.5089; 19.7319
90; 90; 90		3503.62Mino, Takashi; Yamaguchi, Daiki; Masuda, Chihiro; Youda, Junpei; Ebisawa, Toshibumi; Yoshida, Yasushi; Sakamoto, Masami
Synthesis and application of P,olefin type axially chiral ligands with sec-alkyl groups.
Organic & biomolecular chemistry, 2019, 17, 1455-1465
7156655 CIFC21 H20 O2P -16.299; 11.213; 12.297
92.294; 92.253; 96.879		860.8Satpathi, Bishnupada; Dutta, Lona; Ramasastry, S. S. V.
Phosphine- and water-promoted pentannulative aldol reaction.
Organic & biomolecular chemistry, 2019, 17, 1547-1551
7156656 CIFC29 H35 B N2 O6P 1 21/c 116.0337; 12.9982; 14.006
90; 99.941; 90		2875.2Bi, Ya-Ping; Wang, He-Min; Qu, Hong-Yu; Liang, Xian-Chen; Zhou, Ying; Li, Xue-Ying; Xu, Defeng; Shen, Mei-Hua; Xu, Hua-Dong
Stereoselective synthesis of all-cis boryl tetrahydroquinolines via copper-catalyzed regioselective addition/cyclization of o-aldiminyl cinnamate with B<sub>2</sub>Pin<sub>2</sub>.
Organic & biomolecular chemistry, 2019, 17, 1542-1546
7156657 CIFC28 H19 B F4 N2C 1 2/c 131.9; 9.7621; 15.5417
90; 107.394; 90		4618.5Talukdar, Kangkan; Roy, Subhasish; Bag, Raghunath; Punniyamurthy, Tharmalingam
Rh-Catalyzed tandem C-C/C-N bond formation of quinoxalines with alkynes leading to heterocyclic ammonium salts.
Organic & biomolecular chemistry, 2019, 17, 2148-2152
7156658 CIFC18 H20 I N O4 S2P -110.9656; 14.167; 14.562
112.022; 102.093; 104.464		1911.4Lei, Bowen; Miao, Qi; Ma, Lifang; Fu, Ruoqi; Hu, Fangrong; Ni, Ni; Li, Ziyuan
Efficient metal-free aminoiodination of alkenes with N-fluorobenzenesulfonimide under mild conditions.
Organic & biomolecular chemistry, 2019, 17, 2126-2133
7156659 CIFC4.75 H3.38 Cl0.25 N0.13 O0.75 S0.13P 1 21/n 111.8316; 18.9651; 15.2168
90; 101.139; 90		3350.14Deng, Zhi-Xiong; Xie, Zhen-Zhen; Zheng, Yu; Xiao, Jun-An; Wang, Rui-Jia; Xiang, Hao-Yue; Yang, Hua
Intramolecular hydrogen-bonding-assisted phosphine-catalysed [3 + 2] cyclisation of ynones with o-hydroxy/amino benzaldehydes.
Organic & biomolecular chemistry, 2019, 17, 2187-2191
7156660 CIFC17 H22 N2 O2C 1 2/c 118.8452; 5.9542; 27.679
90; 103.868; 90		3015.3Li, Bang; Mao, Qi; Zhou, Jia; Liu, Feng; Ye, Na
HFIP-promoted Michael reactions: direct para-selective C-H activation of anilines with maleimides.
Organic & biomolecular chemistry, 2019, 17, 2242-2246
7156661 CIFC96 H88 O16 S4P 21 21 216.7899; 16.6281; 18.1779
90; 90; 90		2052.3Zehra, Syeda Tazeen; Zhang, Guoxiang; Yang, Shuang; Fang, Xinqiang
Kinetic resolution of β-ketoesters with quaternary stereocenters via a carbene-catalyzed benzoin reaction.
Organic & biomolecular chemistry, 2019, 17, 2169-2173
7156662 CIFC17 H20 O7I b a 225.1245; 17.8586; 7.11686
90; 90; 90		3193.25Salendra, Limbadri; Luo, Xiaowei; Lin, Xiuping; Wang, Junfeng; Yang, Bin; Zhou, Xuefeng; Liu, Yonghong
Versispiroketal A, an unusual tetracyclic bridged spiroketal from the sponge-associated fungus Aspergillus versicolor SCSIO 41013.
Organic & biomolecular chemistry, 2019, 17, 2182-2186
7156663 CIFC19 H9 Br F N O3P 1 21/c 17.3505; 15.9493; 13.0154
90; 95.358; 90		1519.2Mphahlele, Malose J.; Mmonwa, Mmakwena M.
Vilsmeier-Haack reaction of 7-acetyl-2-arylindoles: a convenient method for the synthesis of 6-oxo-6H-pyrrolo[3,2,1-ij]quinoline-1,5-dicarbaldehydes.
Organic & biomolecular chemistry, 2019, 17, 2204-2211
7156664 CIFC35 H49 N O4C 1 2 136.5813; 6.2452; 13.6063
90; 91.068; 90		3107.9Li, Yong-Li; Xue, Li-Jun; Li, Jie; Chen, Li-Ming; Wu, Jian-Jun; Xu, Zhuo-Ni; Chen, Ying; Tian, Yu-Ping; Yang, Xian-Wen
Abinukitrine A, a unique 17,18-cyclolanostane triterpenoid from Abies nukiangensis.
Organic & biomolecular chemistry, 2019, 17, 2107-2109
7156665 CIFC25 H21 N3 O4 SP 1 21/c 116.3438; 12.83299; 10.54089
90; 107.083; 90		2113.3Pang, Yadong; Liang, Guoduan; Xie, Fukai; Hu, Haibin; Du, Chuan; Zhang, Xinhang; Cheng, Maosheng; Lin, Bin; Liu, Yongxiang
N-Fluorobenzenesulfonimide as a highly effective Ag(i)-catalyst attenuator for tryptamine-derived ynesulfonamide cycloisomerization.
Organic & biomolecular chemistry, 2019, 17, 2247-2257
7156666 CIFC16 H8 F4 N4 SP 1 21/n 115.2261; 4.4752; 22.3479
90; 102.846; 90		1484.67Miao, Jiankang; Zhang, Yahui; Sang, Xiaoyan; Hao, Wenyan
A silver(i)-catalyzed cascade bicyclization strategy for synthesis of 5H-benzo[d]tetrazolo[5,1-b][1,3]thiazines.
Organic & biomolecular chemistry, 2019, 17, 2336-2340
7156667 CIFC12 H0.12 N4 SP b c a14.8813; 8.3305; 18.5422
90; 90; 90		2298.7Miao, Jiankang; Zhang, Yahui; Sang, Xiaoyan; Hao, Wenyan
A silver(i)-catalyzed cascade bicyclization strategy for synthesis of 5H-benzo[d]tetrazolo[5,1-b][1,3]thiazines.
Organic & biomolecular chemistry, 2019, 17, 2336-2340
7156668 CIFC58 H64 Cl2 N4 O12P -18.9724; 17.884; 18.7581
71.649; 78.938; 75.953		2749.6Lewis, James E. M.
Self-templated synthesis of amide catenanes and formation of a catenane coordination polymer.
Organic & biomolecular chemistry, 2019, 17, 2442-2447
7156669 CIFC58 H78.5 N6 O20.25P -113.3255; 13.5278; 17.7443
90.033; 100.915; 105.148		3027.4Lewis, James E. M.
Self-templated synthesis of amide catenanes and formation of a catenane coordination polymer.
Organic & biomolecular chemistry, 2019, 17, 2442-2447
7156670 CIFC75 H106 Ag F3 N6 O21 SI 1 2/a 128.3764; 22.9821; 26.0316
90; 110.512; 90		15900.2Lewis, James E. M.
Self-templated synthesis of amide catenanes and formation of a catenane coordination polymer.
Organic & biomolecular chemistry, 2019, 17, 2442-2447
7156671 CIFC29 H25 Cl2 N O5P 1 21 111.4706; 12.9944; 17.0882
90; 95.055; 90		2537.15Kowalczyk-Dworak, Dorota; Albrecht, Łukasz
α,β-Unsaturated butenolides in an organocatalytic doubly annulative cascade for the preparation of 3,4-dihydrocoumarins.
Organic & biomolecular chemistry, 2019, 17, 2624-2628
7156672 CIFC13 H7 N O3 SP -15.4276; 9.6873; 10.8442
69.319; 82.283; 83.399		527.2Tasker, Nikhil R.; Rastelli, Ettore J.; Blanco, Isabella K.; Burnett, James C.; Sharlow, Elizabeth R.; Lazo, John S.; Wipf, Peter
In-flow photooxygenation of aminothienopyridinones generates iminopyridinedione PTP4A3 phosphatase inhibitors.
Organic & biomolecular chemistry, 2019, 17, 2448-2466
7156673 CIFC31 H38 O10P 21 21 2111.8058; 12.6003; 19.4463
90; 90; 90		2892.8He, Jun; Xu, Jie-Kun; Zhang, Jia; Bai, Hong-Jin; Ma, Bing-Zhi; Cheng, Yung-Chi; Zhang, Wei-Ku
Fischeriana A, a meroterpenoid with an unusual 6/6/5/5/5/6/6 heptacyclic carbon skeleton from the roots of Euphorbia fischeriana.
Organic & biomolecular chemistry, 2019, 17, 2721-2724
7156674 CIFC22 H14 Cl I N2 O SP c c n9.8708; 40.1183; 9.9473
90; 90; 90		3939.1Saini, Kapil Mohan; Saunthwal, Rakesh K.; Kumar, Shiv; Verma, Akhilesh K.
On water: iodine-mediated direct construction of 1,3-benzothiazines from ortho-alkynylanilines by regioselective 6-exo-dig cyclization.
Organic & biomolecular chemistry, 2019, 17, 2657-2662
7156675 CIFC17 H24 SP 1 21/n 110.7279; 9.5705; 14.6231
90; 95.351; 90		1494.83Urriolabeitia, Esteban P.; Ruiz, Sara
Ru(ii)-Catalysed synthesis of (1H)-isothiochromenes by oxidative coupling of benzylthioethers with internal alkynes.
Organic & biomolecular chemistry, 2019, 17, 2542-2547

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