Crystallography Open Database

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1553919 CIFC40 H54 B2 N2P -19.0141; 12.9277; 15.5179
111.75; 98.849; 99.031
1613.9Grandl, Markus; Sun, Yu; Pammer, Frank
Electronic and structural properties of N → B-ladder boranes with high electron affinity
Organic Chemistry Frontiers, 2018, 5, 336
1553920 CIFC40 H54 B2 N2P 1 21/n 117.2519; 10.4002; 18.7527
90; 94.829; 90
3352.73Grandl, Markus; Sun, Yu; Pammer, Frank
Electronic and structural properties of N → B-ladder boranes with high electron affinity
Organic Chemistry Frontiers, 2018, 5, 336
1553921 CIFC44 H56 B2 N2P 1 21 110.7137; 14.9388; 11.2075
90; 101.824; 90
1755.7Grandl, Markus; Sun, Yu; Pammer, Frank
Electronic and structural properties of N → B-ladder boranes with high electron affinity
Organic Chemistry Frontiers, 2018, 5, 336
1553922 CIFC50 H29 B2 F20 N3P 1 2/n 113.3636; 12.765; 15.0491
90; 111.844; 90
2382.85Grandl, Markus; Sun, Yu; Pammer, Frank
Electronic and structural properties of N →B-ladder boranes with high electron affinity
Organic Chemistry Frontiers, 2018, 5, 336
1553923 CIFC60 H38 B2 F20 N2P -111.196; 13.488; 19.102
102.11; 104.06; 108.18
2528Grandl, Markus; Sun, Yu; Pammer, Frank
Electronic and structural properties of N → B-ladder boranes with high electron affinity
Organic Chemistry Frontiers, 2018, 5, 336
1553924 CIFC35 H37 Cl2 N3 O4 S2P 1 21/n 18.616; 21.777; 18.552
90; 100.259; 90
3425Cao, Bo; Wei, Yin; Shi, Min
Indium(iii)-catalyzed intramolecular dearomative cycloaddition ofN-sulfonylaziridines to indoles: facile synthesis of tetracyclic pyrroloindoline skeletons
Organic Chemistry Frontiers, 2018, 5, 423
1553925 CIFC8 H12 Cl Cu N4 O4P n a 2124.106; 8.4201; 20.584
90; 90; 90
4178Cao, Bo; Wei, Yin; Shi, Min
Indium(iii)-catalyzed intramolecular dearomative cycloaddition ofN-sulfonylaziridines to indoles: facile synthesis of tetracyclic pyrroloindoline skeletons
Organic Chemistry Frontiers, 2018, 5, 423
1553926 CIFC33 H33 N3 O4 S2C 1 2/c 133.342; 14.1163; 13.8882
90; 113.533; 90
5993Cao, Bo; Wei, Yin; Shi, Min
Indium(iii)-catalyzed intramolecular dearomative cycloaddition ofN-sulfonylaziridines to indoles: facile synthesis of tetracyclic pyrroloindoline skeletons
Organic Chemistry Frontiers, 2018, 5, 423
1553927 CIFC33 H33 N3 O4 S2P 1 21/c 120.618; 12.7286; 11.5829
90; 96.577; 90
3019.8Cao, Bo; Wei, Yin; Shi, Min
Indium(iii)-catalyzed intramolecular dearomative cycloaddition ofN-sulfonylaziridines to indoles: facile synthesis of tetracyclic pyrroloindoline skeletons
Organic Chemistry Frontiers, 2018, 5, 423
1553928 CIFC36 H29 N3P 1 21/c 116.4746; 9.1306; 19.2167
90; 113.764; 90
2645.5Filatov, A. S.; Knyazev, N. A.; Ryazantsev, M. N.; Suslonov, V. V.; Larina, A. G.; Molchanov, A. P.; Kostikov, R. R.; Boitsov, V. M.; Stepakov, A. V.
A highly diastereoselective one-pot three-component 1,3-dipolar cycloaddition of cyclopropenes with azomethine ylides generated from 11H-indeno[1,2-b]-quinoxalin-11-ones
Organic Chemistry Frontiers, 2018, 5, 595
1553929 CIFC40.35 H35.05 N3 O1.67P -19.0006; 13.4106; 13.9272
73.859; 78.251; 71.617
1519.94Filatov, A. S.; Knyazev, N. A.; Ryazantsev, M. N.; Suslonov, V. V.; Larina, A. G.; Molchanov, A. P.; Kostikov, R. R.; Boitsov, V. M.; Stepakov, A. V.
A highly diastereoselective one-pot three-component 1,3-dipolar cycloaddition of cyclopropenes with azomethine ylides generated from 11H-indeno[1,2-b]-quinoxalin-11-ones
Organic Chemistry Frontiers, 2018, 5, 595
1553930 CIFC39 H29 N3 O2P 1 21/n 19.8591; 17.6789; 16.9614
90; 96.753; 90
2935.83Filatov, A. S.; Knyazev, N. A.; Ryazantsev, M. N.; Suslonov, V. V.; Larina, A. G.; Molchanov, A. P.; Kostikov, R. R.; Boitsov, V. M.; Stepakov, A. V.
A highly diastereoselective one-pot three-component 1,3-dipolar cycloaddition of cyclopropenes with azomethine ylides generated from 11H-indeno[1,2-b]-quinoxalin-11-ones
Organic Chemistry Frontiers, 2018, 5, 595
1553931 CIFC43 H29 N3P 1 21/n 19.7752; 18.4617; 18.0848
90; 102.389; 90
3187.7Filatov, A. S.; Knyazev, N. A.; Ryazantsev, M. N.; Suslonov, V. V.; Larina, A. G.; Molchanov, A. P.; Kostikov, R. R.; Boitsov, V. M.; Stepakov, A. V.
A highly diastereoselective one-pot three-component 1,3-dipolar cycloaddition of cyclopropenes with azomethine ylides generated from 11H-indeno[1,2-b]-quinoxalin-11-ones
Organic Chemistry Frontiers, 2018, 5, 595
1553932 CIFC44 H31 N3 OP 1 21/c 19.9057; 18.2185; 17.9256
90; 94.694; 90
3224.13Filatov, A. S.; Knyazev, N. A.; Ryazantsev, M. N.; Suslonov, V. V.; Larina, A. G.; Molchanov, A. P.; Kostikov, R. R.; Boitsov, V. M.; Stepakov, A. V.
A highly diastereoselective one-pot three-component 1,3-dipolar cycloaddition of cyclopropenes with azomethine ylides generated from 11H-indeno[1,2-b]-quinoxalin-11-ones
Organic Chemistry Frontiers, 2018, 5, 595
1553933 CIFC10 H15 N O3P 1 c 19.9528; 5.6608; 10.1737
90; 119.444; 90
499.16Peter, Clovis; Geoffroy, Philippe; Miesch, Michel
Highly diastereoselective access to polyfunctionalized 1,3-oxazines promoted by Brønsted/Lewis acids
Organic Chemistry Frontiers, 2018, 5, 566
1553934 CIFC16 H14 O7P -16.934; 9.4461; 12.5549
77.759; 76.1; 88.981
779.63Xu, Li-Chen; Zhou, Peng; Li, Jia-Zhuo; Hao, Wen-Juan; Tu, Shu-Jiang; Jiang, Bo
Thiazolium salt-catalyzed [3 + 2 + 1] cyclization for the synthesis of trisubstituted 2-pyrones using arylglyoxals as a carbonyl source
Organic Chemistry Frontiers, 2018, 5, 753
1553935 CIFC65 H63 F6 N8 O12 P S6P -114.18; 16.43; 16.973
65.7; 71.841; 79.491
3417.8Zhao, Meng-Yao; Guo, Qing-Hui; Wang, Mei-Xiang
Understanding the driving force for the molecular recognition of S6-corona[3]arene[3]pyridazine toward organic ammonium cations
Organic Chemistry Frontiers, 2018, 5, 760
1553936 CIFC26 H28 Cl2 N3 O5 P RuP 21 21 218.4287; 10.7538; 30.9419
90; 90; 90
2804.59de Julián, E.; Menéndez-Pedregal, E.; Claros, M.; Vaquero, M.; Díez, J.; Lastra, E.; Gamasa, P.; Pizzano, A.
Practical synthesis of enantiopure benzylamines by catalytic hydrogenation or transfer hydrogenation reactions in isopropanol using a Ru-pybox catalyst
Organic Chemistry Frontiers, 2018, 5, 841
1553937 CIFC33 H30 Cl2 N3 O4 P RuP 428.3195; 28.3195; 8.539
90; 90; 90
6848.2de Julián, E.; Menéndez-Pedregal, E.; Claros, M.; Vaquero, M.; Díez, J.; Lastra, E.; Gamasa, P.; Pizzano, A.
Practical synthesis of enantiopure benzylamines by catalytic hydrogenation or transfer hydrogenation reactions in isopropanol using a Ru-pybox catalyst
Organic Chemistry Frontiers, 2018, 5, 841
1553938 CIFC27 H23 N3 OI 41 c d31.825; 31.825; 8.303
90; 90; 90
8410Zhang, Chen; Pi, Junxia; Chen, Shu; Liu, Ping; Sun, Peipei
Construction of a 4H-pyrido[4,3,2-gh]phenanthridin-5(6H)-one skeleton via a catalyst-free radical cascade addition/cyclization using azo compounds as radical sources
Organic Chemistry Frontiers, 2018, 5, 793
1553939 CIFC22 H22 SiP b c a8.8464; 13.6195; 30.1026
90; 90; 90
3626.9Yang, Qi; Liu, Liang; Chi, Yue; Hao, Wei; Zhang, Wen-Xiong; Xi, Zhenfeng
Rhodium-catalyzed intramolecular carbosilylation of alkynes via C(sp3)–Si bond cleavage
Organic Chemistry Frontiers, 2018, 5, 860
1553940 CIFC21 H20 SiP 1 21/n 112.2864; 9.5206; 14.4288
90; 96.731; 90
1676.16Yang, Qi; Liu, Liang; Chi, Yue; Hao, Wei; Zhang, Wen-Xiong; Xi, Zhenfeng
Rhodium-catalyzed intramolecular carbosilylation of alkynes via C(sp3)–Si bond cleavage
Organic Chemistry Frontiers, 2018, 5, 860
1553941 CIFC23 H22 N2 O7P 19.297; 11.515; 11.957
61.974; 80.333; 67.602
1044.6Han, Jianxin; Niu, Sheng-Tong; Liu, Yushuang; Gan, Lishe; Wang, Tianfu; Lu, Chong-Dao; Yuan, Tao
Robustanoids A and B, two novel pyrrolo[2,3-b]indole alkaloids from Coffea canephora: isolation and total synthesis
Organic Chemistry Frontiers, 2018, 5, 586
1553942 CIFC28 H21 N5 OP -17.483; 12.28; 13.156
73.055; 75.131; 76.779
1102.1Gao, Qinghe; He, Shuang; Wu, Xia; Zhang, Jingjing; Bai, Suping; Wu, Yandong; Wu, Anxin
Selective access to dipyrazolo-fused pyridines via formal [3 + 2 + 1] heteroannulation of methyl ketones with pyrazol-5-amines
Organic Chemistry Frontiers, 2018, 5, 765
1553943 CIFC83 H54 Cl2 N2 O2P -19.6948; 10.6078; 14.8224
105.266; 103.77; 93.623
1415.35Marin, L.; Guillot, R.; Gandon, V.; Schulz, E.; Lebœuf, D.
A diversity-oriented synthesis of cyclopenta[b]pyrroles and related compounds through a calcium(ii)/copper(ii) catalytic sequence
Organic Chemistry Frontiers, 2018, 5, 640
1553944 CIFC34 H29 Cl2 N O3P 1 21/c 114.1223; 10.4359; 19.4476
90; 97.282; 90
2843.05Marin, L.; Guillot, R.; Gandon, V.; Schulz, E.; Lebœuf, D.
A diversity-oriented synthesis of cyclopenta[b]pyrroles and related compounds through a calcium(ii)/copper(ii) catalytic sequence
Organic Chemistry Frontiers, 2018, 5, 640
1553945 CIFC13 H9 Br Cl F4 N SP 1 21/c 16.18585; 19.014; 13.0299
90; 104.086; 90
1486.46Das, Prajwalita; Takada, Masahiro; Tokunaga, Etsuko; Saito, Norimichi; Shibata, Norio
Synthesis of pyridine trans-tetrafluoro-λ6-sulfane derivatives via radical addition
Organic Chemistry Frontiers, 2018, 5, 719
1553946 CIFC16 H12 Cl N O2 SC 1 2/c 124.908; 13.4385; 8.7528
90; 93.042; 90
2925.7Zhao, Lang; Liao, Wei-Wei
Pd-Catalyzed intramolecular C–H addition to the cyano-group: construction of functionalized 2,3-fused thiophene scaffolds
Organic Chemistry Frontiers, 2018, 5, 801
1553947 CIFC16 H18 N2 O2P 1 21/n 19.5527; 12.362; 12.0679
90; 92.577; 90
1423.66Yue, Qiang; Xiao, Zhen; Ran, Ziyao; Yuan, Songdong; Zhang, Qian; Li, Dong
Copper-catalyzed α-C–H amidation of simple ethers through C(sp3)–H/N–H cross dehydrogenative coupling
Organic Chemistry Frontiers, 2018, 5, 967
1553948 CIFC17 H15.5 N2 O3.5 SP 1 21 113.1217; 8.2301; 15.9865
90; 109.525; 90
1627.15Huang, Bing-Bing; Wu, Liang; Liu, Ren-Rong; Xing, Ling-Ling; Liang, Ren-Xiao; Jia, Yi-Xia
Enantioselective Friedel–Crafts C2-alkylation of 3-substituted indoles with trifluoropyruvates and cyclic N-sulfonyl α-ketiminoesters
Organic Chemistry Frontiers, 2018, 5, 929
1553949 CIFC19 H17 F3 N O3.5P 21 21 218.0275; 13.876; 31.686
90; 90; 90
3529.5Huang, Bing-Bing; Wu, Liang; Liu, Ren-Rong; Xing, Ling-Ling; Liang, Ren-Xiao; Jia, Yi-Xia
Enantioselective Friedel–Crafts C2-alkylation of 3-substituted indoles with trifluoropyruvates and cyclic N-sulfonyl α-ketiminoesters
Organic Chemistry Frontiers, 2018, 5, 929
1553950 CIFC28 H20 N4P 1 21/c 110.4482; 7.41078; 13.6312
90; 105.538; 90
1016.88Qin, Wen-Bing; Li, Wei-Wei; Zhu, Peng-Fei; Mo, Xiao-Gang; Zhang, Hui-Jun; Wen, Ting-Bin
Rh(iii)-Catalyzed regio- and stereoselective bisindolylation of vinyl acetate: an efficient approach toward (E)-1,2-bis(2-indolyl)ethenes
Organic Chemistry Frontiers, 2018, 5, 1096
1553951 CIFC25 H30 N2 O3.5 RhP -18.5997; 11.3141; 23.5957
89.88; 86.923; 89.086
2292.21Qin, Wen-Bing; Li, Wei-Wei; Zhu, Peng-Fei; Mo, Xiao-Gang; Zhang, Hui-Jun; Wen, Ting-Bin
Rh(iii)-Catalyzed regio- and stereoselective bisindolylation of vinyl acetate: an efficient approach toward (E)-1,2-bis(2-indolyl)ethenes
Organic Chemistry Frontiers, 2018, 5, 1096
1553952 CIFC24 H22 S6 Si2C 1 2/c 131.277; 16.691; 10.668
90; 93.503; 90
5559Liu, Xinming; Sun, Huiliang; Xu, Wan; Wan, Shisheng; Shi, Jianwu; Li, Chunli; Wang, Hua
Syntheses and structures of [7]helicene and double helicene based on dithieno[2,3-b:2′,3′-d]thiophene
Organic Chemistry Frontiers, 2018, 5, 1257
1553953 CIFC22 H20 S7 Si2P 1 21/c 119.71; 13.215; 10.489
90; 103.753; 90
2653.7Liu, Xinming; Sun, Huiliang; Xu, Wan; Wan, Shisheng; Shi, Jianwu; Li, Chunli; Wang, Hua
Syntheses and structures of [7]helicene and double helicene based on dithieno[2,3-b:2′,3′-d]thiophene
Organic Chemistry Frontiers, 2018, 5, 1257
1553954 CIFC11 H11 Br S3 SiP n m a12.594; 7.353; 15.175
90; 90; 90
1405.3Liu, Xinming; Sun, Huiliang; Xu, Wan; Wan, Shisheng; Shi, Jianwu; Li, Chunli; Wang, Hua
Syntheses and structures of [7]helicene and double helicene based on dithieno[2,3-b:2′,3′-d]thiophene
Organic Chemistry Frontiers, 2018, 5, 1257
1553955 CIFC11 H11 Br S3 SiP 1 21/c 111.5286; 15.8164; 8.4588
90; 110.19; 90
1447.6Liu, Xinming; Sun, Huiliang; Xu, Wan; Wan, Shisheng; Shi, Jianwu; Li, Chunli; Wang, Hua
Syntheses and structures of [7]helicene and double helicene based on dithieno[2,3-b:2′,3′-d]thiophene
Organic Chemistry Frontiers, 2018, 5, 1257
1553956 CIFC53 H49 Cl2 N3 O3P 1 21/n 111.566; 31.513; 12.0437
90; 92.279; 90
4386.2Krishnan, Jagadeesh; Jose, Anu; Sasidhar, B. S.; Suresh, E.; Menon, Rajeev S.; Nair, Vijay
An uncommon multicomponent reaction involving nucleophilic heterocyclic carbenes: facile synthesis of fully substituted cyclopentanones
Organic Chemistry Frontiers, 2018, 5, 1202
1553957 CIFC50.5 H49 Cl I N3 O5C 1 2/c 129.069; 16.647; 23.834
90; 124.203; 90
9538.8Krishnan, Jagadeesh; Jose, Anu; Sasidhar, B. S.; Suresh, E.; Menon, Rajeev S.; Nair, Vijay
An uncommon multicomponent reaction involving nucleophilic heterocyclic carbenes: facile synthesis of fully substituted cyclopentanones
Organic Chemistry Frontiers, 2018, 5, 1202
1553958 CIFC52 H47 N3 O3P 1 21/n 113.605; 13.333; 23.507
90; 101.393; 90
4180Krishnan, Jagadeesh; Jose, Anu; Sasidhar, B. S.; Suresh, E.; Menon, Rajeev S.; Nair, Vijay
An uncommon multicomponent reaction involving nucleophilic heterocyclic carbenes: facile synthesis of fully substituted cyclopentanones
Organic Chemistry Frontiers, 2018, 5, 1202
1553959 CIFC20 H19 N O2P 1 21/c 17.6879; 13.3936; 15.696
90; 103.359; 90
1572.46Chen, Wei; Zhang, Yicheng; Li, Pinhua; Wang, Lei
tert-Butyl peroxybenzoate mediated formation of 3-alkylated quinolines from N-propargylamines via a cascade radical addition/cyclization reaction
Organic Chemistry Frontiers, 2018, 5, 855
1553960 CIFC51 H51 Cl5 N4 O2 P2 RuP 1 21/c 112.074; 22.964; 17.711
90; 93.931; 90
4899Roy, Bivas Chandra; Debnath, Subhankar; Chakrabarti, Kaushik; Paul, Bhaskar; Maji, Milan; Kundu, Sabuj
ortho-Amino group functionalized 2,2′-bipyridine based Ru(ii) complex catalysed alkylation of secondary alcohols, nitriles and amines using alcohols
Organic Chemistry Frontiers, 2018, 5, 1008
1553961 CIFC22 H28 Cl F6 N4 P RuP n a 2124.447; 12.95; 7.9
90; 90; 90
2501.1Roy, Bivas Chandra; Debnath, Subhankar; Chakrabarti, Kaushik; Paul, Bhaskar; Maji, Milan; Kundu, Sabuj
ortho-Amino group functionalized 2,2′-bipyridine based Ru(ii) complex catalysed alkylation of secondary alcohols, nitriles and amines using alcohols
Organic Chemistry Frontiers, 2018, 5, 1008
1553962 CIFC48 H44 Cl2 N4 P2 RuP 1 21/c 19.679; 19.168; 21.719
90; 91.489; 90
4028Roy, Bivas Chandra; Debnath, Subhankar; Chakrabarti, Kaushik; Paul, Bhaskar; Maji, Milan; Kundu, Sabuj
ortho-Amino group functionalized 2,2′-bipyridine based Ru(ii) complex catalysed alkylation of secondary alcohols, nitriles and amines using alcohols
Organic Chemistry Frontiers, 2018, 5, 1008
1553963 CIFC23 H21 N O2 SP 21 21 218.0484; 10.6055; 21.9053
90; 90; 90
1869.8Li, Yun; Chen, Jingchao; He, Zhenxiu; Qin, Hongyu; Zhou, Yongyun; Khan, Ruhima; Fan, Baomin
Cobalt-catalyzed asymmetric reactions of heterobicyclic alkenes with in situ generated organozinc halides
Organic Chemistry Frontiers, 2018, 5, 1108
1553964 CIFC26 H27 Br O3P 21 21 214.839; 17.596; 8.652
90; 90; 90
2259.1Li, Shoulei; Liu, Bin; Chen, Li; Li, Xin; Cheng, Jin-Pei
N-Heterocyclic carbene promoted enantioselective desymmetrization reaction of diarylalkane-bisphenols
Organic Chemistry Frontiers, 2018, 5, 1101
1553965 CIFC10 H8 N4P 1 21/c 14.3504; 24.437; 8.5476
90; 102.442; 90
887.36Qiao, Kai; Zhang, Dong; Zhang, Kai; Yuan, Xin; Zheng, Ming-Wei; Guo, Tian-Fo; Fang, Zheng; Wan, Li; Guo, Kai
Iron(ii)-catalyzed C-2 cyanomethylation of indoles and pyrroles via direct oxidative cross-dehydrogenative coupling with acetonitrile derivatives
Organic Chemistry Frontiers, 2018, 5, 1129
1553966 CIFC18 H21 N O2 SP 21 21 219.4077; 9.9254; 17.562
90; 90; 90
1639.9Song, Bo; Chen, Mu-Wang; Zhou, Yong-Gui
Synthesis of chiral sultams with two adjacent stereocenters via palladium-catalyzed dynamic kinetic resolution
Organic Chemistry Frontiers, 2018, 5, 1113
1553967 CIFC15 H7 Cl F N OP 1 21/n 18.9388; 9.7832; 13.5584
90; 107.86; 90
1128.54Liu, Jianming; Yan, Xuyang; Liu, Na; Zhang, Yanyan; Zhao, Shufang; Wang, Xiaopei; Zhuo, Kelei; Yue, Yuanyuan
Elemental sulfur accelerated the reactivity of the 3-position of indole for the construction of chromeno[2,3-b]indoles
Organic Chemistry Frontiers, 2018, 5, 1034
1553968 CIFC26 H27 N O3P -19.2089; 10.5763; 10.9769
100.503; 95.221; 91.16
1046.09Luo, Hejiang; Liang, Renxiao; Chen, Lianfen; Jiang, Huanfeng; Zhu, Shifa
A silver-catalyzed three-component reaction via stabilized cation: synthesis of polysubstituted tetrahydronaphthols and tetrahydronaphthylamines
Organic Chemistry Frontiers, 2018, 5, 1160

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