Crystallography Open Database

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1553009 CIFC22 H18 Br2 O4P -15.9442; 6.7813; 13.014
91.341; 92.608; 105.719
504.1Tian, Bing; Liu, Qiang; Tong, Xiaofeng; Tian, Ping; Lin, Guo-Qiang
Copper(i)-catalyzed enantioselective hydroboration of cyclopropenes: facile synthesis of optically active cyclopropylboronates
Org. Chem. Front., 2014, 1, 1116
1553002 CIFC6 H9 N O2P 21 21 214.3822; 7.7125; 19.0393
90; 90; 90
643.48Godin, François; Duplessis, Martin; Buonomano, Cindy; Trinh, Thao; Houde, Karine; Chapdelaine, Daniel; Rodrigue, Jacques; Boutros, André; Guindon, Yvan
Stereocontrolled synthesis of propionate motifs froml-lactic andl-alanine aldehydes. A DFT study of the hydrogen transfer under endocyclic control
Org. Chem. Front., 2014, 1, 974
1552972 CIFC17 H21 B Br O PP 16.4951; 9.549; 15.501
81.333; 86.707; 74.351
915Li, Chun; Bian, Qing-Long; Xu, Sheng; Duan, Wei-Liang
Palladium-catalyzed 1,4-addition of secondary alkylphenylphosphines to α,β-unsaturated carbonyl compounds for the synthesis of phosphorus- and carbon-stereogenic compounds
Org. Chem. Front., 2014, 1, 541
1556403 CIFC21 H22 O2 SP -18.7371; 9.2269; 12.186
89.9; 72.14; 80.18
920Peng, Lingling; Zhang, Xiu; Ma, Jie; Wang, Jianbo
Ru(ii)-catalyzed rearrangement of the allenic sulfide bearing propargyl moiety: efficient formation of benzene derivatives
Org. Chem. Front., 2014, 1, 235
1552992 CIFC26 H19 N OP -18.8997; 9.2955; 11.9387
79.341; 78.262; 83.259
947Guo, Tenglong; Jiang, Quanbin; Huang, Fei; Chen, Jiping; Yu, Zhengkun
Palladium-catalyzed, copper-mediated construction of benzene rings from the reactions of indoles with in situ generated enones
Org. Chem. Front., 2014, 1, 707
1553038 CIFC24 H19 F3 OP -15.3668; 9.6287; 18.804
82.874; 86.417; 82.471
954.8Ji, Yun-Long; Lin, Jin-Hong; Xiao, Ji-Chang; Gu, Yu-Cheng
Copper-catalyzed tandem trifluoromethylation/cyclization of internal alkynes
Org. Chem. Front., 2014, 1, 1280
1552975 CIFC26 H21 N O2P -19.7339; 10.1445; 11.2108
69.234; 70.764; 78.702
973.4Ge, Guang-Cun; Ding, Chang-Hua; Hou, Xue-Long
Palladacycle-catalyzed cascade reaction of bicyclic alkenes with alkynyl imines: synthesis of polycyclic 5H-benzo[b]azepines
Org. Chem. Front., 2014, 1, 382
1553034 CIFC21 H17 Br2 N O3 SP 1 21 19.4812; 8.1107; 13.3671
90; 106.9; 90
983.53Liu, Cheng-Hang; Yu, Zhi-Xiang
Gold(i)- and platinum(iv)-catalyzed intramolecular annulations of allenes towards furans
Org. Chem. Front., 2014, 1, 1205
1553015 CIFC28 H24 N2 O2P -19.4812; 10.0987; 13.636
74.849; 80.124; 67.332
1159.2You, Xu; Xie, Xin; Sun, Renhong; Chen, Haoyi; Li, Shi; Liu, Yuanhong
Titanium-mediated cross-coupling reactions of 1,3-butadiynes with α-iminonitriles to 3-aminopyrroles: observation of an imino aza-Nazarov cyclization
Org. Chem. Front., 2014, 1, 940
1553008 CIFC26 H31 N3 O5P -16.7701; 11.166; 17.891
74.17; 82.524; 85.51
1288.8Nakamura, Itaru; Jo, Takeru; Zhang, Dong; Terada, Masahiro
N-Allenylnitrone acts as 2-azadiene in the Cu-catalyzed cascade reaction of O-propargylic oximes with azodicarboxylates
Org. Chem. Front., 2014, 1, 914
1552969 CIFC37 H26 O4P 21 21 213.1215; 11.0922; 9.3453
90; 90; 90
1360.17Wang, Bin; Gu, Zhenhua
Highly efficient and practical resolution of 2,3:6,7-dibenzobicyclo[3.3.1]nona-2,6-diene-4,8-dione and stereoselective synthesis of its chiral diamine derivatives
Org. Chem. Front., 2014, 1, 271
1556391 CIFC18 H20 O2P 21 21 219.1769; 10.289; 14.62
90; 90; 90
1380.4Zhang, Shaoguang; Zhan, Ming; Wang, Qifeng; Wang, Chao; Zhang, Wen-Xiong; Xi, Zhenfeng
Synthesis of semibullvalene derivatives via Co2(CO)8-mediated cyclodimerization of 1,4-dilithio-1,3-butadienes
Org. Chem. Front., 2014, 1, 130
1553025 CIFC32 H33 N5 O2 SP -19.91; 12.6331; 13.0734
90.23; 111.217; 111.642
1400.25Un, Hio-Ieng; Huang, Chang-Bo; Huang, Chusen; Jia, Ti; Zhao, Xiao-Li; Wang, Cui-Hong; Xu, Lin; Yang, Hai-Bo
A versatile fluorescent dye based on naphthalimide: highly selective detection of Hg2+in aqueous solution and living cells and its aggregation-induced emission behaviour
Org. Chem. Front., 2014, 1, 1083
1552980 CIFC16 H13 F3 N2 OP 1 21/c 19.805; 9.3144; 15.513
90; 97.91; 90
1403.3Yan, Xiaoyu; Yi, Xiangli; Xi, Chanjuan
Direct cleavage of the NN bond of azobenzenes by MeOTf leading to N-arylbenzimidazoles
Org. Chem. Front., 2014, 1, 657
1552977 CIFC16 H6 F4 N4 O2P 1 21/c 114.965; 8.119; 13.829
90; 116.87; 90
1498.8Liu, Yan-Hua; Zhang, Liang; Xu, Xiao-Na; Li, Zhi-Ming; Zhang, Dan-Wei; Zhao, Xin; Li, Zhan-Ting
Intramolecular C‒H⋯F hydrogen bonding-induced 1,2,3-triazole-based foldamers
Org. Chem. Front., 2014, 1, 494
1553028 CIFC33 H30 F3 N3 O5 SP -18.012; 13.115; 15.516
102.467; 104.463; 98.556
1505.6Lei, Chuan-Hu; Zhao, Liang; Wang, De-Xian; Zhu, Jieping; Wang, Mei-Xiang
Functionalized imidazoliniums from the three-component domino reaction of N-formylmethylcarboxamides with amines and isocyanides
Org. Chem. Front., 2014, 1, 909
1553010 CIFC37 H27 Br N2 O2 SP -110.3013; 13.0206; 13.9427
117.359; 105.117; 95.85
1548.9You, Xu; Xie, Xin; Sun, Renhong; Chen, Haoyi; Li, Shi; Liu, Yuanhong
Titanium-mediated cross-coupling reactions of 1,3-butadiynes with α-iminonitriles to 3-aminopyrroles: observation of an imino aza-Nazarov cyclization
Org. Chem. Front., 2014, 1, 940
1556388 CIFC40 H40P -19.129; 12.58; 15.035
81.14; 73.69; 70.31
1556.9Zhang, Shaoguang; Zhan, Ming; Wang, Qifeng; Wang, Chao; Zhang, Wen-Xiong; Xi, Zhenfeng
Synthesis of semibullvalene derivatives via Co2(CO)8-mediated cyclodimerization of 1,4-dilithio-1,3-butadienes
Org. Chem. Front., 2014, 1, 130
1556393 CIFC16 H16 Br N3 OP 21 21 219.466; 12.4249; 13.3396
90; 90; 90
1568.9Fu, Niankai; Zhang, Long; Luo, Sanzhong; Cheng, Jin-Pei
Chiral primary amine catalysed asymmetric conjugate addition of azoles to α-substituted vinyl ketones
Org. Chem. Front., 2014, 1, 68
1552997 CIFC23 H18 OP 21 21 216.1046; 15.4141; 17.5871
90; 90; 90
1654.9Zhu, Jian-Bo; Chen, Hao; Wang, Lijia; Tang, Yong
Stereospecific synthesis of highly functionalized benzo[3.1.0]bicycloalkanes via multistep cascade reactions
Org. Chem. Front., 2014, 1, 965

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