Crystallography Open Database

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7111893 CIFC27 H29 Ho0 N O3P 1 21 112.246; 6.725; 14.229
90; 92.04; 90
1171.1Leonardo Degennaro; Marina Zenzola; Piera Trinchera; Laura Carroccia; Arianna Giovine; Giuseppe Romanazzi; Aurelia Falcicchio; Renzo Luisi
Regioselective functionalization of 2-arylazetidines: evaluating the ortho-directing ability of the azetidinyl ring and the alpha-directing ability of the N-substituent
Chem.Commun., 2014, 50, 1698
7111894 CIFC27 H9 O22 Zn5I b a m19.7757; 44.7064; 28.6303
90; 90; 90
25312.1Jinjie Qian; Feilong Jiang; Linjie Zhang; Kongzhao Su; Jie Pan; Qipeng Li; Daqiang Yuan; Maochun Hong
Unusual pore structure and sorption behaviour in a hexanodal zinc-organic framework material
Chem.Commun., 2014, 50, 1678
7111895 CIFC32 H72 Co2 N2 P4P -19.7022; 12.226; 17.863
108.791; 95.504; 102.746
1924.3Sergio S. Rozenel; Rosa Padilla; Clement Camp; John Arnold
Unusual activation of H2 by reduced cobalt complexes supported by a PNP pincer ligand
Chem.Commun., 2014, 50, 2612
7111896 CIFC16 H39 Cl Co N P2P -110.526; 15.026; 15.316
62.877; 86.128; 85.906
2149Sergio S. Rozenel; Rosa Padilla; Clement Camp; John Arnold
Unusual activation of H2 by reduced cobalt complexes supported by a PNP pincer ligand
Chem.Commun., 2014, 50, 2612
7111897 CIFC16 H40 Co N P2C 1 2/c 119.9694; 7.4326; 13.6932
90; 98.027; 90
2012.49Sergio S. Rozenel; Rosa Padilla; Clement Camp; John Arnold
Unusual activation of H2 by reduced cobalt complexes supported by a PNP pincer ligand
Chem.Commun., 2014, 50, 2612
7111898 CIFC17 H36 Co N O P2P -17.6066; 8.4996; 17.1584
82.406; 82.863; 69.241
1024.63Sergio S. Rozenel; Rosa Padilla; Clement Camp; John Arnold
Unusual activation of H2 by reduced cobalt complexes supported by a PNP pincer ligand
Chem.Commun., 2014, 50, 2612
7111899 CIFC7 H2.33 Co0.66 Gd0.33 N O6P 6/m c c15.3945; 15.3945; 14.6706
90; 90; 120
3011Zheng Niu; Jian-Gong Ma; Wei Shi; Peng Cheng
Water molecule-driven reversible single-crystal to single-crystal transformation of a multi-metallic coordination polymer with controllable metal ion movement
Chem.Commun., 2014, 50, 1839
7111900 CIFC42 H42 Co4 Gd2 N6 O48P 6/m c c15.7215; 15.7215; 14.9689
90; 90; 120
3204.1Zheng Niu; Jian-Gong Ma; Wei Shi; Peng Cheng
Water molecule-driven reversible single-crystal to single-crystal transformation of a multi-metallic coordination polymer with controllable metal ion movement
Chem.Commun., 2014, 50, 1839
7111901 CIFC42 H32 Co4 Gd2 N6 O43P 6/m c c15.7818; 15.7818; 15.006
90; 90; 120
3236.7Zheng Niu; Jian-Gong Ma; Wei Shi; Peng Cheng
Water molecule-driven reversible single-crystal to single-crystal transformation of a multi-metallic coordination polymer with controllable metal ion movement
Chem.Commun., 2014, 50, 1839
7111902 CIFC21 H22.5 Gd N3 O20.25P 3113.941; 13.941; 21.8405
90; 90; 120
3676Zheng Niu; Jian-Gong Ma; Wei Shi; Peng Cheng
Water molecule-driven reversible single-crystal to single-crystal transformation of a multi-metallic coordination polymer with controllable metal ion movement
Chem.Commun., 2014, 50, 1839
7111903 CIFC40 H37 Cu P2 SP -110.8776; 13.0996; 13.25
82.1651; 76.9886; 66.0524
1679.05Masahisa Osawa
Highly efficient blue-green delayed fluorescence from copper(I) thiolate complexes: luminescence color alteration by orientation change of the aryl ring
Chem.Commun., 2014, 50, 1801
7111904 CIFC48 H53 Cu P2 SP 1 21/n 113.8491; 21.0479; 14.1578
90; 91.5815; 90
4125.35Masahisa Osawa
Highly efficient blue-green delayed fluorescence from copper(I) thiolate complexes: luminescence color alteration by orientation change of the aryl ring
Chem.Commun., 2014, 50, 1801
7111905 CIFC29 H18 Eu N3 O7 SP 1 21/c 116.365; 11.123; 16.421
90; 119.828; 90
2593.1Yongqin Wei; Qiaohong Li; Rongjian Sa; Kechen Wu
A white-light-emitting LnMOF with color properties improved via Eu3+ doping: an alternative approach to a rational design for solid-state lighting
Chem.Commun., 2014, 50, 1820
7111906 CIFC29 H18 La N3 O7 SP 1 21/c 116.49; 11.144; 16.625
90; 120.16; 90
2641.5Yongqin Wei; Qiaohong Li; Rongjian Sa; Kechen Wu
A white-light-emitting LnMOF with color properties improved via Eu3+ doping: an alternative approach to a rational design for solid-state lighting
Chem.Commun., 2014, 50, 1820
7111907 CIFC21 H14 Cd Cl N3 O3 SP 1 21/c 17.155; 16.427; 17.896
90; 108.595; 90
1993.6Yongqin Wei; Qiaohong Li; Rongjian Sa; Kechen Wu
A white-light-emitting LnMOF with color properties improved via Eu3+ doping: an alternative approach to a rational design for solid-state lighting
Chem.Commun., 2014, 50, 1820
7111908 CIFC4 H11 N O3C 1 2/c 114.276; 5.6339; 14.3645
90; 94.598; 90
1151.6Francesca P. A. Fabbiani; Gernot Buth; Demetrius C. Levendis; Aurora; J.; Cruz-Cabeza'
Pharmaceutical hydrates under ambient conditions from high-pressure seeds: a case study of GABA monohydrate
Chem.Commun., 2014, 50, 1817
7111909 CIFC4 H11 N O3C 1 2/c 114.3799; 5.6552; 14.4202
90; 94.499; 90
1169.05Francesca P. A. Fabbiani; Gernot Buth; Demetrius C. Levendis; Aurora; J.; Cruz-Cabeza'
Pharmaceutical hydrates under ambient conditions from high-pressure seeds: a case study of GABA monohydrate
Chem.Commun., 2014, 50, 1817
7111910 CIFC16 H17 N O3 SP 1 21/c 115.908; 5.9035; 16.411
90; 102.783; 90
1503Ting Wu; Ling Pan; Xianxiu Xu; Qun Liu
Regiodivergent heterocyclization: a strategy for the synthesis of substituted pyrroles and furans using alpha-formyl ketene dithioacetals as common precursors
Chem.Commun., 2014, 50, 1797
7111911 CIFC19 H23 N O4 S2P -18.623; 10.8704; 10.8806
81.701; 86.189; 78.49
988.18Ting Wu; Ling Pan; Xianxiu Xu; Qun Liu
Regiodivergent heterocyclization: a strategy for the synthesis of substituted pyrroles and furans using alpha-formyl ketene dithioacetals as common precursors
Chem.Commun., 2014, 50, 1797
7111912 CIFC16 H17 N O3 SP -18.094; 9.747; 10.514
76.657; 81.203; 78.138
785Ting Wu; Ling Pan; Xianxiu Xu; Qun Liu
Regiodivergent heterocyclization: a strategy for the synthesis of substituted pyrroles and furans using alpha-formyl ketene dithioacetals as common precursors
Chem.Commun., 2014, 50, 1797
7111913 CIFC19 H16 O4 S2P 1 21/c 113.51; 8.068; 17.081
90; 107.751; 90
1773.2Ting Wu; Ling Pan; Xianxiu Xu; Qun Liu
Regiodivergent heterocyclization: a strategy for the synthesis of substituted pyrroles and furans using alpha-formyl ketene dithioacetals as common precursors
Chem.Commun., 2014, 50, 1797
7111914 CIFC38 H24 Fe N6 PtP -17.2452; 13.9706; 16.3779
73.531; 83.678; 89.998
1579.24Lucia Pineiro-Lopez; Maksym Seredyuk; M. Carmen Munoz; Jose A. Real
Two- and one-step cooperative spin transitions in Hofmann-like clathrates with enhanced loading capacity
Chem.Commun., 2014, 50, 1833
7111915 CIFC38 H24 Fe N6 PtP -17.3635; 14.1112; 16.3906
74.663; 82.349; 89.878
1626.86Lucia Pineiro-Lopez; Maksym Seredyuk; M. Carmen Munoz; Jose A. Real
Two- and one-step cooperative spin transitions in Hofmann-like clathrates with enhanced loading capacity
Chem.Commun., 2014, 50, 1833
7111916 CIFC38 H24 Fe N6 PtP -17.5174; 14.3676; 16.35
76.831; 84.282; 89.965
1710.5Lucia Pineiro-Lopez; Maksym Seredyuk; M. Carmen Munoz; Jose A. Real
Two- and one-step cooperative spin transitions in Hofmann-like clathrates with enhanced loading capacity
Chem.Commun., 2014, 50, 1833
7111917 CIFC30 H18 Fe N8 O4 PtP -17.2443; 13.8127; 15.4746
80.352; 87.669; 89.842
1525.26Lucia Pineiro-Lopez; Maksym Seredyuk; M. Carmen Munoz; Jose A. Real
Two- and one-step cooperative spin transitions in Hofmann-like clathrates with enhanced loading capacity
Chem.Commun., 2014, 50, 1833
7111918 CIFC30 H18 Fe N8 O4 PtP -17.4872; 14.3024; 15.0203
86.393; 84.502; 89.936
1597.9Lucia Pineiro-Lopez; Maksym Seredyuk; M. Carmen Munoz; Jose A. Real
Two- and one-step cooperative spin transitions in Hofmann-like clathrates with enhanced loading capacity
Chem.Commun., 2014, 50, 1833
7111919 CIFC59.5 H86 Cr2 N4C 1 2/c 125.96; 12.029; 37.245
90; 110.265; 90
10911Jingmei Shen; Glenn P. A. Yap; Klaus H. Theopold
Binding and activation of small molecules by a quintuply bonded chromium dimer
Chem.Commun., 2014, 50, 2579
7111920 CIFC52 H72 Cr2 N4 S2P 1 21/n 113.703; 19.311; 19.558
90; 99.039; 90
5111Jingmei Shen; Glenn P. A. Yap; Klaus H. Theopold
Binding and activation of small molecules by a quintuply bonded chromium dimer
Chem.Commun., 2014, 50, 2579
7111921 CIFC69 H94 Cr2 N6P -110.073; 13.461; 13.59
79.66; 81.58; 80.96
1777Jingmei Shen; Glenn P. A. Yap; Klaus H. Theopold
Binding and activation of small molecules by a quintuply bonded chromium dimer
Chem.Commun., 2014, 50, 2579
7111922 CIFC67.5 H95 Cr2 N5 O0.5P -113.946; 21.212; 22.202
70.368; 87.412; 80.55
6102Jingmei Shen; Glenn P. A. Yap; Klaus H. Theopold
Binding and activation of small molecules by a quintuply bonded chromium dimer
Chem.Commun., 2014, 50, 2579
7111923 CIFC82 H102 Cr2 N4 O3P -112.257; 13.447; 22.146
90.757; 100.752; 97.594
3551.9Jingmei Shen; Glenn P. A. Yap; Klaus H. Theopold
Binding and activation of small molecules by a quintuply bonded chromium dimer
Chem.Commun., 2014, 50, 2579
7111924 CIFC52 H58 Cr N4P 1 21/n 110.213; 23.838; 18.28
90; 97.142; 90
4416Jingmei Shen; Glenn P. A. Yap; Klaus H. Theopold
Binding and activation of small molecules by a quintuply bonded chromium dimer
Chem.Commun., 2014, 50, 2579
7111925 CIFC60 H41 Cl2 N O3 P2P -19.4462; 11.4419; 21.7054
77.79; 87.938; 84.139
2280.67Chunmiao Han; Liping Zhu; Fangchao Zhao; Zhen Zhang; Jianzhe Wang; Zhaopeng Deng; Hui Xu; Jing Li; Dongge Ma; Pengfei Yan
Suppressing triplet state extension for highly efficient ambipolar phosphine oxide host materials in blue PHOLEDs
Chem.Commun., 2014, 50, 2670
7111926 CIFC110 H138 N12 O56 Zn11P m -3 m20.6155; 20.6155; 20.6155
90; 90; 90
8761.6Xianqiang Huang; Yifa Chen; Zhengguo Lin; Xiaoqian Ren; Yuna Song; Zhenzhu Xu; Xinmei Dong; Xingguo Li; Changwen Hu; Bo Wang
Zn-BTC MOFs with active metal sites synthesized via a structure-directing approach for highly efficient carbon conversion
Chem.Commun., 2014, 50, 2624
7111927 CIFC36 H48 N6 O17 Zn4P 21 314.2941; 14.2941; 14.2941
90; 90; 90
2920.6Xianqiang Huang; Yifa Chen; Zhengguo Lin; Xiaoqian Ren; Yuna Song; Zhenzhu Xu; Xinmei Dong; Xingguo Li; Changwen Hu; Bo Wang
Zn-BTC MOFs with active metal sites synthesized via a structure-directing approach for highly efficient carbon conversion
Chem.Commun., 2014, 50, 2624
7111928 CIFC108 H36 N8 O94 Zn22P m -3 m20.4666; 20.4666; 20.4666
90; 90; 90
8573.1Xianqiang Huang; Yifa Chen; Zhengguo Lin; Xiaoqian Ren; Yuna Song; Zhenzhu Xu; Xinmei Dong; Xingguo Li; Changwen Hu; Bo Wang
Zn-BTC MOFs with active metal sites synthesized via a structure-directing approach for highly efficient carbon conversion
Chem.Commun., 2014, 50, 2624
7111929 CIFC98 H104 O15.5 Rb2P -19.3921; 16.1731; 28.6015
80.358; 89.767; 80.008
4216.81Alexander V. Zabula; Yulia V. Sevryugina; Sarah N. Spisak; Lesya Kobryn; Renata Sygula; Andrzej Sygula; Marina A. Petrukhina
An unsolvated buckycatcher and its first dianion
Chem.Commun., 2014, 50, 2657
7111930 CIFC60 H28P -19.8507; 14.1479; 15.1646
105.607; 102.809; 110.367
1788.1Alexander V. Zabula; Yulia V. Sevryugina; Sarah N. Spisak; Lesya Kobryn; Renata Sygula; Andrzej Sygula; Marina A. Petrukhina
An unsolvated buckycatcher and its first dianion
Chem.Commun., 2014, 50, 2657
7111931 CIFC26 H22 Br2 O2 S2P -19.2188; 14.566; 19.104
107.302; 92.63; 104.29
2353.6Dinesh G. (Dan) Patel; Ian M. Walton; Jordan M. Cox; Cody J. Gleason; David R. Butzer; Jason B. Benedict
Photoresponsive porous materials: the design and synthesis of photochromic diarylethene-based linkers and a metal-organic framework
Chem.Commun., 2014, 50, 2653
7111932 CIFC26 H20 Br2 O S2P -19.9642; 11.4661; 11.6872
89.573; 85.9664; 76.225
1293.59Dinesh G. (Dan) Patel; Ian M. Walton; Jordan M. Cox; Cody J. Gleason; David R. Butzer; Jason B. Benedict
Photoresponsive porous materials: the design and synthesis of photochromic diarylethene-based linkers and a metal-organic framework
Chem.Commun., 2014, 50, 2653
7111933 CIFC26 H20 Br2 S2C 1 2/c 19.3043; 21.4919; 11.002
90; 94.3179; 90
2193.79Dinesh G. (Dan) Patel; Ian M. Walton; Jordan M. Cox; Cody J. Gleason; David R. Butzer; Jason B. Benedict
Photoresponsive porous materials: the design and synthesis of photochromic diarylethene-based linkers and a metal-organic framework
Chem.Commun., 2014, 50, 2653
7111934 CIFC26 H18 O4 S2P 1 2/c 17.3757; 11.0027; 17.9502
90; 96.2569; 90
1448.03Dinesh G. (Dan) Patel; Ian M. Walton; Jordan M. Cox; Cody J. Gleason; David R. Butzer; Jason B. Benedict
Photoresponsive porous materials: the design and synthesis of photochromic diarylethene-based linkers and a metal-organic framework
Chem.Commun., 2014, 50, 2653
7111935 CIFC48 H42 O13 Zn4F m -3 m34.25; 34.25; 34.25
90; 90; 90
40177Dinesh G. (Dan) Patel; Ian M. Walton; Jordan M. Cox; Cody J. Gleason; David R. Butzer; Jason B. Benedict
Photoresponsive porous materials: the design and synthesis of photochromic diarylethene-based linkers and a metal-organic framework
Chem.Commun., 2014, 50, 2653
7111936 CIFC40 H34 F6 N10 O6 S2 ZnP -110.8863; 11.9081; 17.5294
71.881; 87.938; 76.949
2102.52Istvan Kocsis; Dan Dumitrescu; Yves-Marie Legrand; Arie van der Lee; Ion Grosu; Mihail Barboiu
Self-sorting of dynamic metallosupramolecular libraries (DMLs) via metal-driven selection
Chem.Commun., 2014, 50, 2621
7111937 CIFC20 H17 Ag F3 N5 O3 SP -19.2473; 10.7831; 12.8209
94.96; 107.524; 110.985
1110.81Istvan Kocsis; Dan Dumitrescu; Yves-Marie Legrand; Arie van der Lee; Ion Grosu; Mihail Barboiu
Self-sorting of dynamic metallosupramolecular libraries (DMLs) via metal-driven selection
Chem.Commun., 2014, 50, 2621
7111938 CIFC80 H68 F12 N20 O12 Pb2 S4I 1 2/c 123.4956; 11.8708; 31.4169
90; 98.953; 90
8655.8Istvan Kocsis; Dan Dumitrescu; Yves-Marie Legrand; Arie van der Lee; Ion Grosu; Mihail Barboiu
Self-sorting of dynamic metallosupramolecular libraries (DMLs) via metal-driven selection
Chem.Commun., 2014, 50, 2621
7111939 CIFC48 H52 Cu3 F18 N12 O24 S6P -112.4851; 12.9394; 13.0853
111.257; 105.181; 103.697
1767.31Istvan Kocsis; Dan Dumitrescu; Yves-Marie Legrand; Arie van der Lee; Ion Grosu; Mihail Barboiu
Self-sorting of dynamic metallosupramolecular libraries (DMLs) via metal-driven selection
Chem.Commun., 2014, 50, 2621
7111940 CIFC17 H24 N2 O5C 1 2/c 114.2575; 13.1713; 20.8636
90; 108.856; 90
3707.7Sudeshna Kar; Kung-Wei Wu; I-Jui Hsu; Chi-Rung Lee; Yian Tai
Study of the nano-morphological versatility by self-assembly of a peptide mimetic molecule in response to physical and chemical stimuli
Chem.Commun., 2014, 50, 2638
7111941 CIFC25 H18 B F10 N SP -110.647; 10.7328; 12.432
99.483; 110.618; 107.209
1211.29Christina Eller; Kathrin Bussmann; Gerald Kehr; Birgit Wibbeling; Constantin G. Daniliuc; Gerhard Erker
Ethene/alkyne exchange reaction at an intramolecular frustrated Lewis pair
Chem.Commun., 2014, 50, 1980
7111942 CIFC42 H33 B F10 SP -111.6658; 12.1737; 15.0272
102.447; 109.041; 102.988
1866.56Christina Eller; Kathrin Bussmann; Gerald Kehr; Birgit Wibbeling; Constantin G. Daniliuc; Gerhard Erker
Ethene/alkyne exchange reaction at an intramolecular frustrated Lewis pair
Chem.Commun., 2014, 50, 1980

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