Crystallography Open Database

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1514715 CIFC16 H12 N O2 SP 16.0479; 8.1021; 14.5564
81.543; 83.748; 72.375
670.83Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong
Pd-catalyzed oxidative C‒H/C‒H cross-coupling of pyridines with heteroarenes
Chemical Science, 2013, 4, 2163
1514716 CIFC13 H13 F3 N2 O4 SP -16.2339; 8.9683; 14.0067
81.624; 89.228; 75.671
750.42Samanta, Ramesh C.; De Sarkar, Suman; Fröhlich, Roland; Grimme, Stefan; Studer, Armido
N-Heterocyclic carbene (NHC) catalyzed chemoselective acylation of alcohols in the presence of amines with various acylating reagents
Chemical Science, 2013, 4, 2177
1514717 CIFC15 H17 F3 N2 O4 SP 1 21/c 19.6013; 7.0186; 25.4572
90; 92.806; 90
1713.44Samanta, Ramesh C.; De Sarkar, Suman; Fröhlich, Roland; Grimme, Stefan; Studer, Armido
N-Heterocyclic carbene (NHC) catalyzed chemoselective acylation of alcohols in the presence of amines with various acylating reagents
Chemical Science, 2013, 4, 2177
1514718 CIFC37 H49.95 Ga Mn N2 O2P 1 21/n 110.1814; 20.4882; 16.7346
90; 103.158; 90
3399.16Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514719 CIFC34 H41 Ga Mo N2 O5P 43 21 29.083; 9.083; 41.8928
90; 90; 90
3456.19Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514720 CIFC34 H41 Ga N2 O5 WP b n m9.15777; 35.5896; 21.105
90; 90; 90
6878.57Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514721 CIFC36 H41 Co2 Ga N2 O7P -18.8239; 19.5134; 21.404
90.0148; 89.9906; 90.0029
3685.43Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514722 CIFC33 H42 Ga Mn N2 O4P 1 21/m 18.86; 21.5544; 9.0818
90; 108.601; 90
1643.77Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514723 CIFC33 H41 Cl Co Ga N2 O4C 1 2/c 121.4272; 16.8902; 21.5723
90; 108.729; 90
7393.79Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514724 CIFC37 H48 Ga Mn N2 O2P -18.8327; 18.3781; 20.6752
90.0077; 90.0065; 85.7423
3346.91Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514725 CIFC65 H53 B Co F24 Ga N2 O4P -112.5663; 13.2686; 20.7262
78.4857; 83.9447; 83.4912
3352.25Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon
Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH}
Chemical Science, 2013, 4, 4245
1514726 CIFC16 H16 O4 SP -110.8453; 12.173; 12.2364
109.364; 106.53; 98.626
1406.8Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V.
The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus
Chemical Science, 2013, 4, 4267
1514727 CIFC16 H14 Cl2 O4P -13.9099; 13.413; 14.207
82.606; 86.888; 82.453
731.9Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V.
The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus
Chemical Science, 2013, 4, 4267
1514728 CIFC34 H30 Au O4 P S2P c a 2123.574; 11.1504; 23.342
90; 90; 90
6135.7Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V.
The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus
Chemical Science, 2013, 4, 4267
1514729 CIFC15.5 H15 Cl3 N2 Pt SP -19.6661; 13.0872; 15.6977
111.029; 90.575; 108.683
1738.24Rosen, Mari S.; Stern, Charlotte L.; Mirkin, Chad A.
Heteroligated PtII Weak-Link Approach complexes using hemilabile N-heterocyclic carbene‒thioether and phosphino‒thioether ligands
Chemical Science, 2013, 4, 4193
1514730 CIFC35 H33 B Cl F4 N2 P Pt S2P -19.4153; 12.0408; 16.6958
102.425; 100.136; 104.304
1737.82Rosen, Mari S.; Stern, Charlotte L.; Mirkin, Chad A.
Heteroligated PtII Weak-Link Approach complexes using hemilabile N-heterocyclic carbene‒thioether and phosphino‒thioether ligands
Chemical Science, 2013, 4, 4193
1514731 CIFC35 H33 B2 F8 N2 P Pt S2P 1 21/c 110.295; 9.8283; 34.0318
90; 94.67; 90
3431.99Rosen, Mari S.; Stern, Charlotte L.; Mirkin, Chad A.
Heteroligated PtII Weak-Link Approach complexes using hemilabile N-heterocyclic carbene‒thioether and phosphino‒thioether ligands
Chemical Science, 2013, 4, 4193
1514732 CIFC30 H42 N2 SiP 1 21/a 115.1354; 9.24; 20.128
90; 101.781; 90
2755.63Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P.
Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis
Chemical Science, 2013, 4, 4212
1514733 CIFC38 H58 Mg N2 O2 SiP -111.294; 12.168; 13.604
96.759; 90.61; 90.961
1856.13Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P.
Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis
Chemical Science, 2013, 4, 4212
1514734 CIFC44 H68 Mg N2 O3.5 SiP 1 21/n 110.031; 30.017; 16.556
90; 104.903; 90
4817.34Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P.
Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis
Chemical Science, 2013, 4, 4212
1514735 CIFC49 H72 Ca N2 O3 SiP 1 21/n 110.2642; 22.7621; 20.7835
90; 98.249; 90
4805.5Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P.
Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis
Chemical Science, 2013, 4, 4212
1514736 CIFC46 H71 N2 O4 Si SrP 1 21 110.37; 18.852; 12.632
90; 113.607; 90
2262.83Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P.
Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis
Chemical Science, 2013, 4, 4212
1514737 CIFC20 H18 F3 N3 O3C 1 2/c 127.371; 7.0453; 18.8951
90; 99.01; 90
3598.7Lee, Min Hee; Yoon, Byungkwon; Kim, Jong Seung; Sessler, Jonathan L.
Naphthalimide trifluoroacetyl acetonate: a hydrazine-selective chemodosimetric sensor
Chemical Science, 2013, 4, 4121
1514738 CIFC47 H77 N2 Na O3 ZnP 21 21 2111.948; 15.878; 24.9404
90; 90; 90
4731.5Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva
Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion
Chemical Science, 2013, 4, 4259
1514739 CIFC35 H54 N2 ZnP -19.7795; 10.1033; 20.1669
90.336; 103.989; 118.932
1674.4Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva
Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion
Chemical Science, 2013, 4, 4259
1514740 CIFC71 H127 N2 Na O7 Zn2P 1 21/c 112.5177; 33.2445; 18.2146
90; 100.694; 90
7448.3Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva
Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion
Chemical Science, 2013, 4, 4259
1514741 CIFC39 H63 Li N2 ZnP b c a21.8628; 22.1892; 31.9347
90; 90; 90
15492.1Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva
Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion
Chemical Science, 2013, 4, 4259
1514742 CIFC45 H50 Au2 Cl N2 PP -19.2833; 14.4759; 16.9188
68.109; 81.38; 86.27
2085.74Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva
Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion
Chemical Science, 2013, 4, 4259
1514743 CIFC18 H12 Br F3 O2P 1 21 111.822; 47.948; 12.119
90; 104.545; 90
6649Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D.
Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study
Chemical Science, 2013, 4, 4146
1514744 CIFC22 H19 F3 O2P 1 21 16.039; 27.449; 11.299
90; 104.404; 90
1814Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D.
Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study
Chemical Science, 2013, 4, 4146
1514745 CIFC19 H20 N2 SP 21 21 217.934; 10.719; 18.419
90; 90; 90
1566.4Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D.
Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study
Chemical Science, 2013, 4, 4146
1514746 CIFC18 H17 F3 O2C 1 2 119.358; 9.419; 8.186
90; 90.979; 90
1492.4Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D.
Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study
Chemical Science, 2013, 4, 4146
1514747 CIFC31 H32 Cl2 N2 O4P -18.3666; 10.8236; 17.2119
84.42; 79.713; 75.288
1481.1Ghorai, Suman; Sumrak, Joseph C.; Hutchins, Kristin M.; Bučar, Dejan-Krešimir; Tivanski, Alexei V.; MacGillivray, Leonard R.
From co-crystals to functional thin films: photolithography using [2+2] photodimerization
Chemical Science, 2013, 4, 4304
1514748 CIFC160 H178 Cd3 N14 O27 Ti4P 6 2 232.0273; 32.0273; 29.1427
90; 90; 120
25888.2Xuan, Weimin; Ye, Chengcheng; Zhang, Mengni; Chen, Zhijie; Cui, Yong
A chiral porous metallosalan-organic framework containing titanium-oxo clusters for enantioselective catalytic sulfoxidation
Chemical Science, 2013, 4, 3154
1514749 CIFC24 H16 B2 O3P 1 21/n 19.4797; 45.49; 21.7415
90; 92.764; 90
9364.7Dimitrijević, Elena; Taylor, Mark S.
9-Hetero-10-boraanthracene-derived borinic acid catalysts for regioselective activation of polyols
Chemical Science, 2013, 4, 3298
1514750 CIFC26 H22 B2 N2 OP b c a10.6981; 14.3379; 26.3743
90; 90; 90
4045.5Dimitrijević, Elena; Taylor, Mark S.
9-Hetero-10-boraanthracene-derived borinic acid catalysts for regioselective activation of polyols
Chemical Science, 2013, 4, 3298
1514752 CIFC47 H97 N O6 S Si9P -113.583; 15.995; 16.961
110.618; 111.892; 93.2
3125.1Brady, Patrick B.; Albert, Brian J.; Akakura, Matsujiro; Yamamoto, Hisashi
Controlling stereochemistry in polyketide synthesis: 1,3- vs. 1,2-asymmetric induction in methyl ketone aldol additions to β-super siloxy aldehydes
Chemical Science, 2013, 4, 3223
1514754 CIFC79.5 H115.5 Co3 N8.5 O34.5P n m a17.564; 25.629; 20.8
90; 90; 90
9363Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters
Chemical Science, 2013, 4, 3232
1514755 CIFC79.5 H109.5 Co3 N8.5 O31.5P n m a17.5608; 25.3474; 20.8804
90; 90; 90
9294.3Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters
Chemical Science, 2013, 4, 3232
1514756 CIFC78 H106 Co3 N8 O31P n m a17.446; 27.758; 18.762
90; 90; 90
9086Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters
Chemical Science, 2013, 4, 3232
1514757 CIFC122 H178 Co6 N14 O46I m -327.2496; 27.2496; 27.2496
90; 90; 90
20233.9Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters
Chemical Science, 2013, 4, 3232
1514759 CIFC18 H18 I2 O2P 21 21 217.7537; 8.7833; 28.0793
90; 90; 90
1912.29Gómez-Bengoa, Enrique; García, Jesús M.; Jiménez, Sandra; Lapuerta, Irati; Mielgo, Antonia; Odriozola, José M.; Otazo, Itziar; Razkin, Jesús; Urruzuno, Iñaki; Vera, Silvia; Oiarbide, Mikel; Palomo, Claudio
Asymmetric synthesis of propargylic alcohols via aldol reaction of aldehydes with ynals promoted by prolinol ether‒transition metal‒Brønsted acid cooperative catalysis
Chemical Science, 2013, 4, 3198
1514762 CIFC95 H74 B Cl6 O4 P2 RhP 1 21/c 119.3718; 20.1092; 21.506
90; 93.7932; 90
8359.34Raskatov, Jevgenij A.; Thompson, Amber L.; Cowley, Andrew R.; Claridge, Timothy D. W.; Brown, John M.
Chiral recognition in contact ion-pairs; observation, characterization and analysis
Chemical Science, 2013, 4, 3140
1514763 CIFC98 H80 B Cl6 O5 P2 RhP 21 21 2115.7224; 20.2138; 25.7426
90; 90; 90
8181.2Raskatov, Jevgenij A.; Thompson, Amber L.; Cowley, Andrew R.; Claridge, Timothy D. W.; Brown, John M.
Chiral recognition in contact ion-pairs; observation, characterization and analysis
Chemical Science, 2013, 4, 3140
1514764 CIFC96 H76 B Cl8 O4 P2 RhP 1 21 111.8286; 25.5279; 14.3047
90; 111.974; 90
4005.65Raskatov, Jevgenij A.; Thompson, Amber L.; Cowley, Andrew R.; Claridge, Timothy D. W.; Brown, John M.
Chiral recognition in contact ion-pairs; observation, characterization and analysis
Chemical Science, 2013, 4, 3140
1514765 CIFC200 H256 Si8P 1 2/n 116.179; 17.461; 32.012
90; 95.835; 90
8997Matsuno, Taisuke; Kamata, Sho; Hitosugi, Shunpei; Isobe, Hiroyuki
Bottom-up synthesis and structures of π-lengthened tubular macrocycles
Chemical Science, 2013, 4, 3179
1514766 CIFC58 H78 Br6 Dy N9 O14 Zn2P b c a22.0395; 16.0165; 39.3819
90; 90; 90
13901.6Liu, Jun-Liang; Chen, Yan-Cong; Zheng, Yan-Zhen; Lin, Wei-Quan; Ungur, Liviu; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Tong, Ming-Liang
Switching the anisotropy barrier of a single-ion magnet by symmetry change from quasi-D5h to quasi-Oh
Chemical Science, 2013, 4, 3310
1514767 CIFC54 H62 Br6 Dy N9 O10 Zn2P b c a20.5186; 16.4699; 37.585
90; 90; 90
12701.4Liu, Jun-Liang; Chen, Yan-Cong; Zheng, Yan-Zhen; Lin, Wei-Quan; Ungur, Liviu; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Tong, Ming-Liang
Switching the anisotropy barrier of a single-ion magnet by symmetry change from quasi-D5h to quasi-Oh
Chemical Science, 2013, 4, 3310
1514768 CIFC58 H78 Br6 Dy N9 O14 Zn2P b c a21.893; 15.9613; 39.306
90; 90; 90
13735.1Liu, Jun-Liang; Chen, Yan-Cong; Zheng, Yan-Zhen; Lin, Wei-Quan; Ungur, Liviu; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Tong, Ming-Liang
Switching the anisotropy barrier of a single-ion magnet by symmetry change from quasi-D5h to quasi-Oh
Chemical Science, 2013, 4, 3310
1514769 CIFC67 H101 Ag2 F3 N4 O6 SP -110.5882; 16.8592; 20.8
74.883; 79.955; 76.103
3454.7Tate, Brandon K.; Wyss, Chelsea M.; Bacsa, John; Kluge, Kelly; Gelbaum, Leslie; Sadighi, Joseph P.
A dinuclear silver hydride and an umpolung reaction of CO2
Chemical Science, 2013, 4, 3068
1514770 CIFC63 H93 Ag2 F3 N4 O5 SP 1 21/n 114.8245; 23.508; 19.9054
90; 110.118; 90
6513.7Tate, Brandon K.; Wyss, Chelsea M.; Bacsa, John; Kluge, Kelly; Gelbaum, Leslie; Sadighi, Joseph P.
A dinuclear silver hydride and an umpolung reaction of CO2
Chemical Science, 2013, 4, 3068
1514771 CIFC44 H38 F6 N4 O8 S2P -111.445; 12.104; 17.978
77.35; 76.4; 65.63
2184Wang, Kai; Huang, Shuo; Zhang, Yu; Zhao, Shanshan; Zhang, Hongyu; Wang, Yue
Multicolor fluorescence and electroluminescence of an ICT-type organic solid tuned by modulating the accepting nature of the central core
Chemical Science, 2013, 4, 3288
1514772 CIFC40 H28 N4 S2P 1 21/c 19.6569; 10.14; 18.898
90; 118.42; 90
1627.5Wang, Kai; Huang, Shuo; Zhang, Yu; Zhao, Shanshan; Zhang, Hongyu; Wang, Yue
Multicolor fluorescence and electroluminescence of an ICT-type organic solid tuned by modulating the accepting nature of the central core
Chemical Science, 2013, 4, 3288
1514773 CIFC24 H14P 1 21/c 111.6522; 5.4552; 11.4821
90; 90.607; 90
729.82Shan, Liang; Liang, Zhixiong; Xu, Xiaomin; Tang, Qin; Miao, Qian
Revisiting zethrene: synthesis, reactivity and semiconductor properties
Chemical Science, 2013, 4, 3294
1514774 CIFC216 H289 Cl2 Gd36 N51 O193P -121.545; 23.046; 23.372
94.535; 115.193; 115.679
8956Wu, Mingyan; Jiang, Feilong; Kong, Xiangjian; Yuan, Daqiang; Long, Lasheng; Al-Thabaiti, Shaeel A.; Hong, Maochun
Two polymeric 36-metal pure lanthanide nanosize clusters
Chemical Science, 2013, 4, 3104
1514775 CIFC216 H289 Cl2 Dy36 N51 O193P -121.545; 22.886; 23.17
94.32; 115.373; 115.639
8817Wu, Mingyan; Jiang, Feilong; Kong, Xiangjian; Yuan, Daqiang; Long, Lasheng; Al-Thabaiti, Shaeel A.; Hong, Maochun
Two polymeric 36-metal pure lanthanide nanosize clusters
Chemical Science, 2013, 4, 3104
1514780 CIFC28 H32 F9 La N9 O10 P S4P 1 21/n 111.106; 16.93; 22
90; 91.61; 90
4134.9Löble, Matthias W.; Oña-Burgos, Pascual; Fernández, Ignacio; Apostolidis, Christos; Morgenstern, Alfred; Walter, Olaf; Bruchertseifer, Frank; Kaden, Peter; Vitova, Tonya; Rothe, Jörg; Dardenne, Kathy; Banik, Nidhu L.; Geist, Andreas; Denecke, Melissa A.; Breher, Frank
Exploring the solution behavior of f-element coordination compounds: a case study on some trivalent rare earth and plutonium complexes
Chemical Science, 2013, 4, 3717
1514781 CIFC54 H61 F18 N19 O19 P2 S8 Sm2P 1 21/c 19.764; 19.857; 22.899
90; 97.37; 90
4403.1Löble, Matthias W.; Oña-Burgos, Pascual; Fernández, Ignacio; Apostolidis, Christos; Morgenstern, Alfred; Walter, Olaf; Bruchertseifer, Frank; Kaden, Peter; Vitova, Tonya; Rothe, Jörg; Dardenne, Kathy; Banik, Nidhu L.; Geist, Andreas; Denecke, Melissa A.; Breher, Frank
Exploring the solution behavior of f-element coordination compounds: a case study on some trivalent rare earth and plutonium complexes
Chemical Science, 2013, 4, 3717
1514782 CIFC30 H33 F9 N12 O9 P Pu S4P -113.2866; 13.3751; 13.849
83.93; 70.156; 80.123
2277.65Löble, Matthias W.; Oña-Burgos, Pascual; Fernández, Ignacio; Apostolidis, Christos; Morgenstern, Alfred; Walter, Olaf; Bruchertseifer, Frank; Kaden, Peter; Vitova, Tonya; Rothe, Jörg; Dardenne, Kathy; Banik, Nidhu L.; Geist, Andreas; Denecke, Melissa A.; Breher, Frank
Exploring the solution behavior of f-element coordination compounds: a case study on some trivalent rare earth and plutonium complexes
Chemical Science, 2013, 4, 3717
1514783 CIFC17 H20 N4 NiP 1 21/c 114.9461; 7.3243; 15.6793
90; 112.463; 90
1586.18Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B.
Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii)
Chemical Science, 2013, 4, 3636
1514784 CIFC36 H40 F6 N8 Ni2 O6 S2P -110.076; 10.6657; 19.6623
90.05; 97.94; 105.384
2016.3Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B.
Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii)
Chemical Science, 2013, 4, 3636
1514785 CIFC25 H36 K N4 Ni O2P 1 21/n 110.5982; 12.3634; 19.8165
90; 95.155; 90
2586Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B.
Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii)
Chemical Science, 2013, 4, 3636
1514786 CIFC23 H29 F12 N7 Ni P2C 1 c 19.223; 23.7522; 15.2139
90; 107.35; 90
3181.2Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B.
Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii)
Chemical Science, 2013, 4, 3636
1514787 CIFC35 H56 K N6 Ni O6P 1 21/c 112.7277; 21; 28.837
90; 99.126; 90
7610Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B.
Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii)
Chemical Science, 2013, 4, 3636
1514788 CIFC70 H106 K2 N12 Ni O12C 1 2/c 134.46; 10.852; 23.144
90; 100.903; 90
8499Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B.
Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii)
Chemical Science, 2013, 4, 3636
1514789 CIFC31 H22 N2P b c a9.7242; 17.6641; 25.6425
90; 90; 90
4404.59Yang, Zhiyong; Qin, Wei; Lam, Jacky W. Y.; Chen, Sijie; Sung, Herman H. Y.; Williams, Ian D.; Tang, Ben Zhong
Fluorescent pH sensor constructed from a heteroatom-containing luminogen with tunable AIE and ICT characteristics
Chemical Science, 2013, 4, 3725
1514790 CIFC17 H15 N OP 1 21/c 19.1485; 13.8946; 10.4647
90; 102.948; 90
1296.4Cui, Sunliang; Zhang, Yan; Wu, Qifan
Rh(iii)-catalyzed C‒H activation/cycloaddition of benzamides and methylenecyclopropanes: divergence in ring formation
Chemical Science, 2013, 4, 3421
1514791 CIFC19.5 H18.5 Cl2.5 N OP 1 21/c 123.247; 9.9836; 16.0069
90; 90.649; 90
3714.8Cui, Sunliang; Zhang, Yan; Wu, Qifan
Rh(iii)-catalyzed C‒H activation/cycloaddition of benzamides and methylenecyclopropanes: divergence in ring formation
Chemical Science, 2013, 4, 3421
1514792 CIFC16 H14 Cl3 N O2P b c a9.7761; 14.7382; 24.0669
90; 90; 90
3467.6Cui, Sunliang; Zhang, Yan; Wu, Qifan
Rh(iii)-catalyzed C‒H activation/cycloaddition of benzamides and methylenecyclopropanes: divergence in ring formation
Chemical Science, 2013, 4, 3421
1514793 CIFC17 H15 N O2P 21 21 216.4122; 12.077; 16.676
90; 90; 90
1291.4Ozaki, Kyohei; Zhang, Hua; Ito, Hideto; Lei, Aiwen; Itami, Kenichiro
One-shot indole-to-carbazole π-extension by a Pd‒Cu‒Ag trimetallic system
Chemical Science, 2013, 4, 3416
1514794 CIFC24.5 H28.5 Cl1.5 N4 O6 RuP 1 21/c 18.906; 17.7086; 17.021
90; 91.073; 90
2684Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W.
Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study
Chemical Science, 2013, 4, 3731
1514795 CIFC34 H31 Cl3 N4 O6 RuC 1 2/c 123.297; 12.4626; 25.803
90; 115.977; 90
6734.8Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W.
Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study
Chemical Science, 2013, 4, 3731
1514796 CIFC66 H58 Cl4 Co2 N8 O21P -19.1898; 11.3905; 16.2931
78.018; 82.142; 76.846
1617.39Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W.
Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study
Chemical Science, 2013, 4, 3731
1514797 CIFC14 H17 Br N2 O4 SP 21 21 217.6678; 13.5683; 14.958
90; 90; 90
1556.2Miles, Dillon H.; Veguillas, Marcos; Toste, F. Dean
Gold(i)-catalyzed enantioselective bromocyclization reactions of allenes
Chemical Science, 2013, 4, 3427
1514798 CIFC21 H18 Cu N5 O4P 1 21/c 19.876; 9.295; 22.594
90; 106.8; 90
1985.5Chen, Yong-Qiang; Li, Guo-Rong; Chang, Ze; Qu, Yang-Kun; Zhang, Ying-Hui; Bu, Xian-He
A Cu(i) metal‒organic framework with 4-fold helical channels for sensing anions
Chemical Science, 2013, 4, 3678
1514799 CIFC20 H16 Cu N5 O4P 1 21/c 19.399; 9.848; 21.834
90; 102.09; 90
1976.2Chen, Yong-Qiang; Li, Guo-Rong; Chang, Ze; Qu, Yang-Kun; Zhang, Ying-Hui; Bu, Xian-He
A Cu(i) metal‒organic framework with 4-fold helical channels for sensing anions
Chemical Science, 2013, 4, 3678
1514800 CIFC21 H18 Cu N5 O4P 1 21/c 19.93; 9.3445; 22.717
90; 106.94; 90
2016.5Chen, Yong-Qiang; Li, Guo-Rong; Chang, Ze; Qu, Yang-Kun; Zhang, Ying-Hui; Bu, Xian-He
A Cu(i) metal‒organic framework with 4-fold helical channels for sensing anions
Chemical Science, 2013, 4, 3678
1514801 CIFC24 H28 Cl3 N O6 Pd SP 1 21 19.3736; 15.178; 10.1053
90; 107.302; 90
1372.7Yamaguchi, Kazuya; Kondo, Hiroki; Yamaguchi, Junichiro; Itami, Kenichiro
Aromatic C‒H coupling with hindered arylboronic acids by Pd/Fe dual catalysts
Chemical Science, 2013, 4, 3753
1514802 CIFC45 H51 N3 P3 VP -110.0198; 11.1462; 19.6789
85.018; 79.607; 74.258
2078.99Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M.
Vanadium‒iron complexes featuring metal‒metal multiple bonds
Chemical Science, 2013, 4, 3557
1514803 CIFC48 H57 Fe I N3 O0.75 P3 VP -110.7003; 22.3479; 22.519
62.001; 81.313; 88.637
4693.3Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M.
Vanadium‒iron complexes featuring metal‒metal multiple bonds
Chemical Science, 2013, 4, 3557
1514804 CIFC48 H60 Fe N3 P4 VP -3 c 116.3841; 16.3841; 22.8729
90; 90; 120
5317.4Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M.
Vanadium‒iron complexes featuring metal‒metal multiple bonds
Chemical Science, 2013, 4, 3557
1514805 CIFC60 H69 Fe N4 P4 VP 1 21/c 113.0944; 14.5742; 28.469
90; 95.9356; 90
5403.9Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M.
Vanadium‒iron complexes featuring metal‒metal multiple bonds
Chemical Science, 2013, 4, 3557
1514806 CIFC48 H57 F Fe I N3 O0.75 P3 VP -110.7611; 22.0867; 22.4678
63.268; 80.585; 85.642
4705.1Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M.
Vanadium‒iron complexes featuring metal‒metal multiple bonds
Chemical Science, 2013, 4, 3557
1514807 CIFC10 H20 Cl2 N4 NiP 1 21/n 18.0672; 13.6398; 12.88
90; 100.756; 90
1392.4Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514808 CIFC6 H13 Cl2 N2 PP b c a7.768; 12.985; 19.423
90; 90; 90
1959.1Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514809 CIFC11 H15 Cl2 N2 PC 1 2/c 119.24; 11.531; 15.038
90; 128.66; 90
2605.2Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514810 CIFC5 H10 Cl3 N2 PP 1 21/c 111.4381; 7.717; 12.979
90; 122.697; 90
964.09Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514811 CIFC10 H20 Cl2 N4 PdP 1 21/n 18.9858; 12.0174; 13.4315
90; 104.706; 90
1402.9Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514812 CIFC5 H11 F4 N2 PP -17.375; 7.56; 8.6846
74.688; 76.04; 62.6
410.6Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514813 CIFC5 H10 Cl4 N2 SiP b c a12.8424; 12.65; 13.2356
90; 90; 90
2150.21Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker
(NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform
Chemical Science, 2013, 4, 77
1514814 CIFC26 H18 FeP -17.1257; 9.7812; 14.6087
74.587; 81.231; 70.49
922.94Gietter, Amber A. S.; Pupillo, Rachel C.; Yap, Glenn P. A.; Beebe, Thomas P.; Rosenthal, Joel; Watson, Donald A.
On-surface cross-coupling methods for the construction of modified electrode assemblies with tailored morphologies
Chemical Science, 2013, 4, 437
1514815 CIFC25 H21 Fe N3P 1 21 111.3194; 5.7682; 14.8959
90; 94.364; 90
969.77Gietter, Amber A. S.; Pupillo, Rachel C.; Yap, Glenn P. A.; Beebe, Thomas P.; Rosenthal, Joel; Watson, Donald A.
On-surface cross-coupling methods for the construction of modified electrode assemblies with tailored morphologies
Chemical Science, 2013, 4, 437
1514816 CIFC24 H18 FeP 1 21/c 121.166; 9.936; 8.1878
90; 92.968; 90
1719.6Gietter, Amber A. S.; Pupillo, Rachel C.; Yap, Glenn P. A.; Beebe, Thomas P.; Rosenthal, Joel; Watson, Donald A.
On-surface cross-coupling methods for the construction of modified electrode assemblies with tailored morphologies
Chemical Science, 2013, 4, 437
1514817 CIFC18 H12 O2C 1 c 120.7703; 20.6316; 23.952
90; 102.233; 90
10031Cheng, Ming; Yan, Jianwei; Hu, Feng; Chen, Hong; Hu, Youhong
Palladium-catalyzed cascade reactions of 3-iodochromones with aryl iodides and norbornadiene leading to annulated xanthones
Chemical Science, 2013, 4, 526
1514818 CIFC10 H17 Cl N4 Ni O6P 1 21/n 17.3309; 16.9368; 12.1796
90; 95.441; 90
1505.43Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514819 CIFC22 H40 Cl2 N8.5 Ni O10 ZnP 1 21/n 111.5005; 20.8961; 14.2514
90; 109.637; 90
3225.65Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514820 CIFC22 H42 Cl2 N8 Ni O10 ZnP 1 21/n 111.5533; 22.0368; 12.9726
90; 104.81; 90
3193.1Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514821 CIFC21 H40 Cl N7 Ni O8 ZnC 1 2/c 118.853; 18.337; 16.409
90; 90.05; 90
5673Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514822 CIFC19 H37 Cl N8 Ni O8 ZnP 18.5274; 12.4106; 13.0776
98.754; 96.004; 90.074
1360.17Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514823 CIFC110 H150 B2 Cl2 N18 Ni2 O16 Zn2P -111.7327; 15.5512; 17.9328
67.784; 71.146; 77.96
2852.6Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514824 CIFC61 H89 B N7 Ni O6.5 ZnP -111.9784; 19.7901; 26.294
104.912; 91.396; 98.3
5947.7Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514825 CIFC77 H100 B N7 Ni O6 P ZnP 1 21/c 121.7065; 13.6234; 24.045
90; 90.533; 90
7110.2Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514826 CIFC55 H74 B N7 Ni O5 ZnP 1 21/c 117.2117; 12.9449; 24.7109
90; 101.43; 90
5396.5Uyeda, Christopher; Peters, Jonas C.
Access to formally Ni(i) states in a heterobimetallic NiZn system
Chemical Science, 2013, 4, 157
1514827 CIFC57 H72 N14 O15P -114.1445; 14.338; 16.719
86.271; 81.687; 61.358
2944.5Moore, Stephen J.; Haynes, Cally J. E.; González, Jorge; Sutton, Jennifer L.; Brooks, Simon J.; Light, Mark E.; Herniman, Julie; Langley, G. John; Soto-Cerrato, Vanessa; Pérez-Tomás, Ricardo; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Gale, Philip A.
Chloride, carboxylate and carbonate transport by ortho-phenylenediamine-based bisureas
Chemical Science, 2013, 4, 103
1514828 CIFC38 H33 Co F9 N8 O6 S2C 1 2/c 123.898; 15.593; 23.95
90; 109.468; 90
8414.5Sun, Yujie; Sun, Jianwei; Long, Jeffrey R.; Yang, Peidong; Chang, Christopher J.
Photocatalytic generation of hydrogen from water using a cobalt pentapyridine complex in combination with molecular and semiconductor nanowire photosensitizers
Chemical Science, 2013, 4, 118
1514830 CIFC20 H18 Fe O4 SiP 1 21 17.151; 29.386; 9.6851
90; 100.773; 90
1999.4Williams, David R.; Shah, Akshay A.; Mazumder, Shivnath; Baik, Mu-Hyun
Studies of iron-mediated Pauson‒Khand reactions of 1,1-disubstituted-allenylsilanes: mechanistic implications for a reactive three-membered iron metallacycle
Chemical Science, 2013, 4, 238
1514831 CIFC25 H38 O2 Si2P 1 21/n 112.129; 8.192; 26.318
90; 102.587; 90
2552.1Williams, David R.; Shah, Akshay A.; Mazumder, Shivnath; Baik, Mu-Hyun
Studies of iron-mediated Pauson‒Khand reactions of 1,1-disubstituted-allenylsilanes: mechanistic implications for a reactive three-membered iron metallacycle
Chemical Science, 2013, 4, 238
1514832 CIFC30 H52 Fe N2 Si2P -18.8101; 9.1759; 11.1624
102.467; 92.503; 113.932
796.59Zadrozny, Joseph M.; Atanasov, Mihail; Bryan, Aimee M.; Lin, Chun-Yi; Rekken, Brian D.; Power, Philip P.; Neese, Frank; Long, Jeffrey R.
Slow magnetization dynamics in a series of two-coordinate iron(ii) complexes
Chemical Science, 2013, 4, 125
1514833 CIFC60 H76 Fe0.93 N2P 1 21/n 110.8937; 20.234; 11.2231
90; 90.829; 90
2473.6Zadrozny, Joseph M.; Atanasov, Mihail; Bryan, Aimee M.; Lin, Chun-Yi; Rekken, Brian D.; Power, Philip P.; Neese, Frank; Long, Jeffrey R.
Slow magnetization dynamics in a series of two-coordinate iron(ii) complexes
Chemical Science, 2013, 4, 125
1514834 CIFC18.87 H19.16 N2 O2 ZnI b c a13.9562; 23.5904; 23.5858
90; 90; 90
7765.2He, Chun-Ting; Tian, Jing-Yu; Liu, Si-Yang; Ouyang, Gangfeng; Zhang, Jie-Peng; Chen, Xiao-Ming
A porous coordination framework for highly sensitive and selective solid-phase microextraction of non-polar volatile organic compounds
Chemical Science, 2013, 4, 351
1514835 CIFC12 H10 N2 O2 ZnI b c a13.9249; 23.653; 23.637
90; 90; 90
7785.2He, Chun-Ting; Tian, Jing-Yu; Liu, Si-Yang; Ouyang, Gangfeng; Zhang, Jie-Peng; Chen, Xiao-Ming
A porous coordination framework for highly sensitive and selective solid-phase microextraction of non-polar volatile organic compounds
Chemical Science, 2013, 4, 351
1514836 CIFC58 H60 Au2 I2 O2 P4P -111.83; 11.9725; 12.3591
65.098; 69.838; 65.309
1411.99Lim, Sang Ho; Olmstead, Marilyn M.; Balch, Alan L.
Inorganic topochemistry. Vapor-induced solid state transformations of luminescent, three-coordinate gold(i) complexes
Chemical Science, 2013, 4, 311
1514837 CIFC51 H62 N3 NiP 1 21/n 112.2859; 20.3988; 17.3454
90; 99.232; 90
4290.8Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L.
Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation
Chemical Science, 2013, 4, 170
1514838 CIFC59 H78 Cl4 N3 NiP 1 21/c 121.2763; 10.7269; 24.4104
90; 97.053; 90
5529Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L.
Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation
Chemical Science, 2013, 4, 170
1514839 CIFC87 H84 B F24 N3 Ni OP 1 21/n 112.9077; 34.624; 19.65
90; 107.756; 90
8363.6Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L.
Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation
Chemical Science, 2013, 4, 170
1514840 CIFC197 H204 B2 F48 N6 Ni2 O4P -114.7621; 16.7885; 21.465
102.291; 106.901; 105.812
4644.3Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L.
Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation
Chemical Science, 2013, 4, 170
1514841 CIFC93 H96 B F24 N3 Ni OP 1 21/c 112.7476; 20.1891; 33.921
90; 90.696; 90
8729.4Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L.
Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation
Chemical Science, 2013, 4, 170
1514842 CIFC30 H27 B F15 O2 P SP 1 21/c 19.4942; 29.0008; 11.5368
90; 90.018; 90
3176.5Sajid, Muhammad; Klose, Annika; Birkmann, Birgit; Liang, Liyuan; Schirmer, Birgitta; Wiegand, Thomas; Eckert, Hellmut; Lough, Alan J.; Fröhlich, Roland; Daniliuc, Constantin G.; Grimme, Stefan; Stephan, Douglas W.; Kehr, Gerald; Erker, Gerhard
Reactions of phosphorus/boron frustrated Lewis pairs with SO2
Chemical Science, 2013, 4, 213
1514843 CIFC33 H28 B F10 O2 P SP -113.2898; 13.3521; 22.579
73.392; 73.073; 83.328
3670.7Sajid, Muhammad; Klose, Annika; Birkmann, Birgit; Liang, Liyuan; Schirmer, Birgitta; Wiegand, Thomas; Eckert, Hellmut; Lough, Alan J.; Fröhlich, Roland; Daniliuc, Constantin G.; Grimme, Stefan; Stephan, Douglas W.; Kehr, Gerald; Erker, Gerhard
Reactions of phosphorus/boron frustrated Lewis pairs with SO2
Chemical Science, 2013, 4, 213
1514844 CIFC36 H32 B F10 O2 P SP -110.5993; 11.865; 14.4165
92.7; 95.322; 111.03
1678.66Sajid, Muhammad; Klose, Annika; Birkmann, Birgit; Liang, Liyuan; Schirmer, Birgitta; Wiegand, Thomas; Eckert, Hellmut; Lough, Alan J.; Fröhlich, Roland; Daniliuc, Constantin G.; Grimme, Stefan; Stephan, Douglas W.; Kehr, Gerald; Erker, Gerhard
Reactions of phosphorus/boron frustrated Lewis pairs with SO2
Chemical Science, 2013, 4, 213
1514845 CIFC76 H162 Cu6 N12 O88.66 V30P 31 2 120.411; 20.411; 40.34
90; 90; 120
14554Forster, Johannes; Rösner, Benedikt; Fink, Rainer H.; Nye, Leanne C.; Ivanovic-Burmazovic, Ivana; Kastner, Katharina; Tucher, Johannes; Streb, Carsten
Oxidation-driven self-assembly gives access to high-nuclearity molecular copper vanadium oxide clusters
Chemical Science, 2013, 4, 418
1514846 CIFC10 H30 N2 O12 S5 VP -19.4145; 11.119; 13.183
67.27; 77.71; 89.25
1240Forster, Johannes; Rösner, Benedikt; Fink, Rainer H.; Nye, Leanne C.; Ivanovic-Burmazovic, Ivana; Kastner, Katharina; Tucher, Johannes; Streb, Carsten
Oxidation-driven self-assembly gives access to high-nuclearity molecular copper vanadium oxide clusters
Chemical Science, 2013, 4, 418
1514849 CIFC24.5 H33 Cl N4 O8 Pd2 S2P 21 21 218.4525; 15.486; 46.184
90; 90; 90
6045.3Rodríguez, Nuria; Romero-Revilla, Jose A.; Fernández-Ibáñez, M. Ángeles; Carretero, Juan C.
Palladium-catalyzed N-(2-pyridyl)sulfonyl-directed C(sp3)‒H γ-arylation of amino acid derivatives
Chemical Science, 2013, 4, 175
1514850 CIFC19 H24 N2 O6 SP 21 21 219.8306; 17.0929; 24.3215
90; 90; 90
4086.8Rodríguez, Nuria; Romero-Revilla, Jose A.; Fernández-Ibáñez, M. Ángeles; Carretero, Juan C.
Palladium-catalyzed N-(2-pyridyl)sulfonyl-directed C(sp3)‒H γ-arylation of amino acid derivatives
Chemical Science, 2013, 4, 175
1514851 CIFC106 H115 Cl N8 O11P -113.258; 20.3837; 26.4826
85.599; 81.344; 81.232
6982Allain, Clémence; Beer, Paul D.; Faulkner, Stephen; Jones, Michael W.; Kenwright, Alan M.; Kilah, Nathan L.; Knighton, Richard C.; Sørensen, Thomas Just; Tropiano, Manuel
Lanthanide appended rotaxanes respond to changing chloride concentration
Chemical Science, 2013, 4, 489
1514852 CIFC70 H126 Lu4 N16 Na4 O43P 1 2/c 118.0616; 14.969; 18.2262
90; 108.69; 90
4667.84Allain, Clémence; Beer, Paul D.; Faulkner, Stephen; Jones, Michael W.; Kenwright, Alan M.; Kilah, Nathan L.; Knighton, Richard C.; Sørensen, Thomas Just; Tropiano, Manuel
Lanthanide appended rotaxanes respond to changing chloride concentration
Chemical Science, 2013, 4, 489
1514853 CIFC26 H16 O5 S8P -16.06; 12.255; 19.535
79.509; 81.926; 76.549
1380.07Simao, Claudia; Mas-Torrent, Marta; André, Vânia; Duarte, M. Teresa; Veciana, Jaume; Rovira, Concepció
Intramolecular electron transfer in the photodimerisation product of a tetrathiafulvalene derivative in solution and on a surface
Chemical Science, 2013, 4, 307
1515358 CIFC10 H14 Cl2 Ru SP 1 21/n 17.0069; 12.8404; 12.4298
90; 92.9276; 90
1116.87Camacho-Fernandez, Miguel A.; Yen, Max; Ziller, Joseph W.; Guan, Zhibin
Direct observation of a cationic ruthenium complex for ethylene insertion polymerization
Chemical Science, 2013, 4, 2902
1515359 CIFC12 H20 Ru SP 1 21/n 16.8375; 13.5463; 12.8712
90; 93.878; 90
1189.44Camacho-Fernandez, Miguel A.; Yen, Max; Ziller, Joseph W.; Guan, Zhibin
Direct observation of a cationic ruthenium complex for ethylene insertion polymerization
Chemical Science, 2013, 4, 2902
1515360 CIFC13 H19 Cl N2 SP b c n13.987; 8.17; 24.959
90; 90; 90
2852Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515361 CIFC13 H19 N3 O2 SP -15.2833; 14.9019; 18.0119
91.957; 95.987; 92.116
1408.4Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515362 CIFC14 H19 N3 SP -17.466; 8.049; 13.472
82.276; 82.154; 63.734
716.7Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515363 CIFC14 H22 N2 SP 1 21/n 110.731; 8.475; 16.092
90; 102.01; 90
1431.5Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515364 CIFC15 H22 N2 O2 SP 1 21/c 111.0875; 7.4703; 37.579
90; 100.356; 90
3061.8Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515365 CIFC14 H19 F3 N2 SP 1 21/c 113.298; 13.278; 8.673
90; 91.912; 90
1530.5Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515366 CIFC13 H19 Br N2 SP 1 21/c 117.3563; 7.8428; 21.0265
90; 97.599; 90
2837Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515367 CIFC13 H19 F N2 SP c a 2117.405; 8.732; 17.612
90; 90; 90
2677Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515368 CIFC15 H22 N2 O2 SP 1 21/n 15.553; 9.157; 30.91
90; 93.215; 90
1569Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515369 CIFC15 H24 N2 O SP -18.39; 9.689; 19.62
93.19; 101.167; 90.09
1562Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515370 CIFC13 H19 I N2 SP 1 21/n 111.4798; 8.4051; 15.6294
90; 102.55; 90
1472.03Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515371 CIFC15 H19 F3 N2 O SP -15.2392; 11.02; 14.5788
75.946; 79.884; 79.501
795.2Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515372 CIFC14 H22 N2 O SP 1 21/c 136.04; 4.347; 9.59
90; 95.3; 90
1496Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515373 CIFC15 H24 N2 SP 1 21/c 113.07; 13.28; 8.885
90; 93.56; 90
1539Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515374 CIFC16 H26 N2 SP 1 21/c 122.536; 7.7393; 9.223
90; 98.488; 90
1591Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515375 CIFC15 H22 N2 O SP b c a7.756; 10.12; 37.38
90; 90; 90
2934Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036

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