Crystallography Open Database

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1560133 CIFC19 H16 Br NP 1 21 110.077; 5.678; 13.478
90; 96.922; 90
765.6Jiang, Feng; Fu, Chunling; Ma, Shengming
Asymmetric construction of pyrido[1,2-<i>a</i>]-1<i>H</i>-indole derivatives <i>via</i> a gold-catalyzed cycloisomerization.
Chemical science, 2020, 12, 696-701
1560134 CIFC17 H20 Cl N OP 1 21 110.4093; 6.0139; 12.2223
90; 100.849; 90
751.45Jiang, Feng; Fu, Chunling; Ma, Shengming
Asymmetric construction of pyrido[1,2-<i>a</i>]-1<i>H</i>-indole derivatives <i>via</i> a gold-catalyzed cycloisomerization.
Chemical science, 2020, 12, 696-701
1560135 CIFC167 H154 Cl3 F4 N34 O30P 1 21/n 122.99; 45.82; 40.8
90; 90.92; 90
42973Mateus, Pedro; Jacquet, Antoine; Méndez-Ardoy, Alejandro; Boulloy, Alice; Kauffmann, Brice; Pecastaings, Gilles; Buffeteau, Thierry; Ferrand, Yann; Bassani, Dario M.; Huc, Ivan
Sensing a binding event through charge transport variations using an aromatic oligoamide capsule
Chemical Science, 2021, 12, 3743-3750
1560136 CIFC25 H23 N3 O5P 1 21/c 111.2876; 21.068; 9.751
90; 106.139; 90
2227.5Park, Hyunchang; Lee, Dongwhan
Biomimetic hydrogen-bonding cascade for chemical activation: telling a nucleophile from a base.
Chemical science, 2020, 12, 590-598
1560137 CIFC17 H14 Br Cl3 N2 O4P 1 21/c 125.8801; 6.9453; 23.8077
90; 116.121; 90
3842.25Park, Hyunchang; Lee, Dongwhan
Biomimetic hydrogen-bonding cascade for chemical activation: telling a nucleophile from a base.
Chemical science, 2020, 12, 590-598
1560138 CIFC16 H14 N2 O4I 1 2/a 117.4514; 4.6477; 35.608
90; 102.334; 90
2821.46Park, Hyunchang; Lee, Dongwhan
Biomimetic hydrogen-bonding cascade for chemical activation: telling a nucleophile from a base.
Chemical science, 2020, 12, 590-598
1560139 CIFC27 H43 N O3P 1 21/c 18.2116; 14.8475; 20.2921
90; 96.28; 90
2459.2Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560140 CIFC116 H190.67 K4 N4 O12I -4 3 d32.4579; 32.4579; 32.4579
90; 90; 90
34194.9Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560141 CIFC58 H94 Li2 N2 O7C 1 2/c 116.8366; 13.6239; 24.398
90; 91.454; 90
5594.6Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560142 CIFC144 H224 N6 Na12 O12P 1 21/n 116.206; 29.7416; 30.0188
90; 102.473; 90
14127.3Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560143 CIFC108 H172 N4 Na4 O12I -4 3 d32.0084; 32.0084; 32.0084
90; 90; 90
32793.8Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560144 CIFC115 H175 K10 N5 O10P 1 21/c 125.5103; 27.8549; 16.3237
90; 90.336; 90
11599.2Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560145 CIFC77 H121 Li6 N3 O8P 1 21 114.2409; 14.1749; 20.804
90; 104.449; 90
4066.7Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560146 CIFC138 H210 Li12 N6 O12P -115.9758; 16.9105; 29.646
84.635; 79.342; 87.435
7833.4Freeman, Lucas A.; Obi, Akachukwu D.; Machost, Haleigh R.; Molino, Andrew; Nichols, Asa W.; Dickie, Diane A.; Wilson, David J. D.; Machan, Charles W.; Gilliard, Robert J.
Soluble, crystalline, and thermally stable alkali CO2− and carbonite (CO22−) clusters supported by cyclic(alkyl)(amino) carbenes
Chemical Science, 2021, 12, 3544-3550
1560147 CIFC22 H24 O8P 1 21/n 18.5666; 14.3257; 9.2306
90; 112.196; 90
1048.86Zhou, Jiawang; Stojanović, Ljiljana; Berezin, Andrey A.; Battisti, Tommaso; Gill, Abigail; Kariuki, Benson M.; Bonifazi, Davide; Crespo-Otero, Rachel; Wasielewski, Michael R.; Wu, Yi-Lin
Organic room-temperature phosphorescence from halogen-bonded organic frameworks: hidden electronic effects in rigidified chromophores.
Chemical science, 2020, 12, 767-773
1560148 CIFC22 H20 Br4 O8P -19.5351; 12.0414; 12.8133
72.585; 69.31; 89.363
1305.8Zhou, Jiawang; Stojanović, Ljiljana; Berezin, Andrey A.; Battisti, Tommaso; Gill, Abigail; Kariuki, Benson M.; Bonifazi, Davide; Crespo-Otero, Rachel; Wasielewski, Michael R.; Wu, Yi-Lin
Organic room-temperature phosphorescence from halogen-bonded organic frameworks: hidden electronic effects in rigidified chromophores.
Chemical science, 2020, 12, 767-773
1560149 CIFC22 H23 Br O8P 1 21 19.6364; 9.8092; 11.8602
90; 90.442; 90
1121.06Zhou, Jiawang; Stojanović, Ljiljana; Berezin, Andrey A.; Battisti, Tommaso; Gill, Abigail; Kariuki, Benson M.; Bonifazi, Davide; Crespo-Otero, Rachel; Wasielewski, Michael R.; Wu, Yi-Lin
Organic room-temperature phosphorescence from halogen-bonded organic frameworks: hidden electronic effects in rigidified chromophores.
Chemical science, 2020, 12, 767-773
1560150 CIFC65 H80 Cl N6 O6P -112.0771; 13.4199; 18.1881
75.562; 80.992; 87.013
2819.2Martinez-Cuezva, Alberto; Pastor, Aurelia; Marin-Luna, Marta; Diaz-Marin, Carmen; Bautista, Delia; Alajarin, Mateo; Berna, Jose
Cyclization of interlocked fumaramides into β-lactams: experimental and computational mechanistic assessment of the key intercomponent proton transfer and the stereocontrolling active pocket.
Chemical science, 2020, 12, 747-756
1560151 CIFC20 H20 N O2 S2P 1 21/n 112.3021; 7.9076; 18.7346
90; 97.095; 90
1808.5Hu, Jiefeng; Yang, Xianyu; Shi, Shasha; Cheng, Bo; Luo, Xiaoling; Lan, Yu; Loh, Teck-Peng
Metal-free C(sp3)‒H functionalization of sulfonamides via strain-release rearrangement
Chemical Science, 2021, 12, 4034-4040
1560152 CIFC47 H62 F6 Fe N O10 PP -111.2754; 11.2786; 19.1955
81.762; 83.501; 76.134
2337.6Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560153 CIFC47 H62 F6 Fe N O10 PP -111.3327; 11.4193; 19.3877
82.951; 80.729; 77.436
2406.89Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560154 CIFC47 H62 F6 Fe N O10 PP -111.2781; 11.2893; 19.213
83.432; 81.586; 76.335
2343.29Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560155 CIFC47 H62 F6 Fe N O10 PP -111.2958; 11.3414; 19.2872
83.238; 81.374; 76.703
2368.53Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560156 CIFC47 H62 F6 Fe N O10 PP -111.3259; 11.3917; 19.3628
83.024; 80.932; 77.121
2395.24Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560157 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.2236; 25.2061; 13.5364
90; 110.914; 90
3258.5Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560158 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.2753; 25.224; 13.5486
90; 111.171; 90
3274.6Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560159 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.3328; 25.4063; 13.6255
90; 111.122; 90
3336.6Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560160 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.361; 25.435; 13.645
90; 111.064; 90
3356Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560161 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.28; 25.269; 13.5675
90; 111.092; 90
3288.2Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560162 CIFC47 H62 F6 Fe N O10 PP -111.2892; 11.3208; 19.2519
83.33; 81.46; 76.478
2357.22Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560163 CIFC47 H62 F6 Fe N O10 PP -111.3088; 11.3689; 19.3307
83.1; 81.166; 76.913
2382.63Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560164 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.844; 11.6767; 16.7383
94.74; 95.623; 104.722
1840.28Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560165 CIFC47 H62 F6 Fe N O10 PP -111.3611; 11.5447; 19.4228
82.91; 80.543; 77.861
2446.24Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560166 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.8233; 11.6256; 16.7174
94.917; 95.464; 104.784
1825.52Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560167 CIFC47 H62 F6 Fe N O10 PP -111.3456; 11.4668; 19.414
82.907; 80.58; 77.69
2424.07Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560168 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.7522; 11.4459; 16.6761
95.5; 95.052; 104.805
1779.06Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560169 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.3108; 25.3315; 13.5949
90; 111.123; 90
3312.2Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560170 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.7269; 11.4193; 16.6601
95.565; 95.014; 104.744
1769.03Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560171 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.3821; 25.543; 13.668
90; 111.172; 90
3380Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560172 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.8091; 11.5747; 16.7136
95.109; 95.249; 104.806
1814.42Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560173 CIFC32 H40 F6 Fe N O6 PP 1 21/n 110.354; 25.443; 13.638
90; 111.061; 90
3352.7Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560174 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.8649; 11.7188; 16.7606
94.613; 95.802; 104.684
1853.36Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560175 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.691; 11.3787; 16.6251
95.673; 94.963; 104.636
1753.22Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560176 CIFC47 H62 F6 Fe N O10 PP -111.3733; 11.6068; 19.427
83.003; 80.579; 77.986
2464.26Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560177 CIFC33 H42 Cl2 F6 Fe N O6 PP -19.7922; 11.5185; 16.7041
95.266; 95.19; 104.874
1800.49Wang, Chi-Hsien; Chen, Kai-Jen; Wu, Tsung-Huan; Chang, Hung-Kai; Tsuchido, Yoshitaka; Sei, Yoshihisa; Chen, Pei-Lin; Horie, Masaki
Ring rotation of ferrocene in interlocked molecules in single crystals
Chemical Science, 2021, 12, 3871-3875
1560178 CIFC26 H42 Si2P 1 21/c 112.1094; 11.0077; 9.4271
90; 103.617; 90
1221.28He, Tao; Wang, Guoqiang; Long, Peng-Wei; Kemper, Sebastian; Irran, Elisabeth; Klare, Hendrik F. T.; Oestreich, Martin
Intramolecular Friedel-Crafts alkylation with a silylium-ion-activated cyclopropyl group: formation of tricyclic ring systems from benzyl-substituted vinylcyclopropanes and hydrosilanes.
Chemical science, 2020, 12, 569-575
1560179 CIFC62 H26 Al F20 N6P 1 21/n 110.6538; 21.0744; 27.7419
90; 90.186; 90
6228.6Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A.
Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling.
Chemical science, 2020, 12, 675-682
1560180 CIFC35 H21 Al Cl2 F10 N3 OP 1 21/n 113.3802; 15.1258; 17.4402
90; 110.95; 90
3296.3Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A.
Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling.
Chemical science, 2020, 12, 675-682
1560181 CIFC44 H39 Al Cl F10 N3 O2.5P 1 21 19.8433; 10.2481; 20.401
90; 103.193; 90
2003.63Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A.
Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling.
Chemical science, 2020, 12, 675-682
1560182 CIFC88 H84 Al N10C 1 2/c 124.1574; 16.2905; 19.344
90; 110.105; 90
7148.7Arnold, Amela; Sherbow, Tobias J.; Bohanon, Amanda M.; Sayler, Richard I.; Britt, R. David; Smith, Allison M.; Fettinger, James C.; Berben, Louise A.
Delocalization tunable by ligand substitution in [L<sub>2</sub>Al] <sup><i>n</i>-</sup> complexes highlights a mechanism for strong electronic coupling.
Chemical science, 2020, 12, 675-682
1560183 CIFC26 H28 Co Ho N10 O8C m c m14.7754; 14.9336; 14.0276
90; 90; 90
3095.2Wang, Junhao; Zakrzewski, Jakub J.; Zychowicz, Mikolaj; Vieru, Veacheslav; Chibotaru, Liviu F.; Nakabayashi, Koji; Chorazy, Szymon; Ohkoshi, Shin-Ichi
Holmium(iii) molecular nanomagnets for optical thermometry exploring the luminescence re-absorption effect.
Chemical science, 2020, 12, 730-741
1560184 CIFC26 H28 Ho Ir N10 O8C m c m14.872; 15.2339; 14.1487
90; 90; 90
3205.51Wang, Junhao; Zakrzewski, Jakub J.; Zychowicz, Mikolaj; Vieru, Veacheslav; Chibotaru, Liviu F.; Nakabayashi, Koji; Chorazy, Szymon; Ohkoshi, Shin-Ichi
Holmium(iii) molecular nanomagnets for optical thermometry exploring the luminescence re-absorption effect.
Chemical science, 2020, 12, 730-741
1560185 CIFC26 H28 Ho N10 O8 RhC m c m14.8236; 15.1198; 14.066
90; 90; 90
3152.6Wang, Junhao; Zakrzewski, Jakub J.; Zychowicz, Mikolaj; Vieru, Veacheslav; Chibotaru, Liviu F.; Nakabayashi, Koji; Chorazy, Szymon; Ohkoshi, Shin-Ichi
Holmium(iii) molecular nanomagnets for optical thermometry exploring the luminescence re-absorption effect.
Chemical science, 2020, 12, 730-741
1560186 CIFC8 H8 N2 O2P -16.931; 7.59; 7.735
60.94; 82.44; 75.12
343.75Nicks, Joshua; Boer, Stephanie A.; White, Nicholas G.; Foster, Jonathan A.
Monolayer nanosheets formed by liquid exfoliation of charge-assisted hydrogen-bonded frameworks
Chemical Science, 2021, 12, 3322-3327
1560187 CIFC8 H8 N2 O2P -17.0348; 7.8512; 7.8827
61.268; 74.309; 82.32
367.54Nicks, Joshua; Boer, Stephanie A.; White, Nicholas G.; Foster, Jonathan A.
Monolayer nanosheets formed by liquid exfoliation of charge-assisted hydrogen-bonded frameworks
Chemical Science, 2021, 12, 3322-3327
1560188 CIFC8 H8 N2 O2P -15.5557; 7.8957; 9.0549
71.386; 83.555; 74.217
362.09Nicks, Joshua; Boer, Stephanie A.; White, Nicholas G.; Foster, Jonathan A.
Monolayer nanosheets formed by liquid exfoliation of charge-assisted hydrogen-bonded frameworks
Chemical Science, 2021, 12, 3322-3327
1560189 CIFC9 H11 N O3P 1 21/c 16.0794; 23.851; 6.5545
90; 114.294; 90
866.24Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing
Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines.
Chemical science, 2020, 12, 774-779
1560190 CIFC9 H11 N O3P c a 2110.2859; 10.6455; 7.6374
90; 90; 90
836.28Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing
Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines.
Chemical science, 2020, 12, 774-779
1560191 CIFC12 H11 N O3P 1 21/c 112.4596; 7.5335; 10.8814
90; 92.749; 90
1020.2Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing
Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines.
Chemical science, 2020, 12, 774-779
1560192 CIFC12 H11 N O3P 1 21/c 19.4978; 19.9607; 11.2962
90; 91.786; 90
2140.5Ma, Liang; Kou, Luyao; Jin, Feng; Cheng, Xionglve; Tao, Suyan; Jiang, Gangzhong; Bao, Xiaoguang; Wan, Xiaobing
Acyclic nitronate olefin cycloaddition (ANOC): regio- and stereospecific synthesis of isoxazolines.
Chemical science, 2020, 12, 774-779
1560197 CIFC33 H17 NP 1 21/c 19.5983; 7.4141; 28.155
90; 97.017; 90
1988.6Ghosh, Animesh; Csókás, Dániel; Budanović, Maja; Webster, Richard D.; Pápai, Imre; Stuparu, Mihaiela C.
Synthesis of azahelicenes through Mallory reaction of imine precursors: corannulene substrates provide an exception to the rule in oxidative photocyclizations of diarylethenes
Chemical Science, 2021, 12, 3977-3983
1560198 CIFAs B F H4 N O4C 1 c 14.4453; 8.1098; 12.7463
90; 90; 90
459.51Bai, Zhiyong; Liu, Lehui; Wang, Dongmei; Hu, Chun-Li; Lin, Zhoubin
To improve the key properties of nonlinear optical crystals assembled with tetrahedral functional building units
Chemical Science, 2021, 12, 4014-4020
1560199 CIFC65 H65 Cu F3 N4 O4 P3 SP -110.6937; 10.7364; 25.1952
88.365; 83.658; 83.887
2858.25Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C.
Using internal electrostatic fields to manipulate the valence manifolds of copper complexes
Chemical Science, 2021, 12, 4395-4404
1560200 CIFC43 H49 B Cl Cu F20 N4 O P3P 1 21/c 116.4423; 20.739; 15.7833
90; 104.388; 90
5213.2Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C.
Using internal electrostatic fields to manipulate the valence manifolds of copper complexes
Chemical Science, 2021, 12, 4395-4404
1560201 CIFC15 H39 Cl2 Cu N4 P3P b c a16.2129; 16.8046; 17.8201
90; 90; 90
4855.1Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C.
Using internal electrostatic fields to manipulate the valence manifolds of copper complexes
Chemical Science, 2021, 12, 4395-4404
1560202 CIFC54 H45 B Cu F20 N4 P3P 1 21/n 112.8794; 28.2479; 15.6613
90; 110.76; 90
5327.9Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C.
Using internal electrostatic fields to manipulate the valence manifolds of copper complexes
Chemical Science, 2021, 12, 4395-4404
1560203 CIFC39 H39 B Cu F20 N4 P3P -113.443; 14.253; 14.599
93.503; 105.397; 107.916
2534.8Weberg, Alexander B.; McCollom, Samuel P.; Thierer, Laura M.; Gau, Michael R.; Carroll, Patrick J.; Tomson, Neil C.
Using internal electrostatic fields to manipulate the valence manifolds of copper complexes
Chemical Science, 2021, 12, 4395-4404
1560204 CIFC19 H18 N2 O2 S2P 1 21 19.6009; 10.3983; 9.9867
90; 115.222; 90
901.95Zhong, Xia; Zhong, Ziwei; Wu, Zhikun; Ye, Zhen; Feng, Yuxiang; Dong, Shunxi; Liu, Xiaohua; Peng, Qian; Feng, Xiaoming
Chiral Lewis acid-bonded picolinaldehyde enables enantiodivergent carbonyl catalysis in the Mannich/condensation reaction of glycine ester
Chemical Science, 2021, 12, 4353-4360
1560205 CIFC38 H56 F9 N4 O16 S3 YbP 21 21 223.069; 24.5839; 9.5501
90; 90; 90
5416.1Zhong, Xia; Zhong, Ziwei; Wu, Zhikun; Ye, Zhen; Feng, Yuxiang; Dong, Shunxi; Liu, Xiaohua; Peng, Qian; Feng, Xiaoming
Chiral Lewis acid-bonded picolinaldehyde enables enantiodivergent carbonyl catalysis in the Mannich/condensation reaction of glycine ester
Chemical Science, 2021, 12, 4353-4360
1560206 CIFC49 H78 F9 N4 O17 S3 YbP 1 21 111.9789; 20.7474; 12.9099
90; 106.293; 90
3079.7Zhong, Xia; Zhong, Ziwei; Wu, Zhikun; Ye, Zhen; Feng, Yuxiang; Dong, Shunxi; Liu, Xiaohua; Peng, Qian; Feng, Xiaoming
Chiral Lewis acid-bonded picolinaldehyde enables enantiodivergent carbonyl catalysis in the Mannich/condensation reaction of glycine ester
Chemical Science, 2021, 12, 4353-4360
1560207 CIFC122 H112 O4 S2P -18.9363; 15.5536; 17.3731
106.709; 97.475; 95.961
2267.6Lu, Xuefeng; An, Dongyue; Han, Yi; Zou, Ya; Qiao, Yanjun; Zhang, Ning; Chang, Dongdong; Wu, Jishan; Liu, Yunqi
A cyclopenta-fused dibenzo[b,d]thiophene-co-phenanthrene macrocyclic tetraradicaloid
Chemical Science, 2021, 12, 3952-3957
1560208 CIFC63 H66 Cu3 N9P -19.7333; 27.941; 42.675
75.096; 83.457; 84.935
11121.3Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong; Zou, Bo; Li, Dan
Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex
Chemical Science, 2021, 12, 4425-4431
1560209 CIFC63 H66 Cu3 N9P 1 c 111.4093; 28.8937; 17.7109
90; 104.338; 90
5656.66Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong; Zou, Bo; Li, Dan
Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex
Chemical Science, 2021, 12, 4425-4431
1560210 CIFC63 H66 Cu3 N9P 1 21/c 111.52641; 29.1085; 17.85854
90; 103.99; 90
5814.11Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong; Zou, Bo; Li, Dan
Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex
Chemical Science, 2021, 12, 4425-4431
1560211 CIFC22 H45 Fe N4 O7P 1 21/c 113.571; 11.046; 19.406
90; 102.992; 90
2834.6Keshari, Kritika; Bera, Moumita; Velasco, Lucía; Munshi, Sandip; Gupta, Geetika; Moonshiram, Dooshaye; Paria, Sayantan
Characterization and reactivity study of non-heme high-valent iron‒hydroxo complexes
Chemical Science, 2021, 12, 4418-4424
1560212 CIFC30 H16 O2P 1 21/c 18.1656; 15.1358; 15.7979
90; 102.468; 90
1906.5Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki
Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes
Chemical Science, 2021, 12, 2784-2793
1560213 CIFC30 H18 N2P 1 21/c 115.9958; 15.9492; 7.8148
90; 91.516; 90
1993.02Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki
Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes
Chemical Science, 2021, 12, 2784-2793
1560214 CIFC15 H8 O2 SC 1 2/c 117.7976; 10.4721; 11.7388
90; 99.158; 90
2159.97Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki
Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes
Chemical Science, 2021, 12, 2784-2793
1560215 CIFC57 H34 Cl2P 21 21 218.57192; 20.53361; 22.43166
90; 90; 90
3948.25Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki
Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes
Chemical Science, 2021, 12, 2784-2793
1560216 CIFC30 H16 S2P 1 21/n 19.338; 13.622; 16.299
90; 102.204; 90
2026.4Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki
Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes
Chemical Science, 2021, 12, 2784-2793
1560217 CIFC28.5 H16.5 Cl1.5 OP 41 2 29.0201; 9.0201; 49.382
90; 90; 90
4017.8Yanagi, Tomoyuki; Tanaka, Takayuki; Yorimitsu, Hideki
Asymmetric systematic synthesis, structures, and (chir)optical properties of a series of dihetero[8]helicenes
Chemical Science, 2021, 12, 2784-2793
1560218 CIFC70 H86 B P2 YP 1 21/c 119.84621; 15.33735; 19.6362
90; 91.1824; 90
5975.76Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560219 CIFC39 H57 Cl2 F6 P2 Ru SbP 1 21/n 114.68263; 10.27641; 28.8561
90; 94.9221; 90
4337.89Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560220 CIFC26 H36 Cl4 Hf P2P 1 21/c 113.847; 11.756; 17.937
90; 95.395; 90
2907Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560221 CIFC33 H43 Cl5 N P2 TaP b c a20.20265; 16.84883; 20.7566
90; 90; 90
7065.36Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560222 CIFC30.5 H39 Br Cl3 Mn O3 P2P 1 21/c 112.12; 18.798; 15.683
90; 111.303; 90
3329Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560223 CIFC30 H36 Cr O4 P2P 1 21/n 111.87864; 15.68278; 15.58857
90; 102.773; 90
2832.13Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560224 CIFC45 H60 Cl N O2 P2 PtP 1 21/c 118.1766; 11.59885; 21.4296
90; 114.947; 90
4096.41Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560225 CIFC38 H55 Cl5 F6 P2 Rh SbP 1 21/c 18.68119; 24.5831; 20.7842
90; 96.7728; 90
4404.61Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560226 CIFC33 H42 N2 O3 P2 WP 1 21/n 110.771; 18.02; 16.983
90; 97.989; 90
3264Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560227 CIFC29 H36 O3 P2 WP b c a15.652; 16.072; 22.3038
90; 90; 90
5610.7Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560228 CIFC33 H42 Mo N2 O3 P2P 1 21/n 110.771; 18.08; 16.992
90; 97.838; 90
3278Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560229 CIFC38 H52 Mo O6 P2P 1 21/c 110.8424; 15.9246; 22.3877
90; 101.63; 90
3786.12Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560230 CIFC35 H48 Mo O4.5 P2C 1 2/c 132.514; 11.57882; 39.5477
90; 113.917; 90
13610.2Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560231 CIFC86 H100 Au B F2 O P2P 1 21/c 111.28458; 13.79053; 47.7699
90; 90.5291; 90
7433.65Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560232 CIFC29 H36 Mo O3 P2P b c a15.65317; 16.11165; 22.26048
90; 90; 90
5614.06Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560233 CIFC56 H82 O3 P2 S2 ZnP 1 21/c 120.688; 26.218; 40.07
90; 95.99; 90
21615Wagner, Hannah K.; Wadepohl, Hubert; Ballmann, Joachim
A 2,2′-diphosphinotolane as a versatile precursor for the synthesis of P-ylidic mesoionic carbenes via reversible C‒P bond formation
Chemical Science, 2021, 12, 3693-3701
1560236 CIFC32 H43 Ba N6 O11 S2P c a 2117.6827; 10.4422; 22.5408
90; 90; 90
4162.08Abou, Diane S.; Thiele, Nikki A.; Gutsche, Nicholas T.; Villmer, Alexandria; Zhang, Hanwen; Woods, Joshua J.; Baidoo, Kwamena E.; Escorcia, Freddy E.; Wilson, Justin J.; Thorek, Daniel L. J.
Towards the stable chelation of radium for biomedical applications with an 18-membered macrocyclic ligand
Chemical Science, 2021, 12, 3733-3742
1560237 CIFC59 H76 Cl Ir N2P 21 21 2116.297; 17.0451; 17.8125
90; 90; 90
4948.03Foster, Daven; Gao, Pengchao; Zhang, Ziyun; Sipos, Gellért; Sobolev, Alexandre N.; Nealon, Gareth; Falivene, Laura; Cavallo, Luigi; Dorta, Reto
Design, scope and mechanism of highly active and selective chiral NHC‒iridium catalysts for the intramolecular hydroamination of a variety of unactivated aminoalkenes
Chemical Science, 2021, 12, 3751-3767
1560238 CIFC55 H64 Br2 N4 O13P -19.3936; 16.783; 17.8687
75.171; 83.247; 84.427
2697.7Wilson, Benjamin H.; Abdulla, Louae M.; Schurko, Robert W.; Loeb, Stephen J.
Translational dynamics of a non-degenerate molecular shuttle imbedded in a zirconium metal‒organic framework
Chemical Science, 2021, 12, 3944-3951

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