Crystallography Open Database
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Searching volume of publication is 13
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1565822 | CIF | C23 H20 I N O2 | P 1 | 8.7754; 8.8984; 12.8772 99.2233; 96.0361; 91.197 | 986.31 | Dishman, Sarah N.; Laconsay, Croix J.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Divergent stereochemical outcomes in the insertion of donor/donor carbenes into the C–H bonds of stereogenic centers Chemical Science, 2022, 13, 1030-1036 |
| 1565823 | CIF | C33 H27 N O3 | P 1 | 6.3151; 11.198; 17.7567 85.4422; 85.449; 86.8128 | 1246.24 | Dishman, Sarah N.; Laconsay, Croix J.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Divergent stereochemical outcomes in the insertion of donor/donor carbenes into the C–H bonds of stereogenic centers Chemical Science, 2022, 13, 1030-1036 |
| 1565833 | CIF | C10 H14 O4 | P 1 21 1 | 6.29835; 10.64131; 7.53892 90; 103.504; 90 | 491.31 | Ai, Yong; Li, Peng-Fei; Yang, Meng-Juan; Xu, Yu-Qiu; Li, Meng-Zhen; Xiong, Ren-Gen An organic plastic ferroelectric with high Curie point Chemical Science, 2022, 13, 748-753 |
| 1565834 | CIF | C10 H14 O4 | P 1 21 1 | 6.3879; 10.8484; 7.6137 90; 103.203; 90 | 513.67 | Ai, Yong; Li, Peng-Fei; Yang, Meng-Juan; Xu, Yu-Qiu; Li, Meng-Zhen; Xiong, Ren-Gen An organic plastic ferroelectric with high Curie point Chemical Science, 2022, 13, 748-753 |
| 1565835 | CIF | C10 H11 Fe N4 | I -4 3 m | 17.1728; 17.1728; 17.1728 90; 90; 90 | 5064.3 | López-Cabrelles, Javier; Miguel-Casañ, Eugenia; Esteve-Rochina, María; Andres-Garcia, Eduardo; Vitórica-Yrezábal, Iñigo J.; Calbo, Joaquín; Mínguez Espallargas, Guillermo Multivariate sodalite zeolitic imidazolate frameworks: a direct solvent-free synthesis Chemical Science, 2022, 13, 842-847 |
| 1565836 | CIF | C12 H14 Fe N4 | I -4 3 m | 17.317; 17.317; 17.317 90; 90; 90 | 5193 | López-Cabrelles, Javier; Miguel-Casañ, Eugenia; Esteve-Rochina, María; Andres-Garcia, Eduardo; Vitórica-Yrezábal, Iñigo J.; Calbo, Joaquín; Mínguez Espallargas, Guillermo Multivariate sodalite zeolitic imidazolate frameworks: a direct solvent-free synthesis Chemical Science, 2022, 13, 842-847 |
| 1565837 | CIF | C25 H20 O4 | P 61 | 17.6742; 17.6742; 11.6231 90; 90; 120 | 3144.36 | Lang, Jiawen; Wang, Siyuan; He, Changli; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of isochromanone derivatives via trapping carboxylic oxonium ylides and aldol cascade Chemical Science, 2022, 13, 1163-1168 |
| 1565838 | CIF | C25 H22 O4 | P 21 21 21 | 6.5263; 13.9032; 21.5712 90; 90; 90 | 1957.29 | Lang, Jiawen; Wang, Siyuan; He, Changli; Liu, Xiaohua; Feng, Xiaoming Asymmetric synthesis of isochromanone derivatives via trapping carboxylic oxonium ylides and aldol cascade Chemical Science, 2022, 13, 1163-1168 |
| 1565840 | CIF | C22 H19 Cl5 N2 Zn | P 1 21/c 1 | 23.376; 10.6352; 20.2506 90; 106.848; 90 | 4818.4 | Frye, Connor W.; Egger, Dominic T.; Kounalis, Errikos; Pearce, Adam J.; Cheng, Yukun; Tonks, Ian A. α-Diimine synthesis via titanium-mediated multicomponent diimination of alkynes with C-nitrosos Chemical Science, 2022, 13, 1469-1477 |
| 1565841 | CIF | C51 H46 Eu N7 O15 | P 1 21/c 1 | 10.2028; 20.5606; 27.5955 90; 94.989; 90 | 5766.9 | Wang, Hui; Li, Xuan; Cheng, Hao; Li, Ya-Jun; Song, Xue-Qin; Wang, Li Two luminescent film sensors constructed from new lanthanide coordination polymers for ratiometric detection of Zn2+ and NH3 in water and their white emission properties Polymer Chemistry, 2022, 13, 778-793 |
| 1565842 | CIF | C51 H46 Gd N7 O15 | P 1 21/c 1 | 10.1478; 20.3871; 27.1677 90; 95.103; 90 | 5598.3 | Wang, Hui; Li, Xuan; Cheng, Hao; Li, Ya-Jun; Song, Xue-Qin; Wang, Li Two luminescent film sensors constructed from new lanthanide coordination polymers for ratiometric detection of Zn2+ and NH3 in water and their white emission properties Polymer Chemistry, 2022, 13, 778-793 |
| 1565843 | CIF | C51 H46 N7 O15 Tb | P 1 21/c 1 | 10.184; 20.5165; 27.539 90; 95.052; 90 | 5731.6 | Wang, Hui; Li, Xuan; Cheng, Hao; Li, Ya-Jun; Song, Xue-Qin; Wang, Li Two luminescent film sensors constructed from new lanthanide coordination polymers for ratiometric detection of Zn2+ and NH3 in water and their white emission properties Polymer Chemistry, 2022, 13, 778-793 |
| 1565906 | CIF | C24 H29 N O3 | C 1 2/c 1 | 32.9756; 9.2126; 13.7861 90; 101.232; 90 | 4107.88 | Zhang, Bei-Bei; Peng, Shuo; Wang, Feiyi; Lu, Cuifen; Nie, Junqi; Chen, Zuxing; Yang, Guichun; Ma, Chao Borane-catalyzed cascade Friedel–Crafts alkylation/[1,5]-hydride transfer/Mannich cyclization to afford tetrahydroquinolines Chemical Science, 2022, 13, 775-780 |
| 1565907 | CIF | C27 H27 N O3 | C 1 c 1 | 5.7626; 21.7654; 36.032 90; 91.845; 90 | 4516.98 | Zhang, Bei-Bei; Peng, Shuo; Wang, Feiyi; Lu, Cuifen; Nie, Junqi; Chen, Zuxing; Yang, Guichun; Ma, Chao Borane-catalyzed cascade Friedel–Crafts alkylation/[1,5]-hydride transfer/Mannich cyclization to afford tetrahydroquinolines Chemical Science, 2022, 13, 775-780 |
| 1565908 | CIF | C23 H26 N2 O3 | P 1 21 1 | 9.4239; 10.0699; 11.235 90; 103.712; 90 | 1035.79 | Liang, Hui; Ji, Dong-Sheng; Xu, Guo-Qiang; Luo, Yong-Chun; Zheng, Haixue; Xu, Peng-Fei Metal-free, visible-light induced enantioselective three-component dicarbofunctionalization and oxytrifluoromethylation of enamines via chiral phosphoric acid catalysis Chemical Science, 2022, 13, 1088-1094 |
| 1565909 | CIF | C12 H9 Br F N3 O | P 1 21 1 | 8.0916; 6.0738; 12.9097 90; 105.671; 90 | 610.89 | Komatsuda, Masaaki; Suto, Ayane; Kondo, Hiroki; Takada, Hiroyuki; Kato, Kenta; Saito, Bunnai; Yamaguchi, Junichiro Ring-opening fluorination of bicyclic azaarenes Chemical Science, 2022, 13, 665-670 |
| 1565910 | CIF | C16 H13 N O3 | P 1 21/c 1 | 8.8242; 7.5306; 19.3128 90; 96.98; 90 | 1273.85 | Li, Long-Hai; Wei, Hao-Zhao; Wei, Yin; Shi, Min The Morita–Baylis–Hillman reaction for non-electron-deficient olefins enabled by photoredox catalysis Chemical Science, 2022, 13, 1478-1483 |
| 1565911 | CIF | C13 H15 N O4 | P 1 21/c 1 | 6.8237; 21.9249; 8.5663 90; 96.654; 90 | 1272.96 | Li, Long-Hai; Wei, Hao-Zhao; Wei, Yin; Shi, Min The Morita–Baylis–Hillman reaction for non-electron-deficient olefins enabled by photoredox catalysis Chemical Science, 2022, 13, 1478-1483 |
| 1565912 | CIF | C22 H23 N O2 | P 1 21/c 1 | 11.917; 7.3388; 20.1019 90; 92.932; 90 | 1755.74 | Li, Long-Hai; Wei, Hao-Zhao; Wei, Yin; Shi, Min The Morita–Baylis–Hillman reaction for non-electron-deficient olefins enabled by photoredox catalysis Chemical Science, 2022, 13, 1478-1483 |
| 1565913 | CIF | C20 H21 N O2 | P -1 | 6.9435; 11.9044; 21.0418 74.164; 85.968; 83.016 | 1659.59 | Li, Long-Hai; Wei, Hao-Zhao; Wei, Yin; Shi, Min The Morita–Baylis–Hillman reaction for non-electron-deficient olefins enabled by photoredox catalysis Chemical Science, 2022, 13, 1478-1483 |
| 1565914 | CIF | C108 H128 Cl4 N12 O26 | P 1 21/c 1 | 13.6939; 19.0018; 50.945 90; 90.412; 90 | 13256 | Chen, Qiong; Lei, Ye; Wu, Guangcheng; Li, Qing; Pan, Yuanjiang; Li, Hao Ultramacrocyclization in water via external templation Chemical Science, 2022, 13, 798-803 |
| 1565915 | CIF | C49 H57 Cl2 N6 O11.5 | P -1 | 10.312; 20.687; 26.395 74.272; 81.268; 78.693 | 5285.6 | Chen, Qiong; Lei, Ye; Wu, Guangcheng; Li, Qing; Pan, Yuanjiang; Li, Hao Ultramacrocyclization in water via external templation Chemical Science, 2022, 13, 798-803 |
| 1565916 | CIF | C50 H52 F12 N6 O7 P2 | P -1 | 9.22; 19.51; 20.82 62.99; 86.96; 78.01 | 3260 | Chen, Qiong; Lei, Ye; Wu, Guangcheng; Li, Qing; Pan, Yuanjiang; Li, Hao Ultramacrocyclization in water via external templation Chemical Science, 2022, 13, 798-803 |
| 1565917 | CIF | C102 H102 Cl2 N38 O25 | P -1 | 14.5032; 23.2785; 23.8851 107.441; 93.266; 104.627 | 7366.6 | Chen, Qiong; Lei, Ye; Wu, Guangcheng; Li, Qing; Pan, Yuanjiang; Li, Hao Ultramacrocyclization in water via external templation Chemical Science, 2022, 13, 798-803 |
| 1565922 | CIF | C49 H37 B Cl2 O2 | P 1 21/n 1 | 9.0213; 12.4023; 32.9897 90; 94.685; 90 | 3678.72 | Narita, Hiroki; Choi, Heekyoung; Ito, Masato; Ando, Naoki; Ogi, Soichiro; Yamaguchi, Shigehiro Fully fused boron-doped polycyclic aromatic hydrocarbons: their synthesis, structure–property relationships, and self-assembly behavior in aqueous media Chemical Science, 2022, 13, 1484-1491 |
| 1565923 | CIF | C63 H53 B Cl2 O2 Si2 | P -1 | 9.1151; 12.6682; 21.4094 89.252; 84.01; 84.665 | 2448.02 | Narita, Hiroki; Choi, Heekyoung; Ito, Masato; Ando, Naoki; Ogi, Soichiro; Yamaguchi, Shigehiro Fully fused boron-doped polycyclic aromatic hydrocarbons: their synthesis, structure–property relationships, and self-assembly behavior in aqueous media Chemical Science, 2022, 13, 1484-1491 |
| 1565924 | CIF | C54 H37 B O2 | P 1 21/c 1 | 18.5697; 12.0685; 16.8103 90; 95.339; 90 | 3751 | Narita, Hiroki; Choi, Heekyoung; Ito, Masato; Ando, Naoki; Ogi, Soichiro; Yamaguchi, Shigehiro Fully fused boron-doped polycyclic aromatic hydrocarbons: their synthesis, structure–property relationships, and self-assembly behavior in aqueous media Chemical Science, 2022, 13, 1484-1491 |
| 1565925 | CIF | C50 H35 B O2 | P 1 21/c 1 | 12.1456; 15.8222; 35.8589 90; 98.879; 90 | 6808.4 | Narita, Hiroki; Choi, Heekyoung; Ito, Masato; Ando, Naoki; Ogi, Soichiro; Yamaguchi, Shigehiro Fully fused boron-doped polycyclic aromatic hydrocarbons: their synthesis, structure–property relationships, and self-assembly behavior in aqueous media Chemical Science, 2022, 13, 1484-1491 |
| 1565926 | CIF | C50 H59 Ni O9 P2 | P 1 21/c 1 | 12.239; 20.228; 19.483 90; 99.971; 90 | 4750.6 | Luu, Quang H.; Li, Junqi A C-to-O atom-swapping reaction sequence enabled by Ni-catalyzed decarbonylation of lactones Chemical Science, 2022, 13, 1095-1100 |
| 1565927 | CIF | C45 H64 Ni O P2 | P 1 21 1 | 9.0475; 18.2763; 12.7484 90; 105.437; 90 | 2032 | Luu, Quang H.; Li, Junqi A C-to-O atom-swapping reaction sequence enabled by Ni-catalyzed decarbonylation of lactones Chemical Science, 2022, 13, 1095-1100 |
| 1565972 | CIF | C20 H13 B Br N | P c a 21 | 22.958; 9.4271; 7.0146 90; 90; 90 | 1518.15 | Yuan, Kang; Volland, Daniel; Kirschner, Sven; Uzelac, Marina; Nichol, Gary S.; Nowak-Król, Agnieszka; Ingleson, Michael J. Enhanced N-directed electrophilic C–H borylation generates BN–[5]- and [6]helicenes with improved photophysical properties Chemical Science, 2022, 13, 1136-1145 |
| 1565973 | CIF | C33 H26 B N | P -1 | 6.6409; 12.0504; 15.9138 78.061; 78.902; 79.901 | 1210.42 | Yuan, Kang; Volland, Daniel; Kirschner, Sven; Uzelac, Marina; Nichol, Gary S.; Nowak-Król, Agnieszka; Ingleson, Michael J. Enhanced N-directed electrophilic C–H borylation generates BN–[5]- and [6]helicenes with improved photophysical properties Chemical Science, 2022, 13, 1136-1145 |
| 1565974 | CIF | C34 H30 B N | P 1 21/c 1 | 12.0461; 17.1985; 13.07 90; 109.463; 90 | 2553 | Yuan, Kang; Volland, Daniel; Kirschner, Sven; Uzelac, Marina; Nichol, Gary S.; Nowak-Król, Agnieszka; Ingleson, Michael J. Enhanced N-directed electrophilic C–H borylation generates BN–[5]- and [6]helicenes with improved photophysical properties Chemical Science, 2022, 13, 1136-1145 |
| 1565978 | CIF | C214 H136 Cl4 O4 | P 1 2/c 1 | 16.922; 17.1293; 27.104 90; 100.952; 90 | 7713.3 | Chen, Han; Xia, Zeming; Miao, Qian Synthesis, aromatization and cavitates of an oxanorbornene-fused dibenzo[de,qr]tetracene nanobox Chemical Science, 2022, 13, 2280-2285 |
| 1565979 | CIF | C148 H128 Cl14 O4 | P -1 | 14.1531; 17.009; 17.275 93.079; 100.115; 110.482 | 3805.1 | Chen, Han; Xia, Zeming; Miao, Qian Synthesis, aromatization and cavitates of an oxanorbornene-fused dibenzo[de,qr]tetracene nanobox Chemical Science, 2022, 13, 2280-2285 |
| 1565980 | CIF | C108 H62 Ca4 F8 O19 | P -1 | 10.0419; 15.6393; 42.1081 92.477; 91.364; 91.427 | 6602.7 | Wu, Zhao-Feng; Tan, Bin; Fu, Zhi-Hua; Velasco, Ever; Liu, Xing-Wu; Teat, Simon J.; Zhu, Kun; Xing, Kai; Huang, Xiao-Ying; Li, Jing Achieving a blue-excitable yellow-emitting Ca-LMOF phosphor via water induced phase transformation Chemical Science, 2022, 13, 1375-1381 |
| 1565992 | CIF | C80 H199 K4 O99.5 P2 | P 42 21 2 | 23.4286; 23.4286; 24.2838 90; 90; 90 | 13329.4 | Scelle, Jérémy; Vervoitte, Hugo; Bouteiller, Laurent; Chamoreau, Lise-Marie; Sollogoub, Matthieu; Vives, Guillaume; Hasenknopf, Bernold Size-dependent compression of threaded alkyldiphosphate in head to head cyclodextrin [3]pseudorotaxanes Chemical Science, 2022, 13, 2218-2225 |
| 1565993 | CIF | C81 H195 K4 O96.5 P2 | P 42 21 2 | 23.5333; 23.5333; 24.406 90; 90; 90 | 13516 | Scelle, Jérémy; Vervoitte, Hugo; Bouteiller, Laurent; Chamoreau, Lise-Marie; Sollogoub, Matthieu; Vives, Guillaume; Hasenknopf, Bernold Size-dependent compression of threaded alkyldiphosphate in head to head cyclodextrin [3]pseudorotaxanes Chemical Science, 2022, 13, 2218-2225 |
| 1565994 | CIF | C168 H443 K8 O213.5 P4 | P 1 21 1 | 22.944; 13.9699; 44.772 90; 92.681; 90 | 14335 | Scelle, Jérémy; Vervoitte, Hugo; Bouteiller, Laurent; Chamoreau, Lise-Marie; Sollogoub, Matthieu; Vives, Guillaume; Hasenknopf, Bernold Size-dependent compression of threaded alkyldiphosphate in head to head cyclodextrin [3]pseudorotaxanes Chemical Science, 2022, 13, 2218-2225 |
| 1565995 | CIF | C82 H201.75 K4 O98.88 P2 | P 43 21 2 | 23.3244; 23.3244; 48.784 90; 90; 90 | 26540 | Scelle, Jérémy; Vervoitte, Hugo; Bouteiller, Laurent; Chamoreau, Lise-Marie; Sollogoub, Matthieu; Vives, Guillaume; Hasenknopf, Bernold Size-dependent compression of threaded alkyldiphosphate in head to head cyclodextrin [3]pseudorotaxanes Chemical Science, 2022, 13, 2218-2225 |
| 1566046 | CIF | C16 H19 N O3 S | P 1 | 7.6588; 7.9714; 12.8907 99.211; 90.731; 99.142 | 766.39 | Iwumene, Ndidi U. N.; Moseley, Daniel. F.; Pullin, Robert D. C.; Willis, Michael C. Diverse saturated heterocycles from a hydroacylation/conjugate addition cascade Chemical Science, 2022, 13, 1504-1511 |
| 1566047 | CIF | C14 H20 O3 S | P 1 21/n 1 | 12.2921; 7.393; 15.8524 90; 103.199; 90 | 1402.54 | Iwumene, Ndidi U. N.; Moseley, Daniel. F.; Pullin, Robert D. C.; Willis, Michael C. Diverse saturated heterocycles from a hydroacylation/conjugate addition cascade Chemical Science, 2022, 13, 1504-1511 |
| 1566048 | CIF | C19 H20 O3 S | P 1 21/n 1 | 23.8127; 5.6108; 24.8367 90; 90.39; 90 | 3318.3 | Iwumene, Ndidi U. N.; Moseley, Daniel. F.; Pullin, Robert D. C.; Willis, Michael C. Diverse saturated heterocycles from a hydroacylation/conjugate addition cascade Chemical Science, 2022, 13, 1504-1511 |
| 1566049 | CIF | C20 H27 N O5 | P 1 21/c 1 | 11.6377; 19.035; 18.0198 90; 107.936; 90 | 3797.8 | Iwumene, Ndidi U. N.; Moseley, Daniel. F.; Pullin, Robert D. C.; Willis, Michael C. Diverse saturated heterocycles from a hydroacylation/conjugate addition cascade Chemical Science, 2022, 13, 1504-1511 |
| 1566079 | CIF | C54.5 H65 Cl5 N12 O8 Pd4 | C 1 2/c 1 | 39.352; 14.1869; 22.175 90; 96.411; 90 | 12303 | Zhang, Shuaizhong; Zhang, Jinquan; Zou, Hongbin C(sp3)–H oxygenation via alkoxypalladium(ii) species: an update for the mechanism Chemical Science, 2022, 13, 1298-1306 |
| 1566110 | CIF | C6 H21 Cu F6 N5 Si | P 1 21/n 1 | 8.9945; 9.6067; 15.7357 90; 91.46; 90 | 1359.24 | Lavrenyuk, Helen; Mykhalichko, Borys; Dziuk, Błażej; Olijnyk, Volodymyr; Mykhalichko, Oleg A new copper(II) chelate complex with polyamines as fire retardant and epoxy hardener: Synthesis, crystal and electronic structure, and thermal behavior of (ethylenediamine-N,N′)-(diethylenetriamine-N,N′,N″)-copper(II) hexafluoridosilicate Arabian Journal of Chemistry, 2020, 13, 3060-3069 |
| 1566151 | CIF | C29 H49 B Br N3 | P n a 21 | 16.6843; 10.1022; 17.8126 90; 90; 90 | 3002.3 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566152 | CIF | C29 H49 B Cl N3 | P n a 21 | 16.7035; 10.08; 17.6907 90; 90; 90 | 2978.6 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566153 | CIF | C29 H49 Al B Br3 N6 | P b c a | 18.3035; 18.6688; 41.8373 90; 90; 90 | 14296 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566154 | CIF | C58 H98 Al2 B2 Br8 N6 | P -1 | 9.5926; 18.3489; 22.4133 109.017; 98.006; 96.256 | 3642.84 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566155 | CIF | C35 H57 Al B Br4 N3 | P -1 | 9.7709; 20.3965; 21.6332 91.982; 100.812; 98.869 | 4175.2 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566156 | CIF | C41 H61 Al B Br4 N3 | P -1 | 10.2658; 15.817; 15.9702 65.411; 78.295; 80.201 | 2298.2 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566157 | CIF | C33 H59 Al B Br4 N5 Si | P -1 | 11.9613; 13.4134; 15.2453 109.98; 104.192; 102.755 | 2100.41 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566158 | CIF | C31 H52 Al B Br4 N4 | I 1 2/a 1 | 11.781; 15.9628; 41.3531 90; 93.4263; 90 | 7762.9 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566159 | CIF | C41 H65 Al B Br4 Cl3 N4 O | P 1 21/n 1 | 12.64878; 21.8402; 19.4954 90; 106.767; 90 | 5156.68 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566160 | CIF | C54 H77 Al B Br4 N5 | P -1 | 14.3058; 14.4769; 14.7822 82.612; 72.27; 89.201 | 2890.8 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566188 | CIF | C8 H7 N O2 | P 21 21 21 | 5.862; 7.712; 14.907 90; 90; 90 | 673.9 | Sasikumar, Devika; Vinod, Kavya; Sunny, Jeswin; Hariharan, Mahesh Exciton interactions in helical crystals of a hydrogen-bonded eumelanin monomer Chemical Science, 2022, 13, 2331-2338 |
| 1566247 | CIF | C15 H17 N3 O5 S | P 1 21 1 | 6.5937; 22.424; 10.7128 90; 97.951; 90 | 1568.7 | Rigotti, Thomas; Schwinger, Daniel P.; Graßl, Raphaela; Jandl, Christian; Bach, Thorsten Enantioselective crossed intramolecular [2+2] photocycloaddition reactions mediated by a chiral chelating Lewis acid Chemical Science, 2022, 13, 2378-2384 |
| 1566266 | CIF | C25 H23 N3 O7 S | P 1 21 1 | 7.5832; 15.8833; 10.5856 90; 104.429; 90 | 1234.78 | Huang, Yao; Zou, Suchen; Yu, Bangkui; Yan, Xuyang; Liu, Song; Huang, Hanmin Highly regioselective and diastereodivergent aminomethylative annulation of dienyl alcohols enabled by a hydrogen-bonding assisting effect Chemical Science, 2022, 13, 2317-2323 |
| 1566267 | CIF | C25 H21 N3 O7 S | P -1 | 7.2994; 8.0887; 21.2887 91.614; 94.807; 100.145 | 1231.76 | Huang, Yao; Zou, Suchen; Yu, Bangkui; Yan, Xuyang; Liu, Song; Huang, Hanmin Highly regioselective and diastereodivergent aminomethylative annulation of dienyl alcohols enabled by a hydrogen-bonding assisting effect Chemical Science, 2022, 13, 2317-2323 |
| 1566268 | CIF | C25 H24 N2 O5 S | P 1 21/c 1 | 14.60983; 31.1413; 10.11618 90; 91.553; 90 | 4600.86 | Huang, Yao; Zou, Suchen; Yu, Bangkui; Yan, Xuyang; Liu, Song; Huang, Hanmin Highly regioselective and diastereodivergent aminomethylative annulation of dienyl alcohols enabled by a hydrogen-bonding assisting effect Chemical Science, 2022, 13, 2317-2323 |
| 1566274 | CIF | C24 H18 Fe O2 | F d d 2 | 11.3424; 25.8718; 11.9601 90; 90; 90 | 3509.67 | Kunde, Tom; Pausch, Tobias; Guńka, Piotr A; Krzyżanowski, Maurycy; Kasprzak, Artur; Schmidt, Bernd M. Fast, solvent-free synthesis of ferrocene-containing organic cages <i>via</i> dynamic covalent chemistry in the solid state. Chemical science, 2022, 13, 2877-2883 |
| 1566275 | CIF | C69 H75 Cl9 Fe3 N6 O0.39 | P -1 | 13.1378; 16.3059; 19.0267 97.399; 93.732; 113.532 | 3675.33 | Kunde, Tom; Pausch, Tobias; Guńka, Piotr A; Krzyżanowski, Maurycy; Kasprzak, Artur; Schmidt, Bernd M. Fast, solvent-free synthesis of ferrocene-containing organic cages <i>via</i> dynamic covalent chemistry in the solid state. Chemical science, 2022, 13, 2877-2883 |
| 1566276 | CIF | C113 H114 Cl18 Fe3 N6 | P -1 | 16.0318; 17.0394; 21.0388 102.395; 99.882; 91.283 | 5519.49 | Kunde, Tom; Pausch, Tobias; Guńka, Piotr A; Krzyżanowski, Maurycy; Kasprzak, Artur; Schmidt, Bernd M. Fast, solvent-free synthesis of ferrocene-containing organic cages <i>via</i> dynamic covalent chemistry in the solid state. Chemical science, 2022, 13, 2877-2883 |
| 1566277 | CIF | C75 H58 Fe3 N8 O0.5 | P -1 | 10.8575; 16.0366; 19.8722 107.932; 90.985; 106.814 | 3129.76 | Kunde, Tom; Pausch, Tobias; Guńka, Piotr A; Krzyżanowski, Maurycy; Kasprzak, Artur; Schmidt, Bernd M. Fast, solvent-free synthesis of ferrocene-containing organic cages <i>via</i> dynamic covalent chemistry in the solid state. Chemical science, 2022, 13, 2877-2883 |
| 1566278 | CIF | C187 H120 F9 N62 Nd O57.5 S3 Zn16 | P 4/n c c :2 | 29.7978; 29.7978; 27.541 90; 90; 90 | 24453.9 | Eliseeva, Svetlana V.; Nguyen, Tu N.; Kampf, Jeff W.; Trivedi, Evan R.; Pecoraro, Vincent L.; Petoud, Stéphane Tuning the photophysical properties of lanthanide(iii)/zinc(ii) 'encapsulated sandwich' metallacrowns emitting in the near-infrared range. Chemical science, 2022, 13, 2919-2931 |
| 1566279 | CIF | C187 H124.5 F9 N56 O47 S3 Yb Zn16 | P 4/n c c :2 | 30.0778; 30.0778; 26.9277 90; 90; 90 | 24360.8 | Eliseeva, Svetlana V.; Nguyen, Tu N.; Kampf, Jeff W.; Trivedi, Evan R.; Pecoraro, Vincent L.; Petoud, Stéphane Tuning the photophysical properties of lanthanide(iii)/zinc(ii) 'encapsulated sandwich' metallacrowns emitting in the near-infrared range. Chemical science, 2022, 13, 2919-2931 |
| 1566308 | CIF | C37 H32 B P S | C 1 c 1 | 20.883; 8.704; 19.093 90; 123.59; 90 | 2891 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566309 | CIF | C21 H16 B N S | P 1 21/c 1 | 8.8; 10.843; 17.829 90; 99.74; 90 | 1676.7 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566310 | CIF | C44.25 H33.51 B2 N3 S2 | P -1 | 10.278; 12.065; 16.702 92.946; 107.906; 114.158 | 1760.3 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566311 | CIF | C41 H37 B2 N3 S2 Si | P -1 | 9.9577; 12.2845; 16.579 100.823; 90.407; 112.635 | 1831.5 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566312 | CIF | C36 H30 B2 S2 | C 1 2/c 1 | 14.644; 11.056; 17.829 90; 94.9; 90 | 2876 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566313 | CIF | C32 H22 B2 S2 | P 1 21 1 | 11.4201; 17.9796; 12.1277 90; 90.12; 90 | 2490.16 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566314 | CIF | C19 H17 B S | P 1 21/c 1 | 13.289; 30.28; 7.763 90; 93.3; 90 | 3119 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566315 | CIF | C38 H26 B2 N4 O2 S2 | P 1 21/n 1 | 13.299; 18.859; 13.574 90; 112.808; 90 | 3138.2 | Fuchs, Sonja; Jayaraman, Arumugam; Krummenacher, Ivo; Haley, Laura; Baštovanović, Marta; Fest, Maximilian; Radacki, Krzysztof; Helten, Holger; Braunschweig, Holger Diboramacrocycles: reversible borole dimerisation-dissociation systems. Chemical science, 2022, 13, 2932-2938 |
| 1566316 | CIF | C13 H7 F5 O2 | P 1 21/n 1 | 6.327; 26.441; 7.0232 90; 95.01; 90 | 1170.4 | Gerthoffer, Margaret C.; Xu, Bohan; Wu, Sikai; Cox, Jordan; Huss, Steven; Oburn, Shalisa M.; Lopez, Steven A.; Crespi, Vincent H.; Badding, John V.; Elacqua, Elizabeth Mechanistic insights into the pressure-induced polymerization of aryl/perfluoroaryl co-crystals Polymer Chemistry, 2022, 13, 1359-1368 |
| 1566317 | CIF | C13 H7 F5 O2 | P -1 | 5.9872; 7.934; 13.242 105.378; 99.982; 94.446 | 592.3 | Gerthoffer, Margaret C.; Xu, Bohan; Wu, Sikai; Cox, Jordan; Huss, Steven; Oburn, Shalisa M.; Lopez, Steven A.; Crespi, Vincent H.; Badding, John V.; Elacqua, Elizabeth Mechanistic insights into the pressure-induced polymerization of aryl/perfluoroaryl co-crystals Polymer Chemistry, 2022, 13, 1359-1368 |
| 1566331 | CIF | C24 H29 N O6 | P 1 21 1 | 8.4222; 8.6086; 15.573 90; 93.674; 90 | 1126.77 | You, Shiqi; Ruan, Mengyao; Lu, Cuifen; Liu, Li; Weng, Yue; Yang, Guichun; Wang, Shengchun; Alhumade, Hesham; Lei, Aiwen; Gao, Meng Paired electrolysis enabled annulation for the quinolyl-modification of bioactive molecules Chemical Science, 2022, 13, 2310-2316 |
| 1566332 | CIF | C68 H146 Cr Mo6 N3 O32 | P 1 21/c 1 | 27.8416; 13.6571; 25.0139 90; 92.128; 90 | 9504.6 | Salazar Marcano, David E.; Moussawi, Mhamad Aly; Anyushin, Alexander V.; Lentink, Sarah; Van Meervelt, Luc; Ivanović-Burmazović, Ivana; Parac-Vogt, Tatjana N Versatile post-functionalisation strategy for the formation of modular organic-inorganic polyoxometalate hybrids. Chemical science, 2022, 13, 2891-2899 |
| 1566333 | CIF | C26 H55 N O13.5 V3 | P 1 21/c 1 | 13.052; 13.4949; 20.5929 90; 104.803; 90 | 3506.8 | Salazar Marcano, David E.; Moussawi, Mhamad Aly; Anyushin, Alexander V.; Lentink, Sarah; Van Meervelt, Luc; Ivanović-Burmazović, Ivana; Parac-Vogt, Tatjana N Versatile post-functionalisation strategy for the formation of modular organic-inorganic polyoxometalate hybrids. Chemical science, 2022, 13, 2891-2899 |
| 1566334 | CIF | C34.67 H59 B N2 Ni P2 | P 1 21/c 1 | 23.1838; 26.0619; 17.536 90; 101.639; 90 | 10377.6 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566335 | CIF | C30 H50 P2 Pd Si | P -1 | 9.5911; 9.8051; 19.1276 90.444; 94.813; 117.164 | 1592.59 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566336 | CIF | C50 H94 B2 N6 Ni2 P4 | P -1 | 10.5516; 11.9228; 13.7755 103.985; 111.062; 90.654 | 1560 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566337 | CIF | C26 H47 B N2 O2 P2 Pd | P 1 21/c 1 | 12.5308; 15.0351; 15.989 90; 103.614; 90 | 2927.72 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566338 | CIF | C32 H52 B Cl N2 Ni P2 | R -3 c :H | 26.0265; 26.0265; 26.0801 90; 90; 120 | 15299.3 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566339 | CIF | C25 H47 B N2 P2 Pd | P b c a | 11.9139; 14.4308; 32.1655 90; 90; 90 | 5530.12 | Deziel, Anthony P.; Espinosa, Matthew R.; Pavlovic, Ljiljana; Charboneau, David J.; Hazari, Nilay; Hopmann, Kathrin H.; Mercado, Brandon Q. Ligand and solvent effects on CO2 insertion into group 10 metal alkyl bonds Chemical Science, 2022, 13, 2391-2404 |
| 1566341 | CIF | C22 H23 Cl2 F6 N3 P Rh | P 1 21/c 1 | 12.804; 13.813; 13.807 90; 95.465; 90 | 2431 | Angoy, Marta; Jiménez, M. Victoria; Lahoz, Fernando J.; Vispe, Eugenio; Pérez-Torrente, Jesús J. Polymerization of phenylacetylene catalyzed by rhodium(i) complexes with N-functionalized N-heterocyclic carbene ligands Polymer Chemistry, 2022, 13, 1411-1421 |
| 1566346 | CIF | C52 H77 B2 Na O6 | P 1 21/c 1 | 12.5628; 13.3264; 15.5838 90; 106.231; 90 | 2505 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566347 | CIF | C55 H65 B2 Cu N2 | C 1 2/c 1 | 13.312; 19.989; 17.2387 90; 96.574; 90 | 4556.9 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566348 | CIF | C55 H65 Ag B2 N2 | C 1 2/c 1 | 13.3073; 20.5224; 17.1012 90; 96.418; 90 | 4641 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566349 | CIF | C55 H65 Au B2 N2 | P b c a | 21.161; 17.679; 25.912 90; 90; 90 | 9694 | Mao, Xiaofeng; Zhang, Jie; Lu, Zhenpin; Xie, Zuowei A (μ-hydrido)diborane(4) anion and its coordination chemistry with coinage metals. Chemical science, 2022, 13, 3009-3013 |
| 1566369 | CIF | C19 H24 O3 | P 21 21 21 | 9.16551; 10.4822; 17.5734 90; 90; 90 | 1688.36 | Wang, Jianhua; Li, Xiaoxun Asymmetric β-arylation of cyclopropanols enabled by photoredox and nickel dual catalysis. Chemical science, 2022, 13, 3020-3026 |
| 1566406 | CIF | C10 H11 Cl F N O2 | P 21 21 21 | 5.1224; 8.268; 24.1637 90; 90; 90 | 1023.38 | Yamane, Daiki; Onitsuka, Satsuki; Re, Suyong; Isogai, Hikaru; Hamada, Rui; Hiramoto, Tadanari; Kawanishi, Eiji; Mizuguchi, Kenji; Shindo, Naoya; Ojida, Akio Selective covalent targeting of SARS-CoV-2 main protease by enantiopure chlorofluoroacetamide. Chemical science, 2022, 13, 3027-3034 |
| 1566407 | CIF | C22 H18 Cl F7 N4 O2 S | P 1 21/n 1 | 9.4276; 19.5575; 50.822 90; 93.634; 90 | 9351.7 | Yamane, Daiki; Onitsuka, Satsuki; Re, Suyong; Isogai, Hikaru; Hamada, Rui; Hiramoto, Tadanari; Kawanishi, Eiji; Mizuguchi, Kenji; Shindo, Naoya; Ojida, Akio Selective covalent targeting of SARS-CoV-2 main protease by enantiopure chlorofluoroacetamide. Chemical science, 2022, 13, 3027-3034 |
| 1566598 | CIF | C33 H43 Cl2 Cr N2 O2 | P -1 | 16.326; 16.389; 16.464 70.953; 89.935; 71.859 | 3932.2 | Tian, Jiliang; Zhang, Xingwang; Liu, Shaofeng; Li, Zhibo Chromium complexes supported by NNO-tridentate ligands: an unprecedented activity with the requirement of a small amount of MAO Polymer Chemistry, 2022, 13, 1852-1860 |
| 1566599 | CIF | C31 H37 Cl2 Cr F2 N2 O2 | P 1 21/c 1 | 14.4764; 14.5398; 15.5208 90; 109.539; 90 | 3078.75 | Tian, Jiliang; Zhang, Xingwang; Liu, Shaofeng; Li, Zhibo Chromium complexes supported by NNO-tridentate ligands: an unprecedented activity with the requirement of a small amount of MAO Polymer Chemistry, 2022, 13, 1852-1860 |
| 1566739 | CIF | C17 H15 N O2 | P 21 21 21 | 6.562; 14.232; 14.4563 90; 90; 90 | 1350.1 | Kim, Alexia N.; Ngamnithiporn, Aurapat; Bartberger, Michael D.; Stoltz, Brian M. Iridium-catalyzed asymmetric trans-selective hydrogenation of 1,3-disubstituted isoquinolines Chemical Science, 2022, 13, 3227-3232 |
| 1566794 | CIF | C14 H12 F6 O | P 21 21 21 | 5.8199; 11.7062; 18.082 90; 90; 90 | 1231.9 | Sathe, Devavrat; Zhou, Junfeng; Chen, Hanlin; Schrage, Briana R.; Yoon, Seiyoung; Wang, Zeyu; Ziegler, Christopher J.; Wang, Junpeng Depolymerizable semi-fluorinated polymers for sustainable functional materials Polymer Chemistry, 2022, 13, 2608-2614 |
| 1566851 | CIF | C14 H17 N2 O P | P 21 21 21 | 7.2488; 10.7508; 17.638 90; 90; 90 | 1374.5 | Zhang, Ying; Yuan, Jia; Huang, Guanglong; Yu, Hong; Liu, Jinpeng; Chen, Jian; Meng, Sixuan; Zhong, Jian-Ji; Dang, Li; Yu, Guang-Ao; Che, Chi-Ming Direct visible-light-induced synthesis of P-stereogenic phosphine oxides under air conditions. Chemical science, 2022, 13, 6519-6524 |
| 1566905 | CIF | C64 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.5713; 15.332; 21.6572 90; 96.891; 90 | 6781.3 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566906 | CIF | C66 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.7927; 15.218; 21.7299 90; 93.52; 90 | 6862.9 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566907 | CIF | C67 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.6916; 15.2813; 21.6745 90; 92.481; 90 | 6846.93 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566908 | CIF | C66 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.5389; 15.2128; 21.6422 90; 94.526; 90 | 6741.1 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566909 | CIF | C66 H50 N30 O15 Zn6 | P 1 2/c 1 | 20.7798; 15.2345; 21.6564 90; 93.144; 90 | 6845.4 | Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science, 2022, 13, 4813-4820 |
| 1566932 | CIF | C48 H36 B Cu F24 | P b c a | 18.0783; 19.0664; 27.2154 90; 90; 90 | 9380.8 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566933 | CIF | C71 H75 B Cu F24 N4 P3 | P 1 21/n 1 | 14.9684; 25.1887; 19.9836 90; 95.937; 90 | 7494.1 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566934 | CIF | C41 H65 Al Cu N4 O0.5 P3 | P -1 | 11.2148; 14.0921; 14.3396 70.906; 82.68; 80.584 | 2106 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566935 | CIF | C42.5 H64 Cu Ga N4 P3 | P -1 | 11.344; 14.194; 14.285 70.274; 79.551; 82.067 | 2121.9 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566936 | CIF | C78 H120 B12 Cl12 Cu2 Ga2 N8 P6 | P -3 c 1 | 14.9147; 14.9147; 26.629 90; 90; 120 | 5130 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566937 | CIF | C78 H120 Al2 B12 Cl12 Cu2 N8 P6 | P -3 c 1 | 14.9086; 14.9086; 26.6016 90; 90; 120 | 5120.5 | Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C. One-electron bonds in copper-aluminum and copper-gallium complexes. Chemical science, 2022, 13, 6525-6531 |
| 1566968 | CIF | C42 H33 Cu2 F10 N7 O5 S2 | P -1 | 12.9678; 14.3694; 14.5813 63.797; 69.859; 65.255 | 2171.18 | Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand. Chemical science, 2022, 13, 6619-6625 |
| 1566969 | CIF | C38 H24 B Cu2 F8 N7 O6 S2 | P 1 21/n 1 | 13.3106; 22.6847; 15.3728 90; 107.618; 90 | 4424.05 | Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand. Chemical science, 2022, 13, 6619-6625 |
| 1566970 | CIF | C78 H69 B2 Cu4 F16 N14 O12.5 S4 | P 1 21/n 1 | 12.4859; 32.2974; 21.2406 90; 90.543; 90 | 8565.14 | Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand. Chemical science, 2022, 13, 6619-6625 |
| 1566976 | CIF | C101 H175 As8 K3 N10 Nb O18 Zn4 | P 1 21/n 1 | 16.9909; 33.0617; 22.675 90; 104.519; 90 | 12330.9 | Zhang, Wei-Qiang; Morgan, Harry W. T.; McGrady, John E.; Sun, Zhong-Ming Synthesis and characterisation of the ternary intermetalloid clusters {M@[As<sub>8</sub>(ZnMes)<sub>4</sub>]}<sup>3-</sup> (M = Nb, Ta) from binary [M@As<sub>8</sub>]<sup>3-</sup> precursors. Chemical science, 2022, 13, 6744-6748 |
| 1566977 | CIF | C92 H160 As8 K3 N8 O18 Ta Zn4 | P 1 21/n 1 | 17.0926; 32.8161; 22.5199 90; 104.29; 90 | 12240.8 | Zhang, Wei-Qiang; Morgan, Harry W. T.; McGrady, John E.; Sun, Zhong-Ming Synthesis and characterisation of the ternary intermetalloid clusters {M@[As<sub>8</sub>(ZnMes)<sub>4</sub>]}<sup>3-</sup> (M = Nb, Ta) from binary [M@As<sub>8</sub>]<sup>3-</sup> precursors. Chemical science, 2022, 13, 6744-6748 |
| 1566978 | CIF | C71 H92 Cr Mg2 N4 O6 | P n a 21 | 35.2188; 15.3914; 12.77462 90; 90; 90 | 6924.7 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566979 | CIF | C71 H92 Mg2 N4 O6 W | P n a 21 | 35.3464; 15.4039; 12.869 90; 90; 90 | 7006.8 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566980 | CIF | C67 H91 Mg2 Mn N4 O3 | P 1 21/c 1 | 15.2588; 12.9668; 35.832 90; 97.903; 90 | 7022.3 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566981 | CIF | C79 H120 Mg2 N4 O2 Rh | P 1 21/n 1 | 14.0176; 13.9077; 40.2691 90; 99.749; 90 | 7737.2 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566982 | CIF | C104 H154 Cr Mg3 N6 O5 | P 1 21/c 1 | 19.433; 17.40489; 30.8931 90; 96.4115; 90 | 10383.6 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566983 | CIF | C79 H120 Ir Mg2 N4 O2 | P 1 21/n 1 | 14.0273; 13.9062; 40.2048 90; 99.779; 90 | 7728.7 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566984 | CIF | C67 H90 Cr Mg2 N4 O3 | P 1 21/c 1 | 15.3628; 12.9497; 35.885 90; 99.436; 90 | 7042.5 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566985 | CIF | C77 H100 Fe Mg2 N4 O5 | P -1 | 13.3957; 13.4353; 22.6744 99.136; 97.078; 112.627 | 3642.1 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566986 | CIF | C84 H115 Co Mg2 N4 O2 | P 1 21/c 1 | 13.9878; 13.5935; 41.687 90; 92.375; 90 | 7919.7 | Parr, Joseph M.; White, Andrew J. P.; Crimmin, Mark R. Magnesium-stabilised transition metal formyl complexes: structures, bonding, and ethenediolate formation. Chemical science, 2022, 13, 6592-6598 |
| 1566996 | CIF | C15 H15 N O S | P 1 21/n 1 | 15.7788; 5.6659; 16.0675 90; 116.848; 90 | 1281.6 | Li, Zi-Qi; He, Wen-Ji; Ni, Hui-Qi; Engle, Keary M. Directed, nickel-catalyzed 1,2-alkylsulfenylation of alkenyl carbonyl compounds. Chemical science, 2022, 13, 6567-6572 |
| 1566997 | CIF | C23 H26 N2 O S | P 1 n 1 | 7.7413; 10.5757; 25.507 90; 98.727; 90 | 2064.1 | Li, Zi-Qi; He, Wen-Ji; Ni, Hui-Qi; Engle, Keary M. Directed, nickel-catalyzed 1,2-alkylsulfenylation of alkenyl carbonyl compounds. Chemical science, 2022, 13, 6567-6572 |
| 1566998 | CIF | C47 H28 B Cl F24 | P -1 | 12.4688; 12.8052; 15.4127 79.663; 83.931; 69.083 | 2259.1 | Karandikar, Shubhendu S.; Bhattacharjee, Avik; Metze, Bryan E.; Javaly, Nicole; Valente, Edward J.; McCormick, Theresa M.; Stuart, David R. Orbital analysis of bonding in diarylhalonium salts and relevance to periodic trends in structure and reactivity. Chemical science, 2022, 13, 6532-6540 |
| 1566999 | CIF | C47 H28 B Br F24 | P -1 | 12.4957; 12.7882; 15.4855 79.453; 83.941; 69.043 | 2269.6 | Karandikar, Shubhendu S.; Bhattacharjee, Avik; Metze, Bryan E.; Javaly, Nicole; Valente, Edward J.; McCormick, Theresa M.; Stuart, David R. Orbital analysis of bonding in diarylhalonium salts and relevance to periodic trends in structure and reactivity. Chemical science, 2022, 13, 6532-6540 |
| 1567000 | CIF | C47 H28 B F24 I | P -1 | 12.5291; 12.8808; 15.7078 79.342; 83.823; 68.734 | 2319.4 | Karandikar, Shubhendu S.; Bhattacharjee, Avik; Metze, Bryan E.; Javaly, Nicole; Valente, Edward J.; McCormick, Theresa M.; Stuart, David R. Orbital analysis of bonding in diarylhalonium salts and relevance to periodic trends in structure and reactivity. Chemical science, 2022, 13, 6532-6540 |
| 1567002 | CIF | C13 H18 B Cu F4 N4 | P -1 | 7.9267; 10.4752; 10.6827 107.079; 100.319; 102.013 | 801.49 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567003 | CIF | C31 H22 B Cu F18 N6 | P 1 21/m 1 | 11.064; 13.6074; 11.4278 90; 91.989; 90 | 1719.44 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567004 | CIF | C22 H16 Ag B F6 N4 | P 1 21/n 1 | 14.6979; 10.2199; 15.7068 90; 105.812; 90 | 2270.06 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567005 | CIF | C22 H16 B Cu F6 N4 | P -1 | 10.1272; 10.3873; 12.0427 75.542; 65.639; 76.936 | 1106.56 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567006 | CIF | C13 H18 Ag F6 N4 Sb | P 1 21/n 1 | 11.724; 12.2179; 12.8999 90; 93.091; 90 | 1845.13 | Noonikara-Poyil, Anurag; Ridlen, Shawn G.; Fernández, Israel; Dias, H. V. Rasika Isolable acetylene complexes of copper and silver Chemical Science, 2022, 13, 7190-7203 |
| 1567012 | CIF | C72 H108 Br2 I2 N36 O36 | P 1 21/n 1 | 14.3431; 16.633; 20.226 90; 97.151; 90 | 4787.8 | Liu, Fengbo; Yang, Hai; Sun, Dongdong; Gao, Fang; Zhang, Xiongzhi; Zhao, Zhiyong; Han, Xie; Liu, Simin Red aqueous room-temperature phosphorescence modulated by anion–π and intermolecular electronic coupling interactions Chemical Science, 2022, 13, 7247-7255 |
| 1567013 | CIF | C24 H40 Br2 Cl2 N4 O10 | P -1 | 6.6366; 6.8219; 19.554 82.484; 87.519; 68.781 | 818.2 | Liu, Fengbo; Yang, Hai; Sun, Dongdong; Gao, Fang; Zhang, Xiongzhi; Zhao, Zhiyong; Han, Xie; Liu, Simin Red aqueous room-temperature phosphorescence modulated by anion–π and intermolecular electronic coupling interactions Chemical Science, 2022, 13, 7247-7255 |
| 1567038 | CIF | C29 H22 Cl N O | P 1 21/n 1 | 16.7731; 7.1332; 19.2367 90; 104.828; 90 | 2224.95 | Sun, Lincong; Zhao, Yuyao; Liu, Bingxian; Chang, Junbiao; Li, Xingwei RhodiumIII-catalyzed remote difunctionalization of arenes assisted by a relay directing group Chemical Science, 2022, 13, 7347-7354 |
| 1567039 | CIF | C25 H29 Cl N O Rh | P 1 21/c 1 | 18.7457; 7.7279; 31.217 90; 93.528; 90 | 4513.68 | Sun, Lincong; Zhao, Yuyao; Liu, Bingxian; Chang, Junbiao; Li, Xingwei RhodiumIII-catalyzed remote difunctionalization of arenes assisted by a relay directing group Chemical Science, 2022, 13, 7347-7354 |
| 1567040 | CIF | C37 H38 N2 O4 S | P 1 21/c 1 | 9.018; 20.697; 17.164 90; 98.38; 90 | 3169 | Jiang, Kun; Li, Shi-Jun; Liu, Qing-Peng; Yu, Ning; Li, Yu-Lin; Zhou, Yu-Qiang; He, Kui-Cheng; Lin, Jing; Zheng, Ting-Yu; Lang, Jian; Lan, Yu; Wei, Ye Iminyl radical-triggered relay annulation for the construction of bridged aza-tetracycles bearing four contiguous stereogenic centers Chemical Science, 2022, 13, 7283-7288 |
| 1567048 | CIF | C53 H37 N11 O4 | P 1 | 10.1334; 10.2002; 11.4807 93.3946; 99.9779; 107.948 | 1103.79 | Gorai, Tumpa; Lovitt, June I.; Umadevi, Deivasigamani; McManus, Gavin; Gunnlaugsson, Thorfinnur Hierarchical supramolecular co-assembly formation employing multi-component light-harvesting charge transfer interactions giving rise to long-wavelength emitting luminescent microspheres. Chemical science, 2022, 13, 7805-7813 |
| 1567049 | CIF | C37.75 H43.75 Cl5.25 N6 O6 | P 1 | 12.733; 13.433; 14.738 63.059; 71.223; 73.702 | 2100.3 | Al Kelabi, Dana; Dey, Avishek; Alimi, Lukman O.; Piwoński, Hubert; Habuchi, Satoshi; Khashab, Niveen M. Photostable polymorphic organic cages for targeted live cell imaging Chemical Science, 2022, 13, 7341-7346 |
| 1567072 | CIF | C18 H17 N5 O5 | P 1 21 1 | 7.1241; 34.022; 7.3539 90; 90.288; 90 | 1782.4 | Zhang, Dequan; Wen, Jialin; Zhang, Xumu Construction of a quaternary stereogenic center by asymmetric hydroformylation: a straightforward method to prepare chiral α-quaternary amino acids Chemical Science, 2022, 13, 7215-7223 |
| 1567073 | CIF | C48 H45 Cl N2 Pd | P 21 21 21 | 11.191; 18.5238; 21.495 90; 90; 90 | 4455.9 | Lu, Zhou; Liao, Yudan; Fan, Weigang; Dai, Shengyu Efficient suppression of the chain transfer reaction in ethylene coordination polymerization with dibenzosuberyl substituents Polymer Chemistry, 2022, 13, 4090-4099 |
| 1567076 | CIF | C111 H127 N11 O4 | P -1 | 14.7293; 18.9653; 22.0241 66.815; 72.348; 74.252 | 5307.4 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567077 | CIF | C109 H121 B4 F8 N11 O5 | P 21 21 21 | 17.2251; 23.1997; 28.8441 90; 90; 90 | 11526.6 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567078 | CIF | C111 H129 B2 Cl4 F4 N11 O5 | P b c n | 38.9356; 18.8132; 29.4619 90; 90; 90 | 21580.9 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567079 | CIF | C104 H104 B3 F6 N11 | P -1 | 12.9759; 17.3; 23.1532 82.59; 81.602; 76.517 | 4975.7 | Zhou, Weinan; Sarma, Tridib; Yang, Liu; Lei, Chuanhu; Sessler, Jonathan L. Controlled assembly of a bicyclic porphyrinoid and its 3-dimensional boron difluoride arrays Chemical Science, 2022, 13, 7276-7282 |
| 1567080 | CIF | C38 H60 B2 N4 O4 | P 1 21/n 1 | 8.465; 16.1068; 13.6527 90; 95.327; 90 | 1853.43 | Kuehn, Laura; Zapf, Ludwig; Werner, Luis; Stang, Martin; Würtemberger-Pietsch, Sabrina; Krummenacher, Ivo; Braunschweig, Holger; Lacôte, Emmanuel; Marder, Todd B.; Radius, Udo NHC induced radical formation <i>via</i> homolytic cleavage of B-B bonds and its role in organic reactions. Chemical science, 2022, 13, 8321-8333 |
| 1567081 | CIF | C20 H36 B I N4 O2 | P 1 2/c 1 | 13.3858; 14.2988; 13.1709 90; 109.65; 90 | 2374.11 | Kuehn, Laura; Zapf, Ludwig; Werner, Luis; Stang, Martin; Würtemberger-Pietsch, Sabrina; Krummenacher, Ivo; Braunschweig, Holger; Lacôte, Emmanuel; Marder, Todd B.; Radius, Udo NHC induced radical formation <i>via</i> homolytic cleavage of B-B bonds and its role in organic reactions. Chemical science, 2022, 13, 8321-8333 |
| 1567087 | CIF | C45 H60 Cl2 N2 O4 S2 | P -1 | 13.984; 14.07; 14.277 61.576; 82.569; 62.486 | 2176.2 | Ning, Chao; Rui, Kang-Hua; Wei, Yin; Shi, Min Rh(i)-catalyzed dimerization of ene-vinylidenecyclopropanes for the construction of spiro[4,5]decanes and mechanistic studies Chemical Science, 2022, 13, 7310-7317 |
| 1567088 | CIF | C13 H14 Cl I O2 | P 21 21 21 | 8.9639; 11.1228; 13.259 90; 90; 90 | 1321.97 | Payne, Jenna L.; Deng, Zihang; Flach, Andrew L.; Johnston, Jeffrey N. Enantioselective iodolactonization to prepare ε-lactone rings using hypervalent iodine Chemical Science, 2022, 13, 7318-7324 |
| 1567091 | CIF | C57 H99 Fe K N5 O6 Si2 | P 1 21/c 1 | 11.9424; 24.7899; 22.9964 90; 95.974; 90 | 6771.1 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567092 | CIF | C39 H63 Fe N3 Si2 | P b c a | 19.2646; 16.7587; 24.952 90; 90; 90 | 8055.7 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567093 | CIF | C48 H88 Fe K N4 O6 Si2 | P 1 21/n 1 | 18.281; 14.0555; 22.1239 90; 106.298; 90 | 5456.3 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567094 | CIF | C58 H99 Fe K N5 O6 S2 Si2 | P 1 21/c 1 | 13.8538; 24.6616; 23.5229 90; 90.755; 90 | 8036.1 | Reith, Sascha; Demeshko, Serhiy; Battistella, Beatrice; Reckziegel, Alexander; Schneider, Christian; Stoy, Andreas; Lichtenberg, Crispin; Meyer, Franc; Munz, Dominik; Werncke, C. Gunnar Between imide, imidyl and nitrene - an imido iron complex in two oxidation states. Chemical science, 2022, 13, 7907-7913 |
| 1567095 | CIF | C35 H24 N2 O9 S4 | P 1 21/c 1 | 12.807; 13.731; 20.965 90; 110.6; 90 | 3451.02 | Liu, Chunyang; Shangguan, Xiaoyan; Li, Yan; Zhang, Qian Copper-catalyzed radical cascade reaction of simple cyclobutanes: synthesis of highly functionalized cyclobutene derivatives. Chemical science, 2022, 13, 7886-7891 |
| 1567096 | CIF | C8 H7.33 Br2 O0.67 | P 1 21/m 1 | 7.6142; 7.1461; 12.6645 90; 106.526; 90 | 660.63 | Liu, Chunyang; Shangguan, Xiaoyan; Li, Yan; Zhang, Qian Copper-catalyzed radical cascade reaction of simple cyclobutanes: synthesis of highly functionalized cyclobutene derivatives. Chemical science, 2022, 13, 7886-7891 |
| 1567097 | CIF | C19 H13 N3 O | P -1 | 6.1025; 8.5817; 14.6868 86.201; 80.086; 76.138 | 735.34 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567098 | CIF | C21 H13 F3 N2 O | P 1 21/c 1 | 12.0851; 7.7428; 19.0267 90; 102.465; 90 | 1738.41 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567099 | CIF | C22 H19 N3 O | I 1 2/a 1 | 21.1606; 7.1694; 25.5604 90; 110.862; 90 | 3623.5 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567100 | CIF | C17 H13 Cl N2 O | C 1 c 1 | 5.7112; 23.177; 10.865 90; 90.891; 90 | 1438 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567101 | CIF | C27 H17 N3 O | P 1 21/n 1 | 11.3712; 9.205; 19.1767 90; 104.402; 90 | 1944.18 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567102 | CIF | C21 H16 N2 O | P 21 21 21 | 7.4535; 11.5915; 18.893 90; 90; 90 | 1632.3 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567108 | CIF | C42 H36 Ag13 F18 N6 O18 S6 | P -1 | 14.0332; 15.3545; 22.418 82.805; 84.35; 88.156 | 4768.2 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567109 | CIF | C14 H14 F6 N2 O6 S2 | P -1 | 6.8729; 8.3071; 8.8774 77.25; 88.991; 75.454 | 478.12 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567110 | CIF | C51 H50 Ag F9 N16 O9 S3 | P 1 21/c 1 | 13.6223; 29.4112; 17.5734 90; 111.122; 90 | 6567.72 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567111 | CIF | C62 H55 Ag5 F9 N17 O9 S3 | C 1 2/c 1 | 38.1353; 21.9159; 25.6721 90; 129.97; 90 | 16443.4 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567112 | CIF | C59 H57 Ag5 F9 N17 O9 S3 | P -1 | 14.8014; 22.3158; 24.83 84.932; 76.949; 73.121 | 7643.2 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567113 | CIF | C57 H53 Ag5 F9 N17 O9 S3 | I 1 2/a 1 | 25.7535; 24.5293; 24.9163 90; 91.174; 90 | 15736.7 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567114 | CIF | C18 H22 F6 N2 O6 S2 | P -1 | 9.0344; 12.927; 15.428 85.714; 87.099; 87.475 | 1792.99 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567115 | CIF | C72 H48 Ag13 F18 N6 O18 S6 | F d d d :2 | 16.1557; 30.2077; 58.888 90; 90; 90 | 28739 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567133 | CIF | C17 H21 N O2 | P -1 | 8.1149; 9.1915; 10.8628 68.232; 78.44; 81.264 | 734.51 | Yu, Wan-Lei; Ren, Zi-Gang; Ma, Ke-Xing; Yang, Hui-Qing; Yang, Jun-Jie; Zheng, Haixue; Wu, Wangsuo; Xu, Peng-Fei Cobalt-catalyzed chemoselective dehydrogenation through radical translocation under visible light. Chemical science, 2022, 13, 7947-7954 |
| 1567134 | CIF | C31 H32 Co N5 O4 Sn | P b c a | 15.0187; 14.1539; 30.0583 90; 90; 90 | 6389.6 | Yu, Wan-Lei; Ren, Zi-Gang; Ma, Ke-Xing; Yang, Hui-Qing; Yang, Jun-Jie; Zheng, Haixue; Wu, Wangsuo; Xu, Peng-Fei Cobalt-catalyzed chemoselective dehydrogenation through radical translocation under visible light. Chemical science, 2022, 13, 7947-7954 |
| 1567145 | CIF | C102 H148 Ag16 Cl F15 N4 O16 S9 | P -1 | 17.2901; 17.3047; 29.001 94.002; 97.603; 119.287 | 7410.1 | Das, Anish Kumar; Biswas, Sourav; Manna, Surya Sekhar; Pathak, Biswarup; Mandal, Sukhendu An atomically precise silver nanocluster for artificial light-harvesting system through supramolecular functionalization. Chemical science, 2022, 13, 8355-8364 |
| 1567146 | CIF | C23 H42 Cl Ir N4 O P2 | P 1 21/c 1 | 17.533; 8.1217; 21.3907 90; 111.63; 90 | 2831.5 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567147 | CIF | C23 H42 I Ir N4 O P2 | P 1 21/c 1 | 17.9499; 8.1504; 21.5003 90; 110.968; 90 | 2937.18 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567148 | CIF | C25 H44 Cl3 Ir N4 O P2 | P 1 21/n 1 | 11.9445; 10.1985; 25.8721 90; 94.016; 90 | 3143.9 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567149 | CIF | C48 H89 F2 Ir2 N9 O3 P4 | P -1 | 11.8995; 16.0723; 17.0807 67.203; 75.219; 89.306 | 2898.06 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567150 | CIF | C25 H48 F6 Ir N4 O P3 | P -1 | 13.2443; 16.1281; 16.2491 77.427; 82.219; 84.357 | 3347.95 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567151 | CIF | C23 H42 Br Ir N4 O P2 | P 1 21/c 1 | 17.7005; 8.1175; 21.384 90; 111.189; 90 | 2864.81 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567152 | CIF | C23 H42 F6 Ir N4 O P3 | P 1 21/c 1 | 12.0735; 10.6615; 23.5954 90; 92.963; 90 | 3033.18 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567153 | CIF | C26 H45.5 Ir N5.5 O P2 | P b c a | 26.0183; 23.433; 31.3406 90; 90; 90 | 19107.9 | Jain, Anant Kumar; Gau, Michael R.; Carroll, Patrick J.; Goldberg, Karen I. The underappreciated influence of ancillary halide on metal-ligand proton tautomerism. Chemical science, 2022, 13, 7837-7845 |
| 1567156 | CIF | C30 H27 N O5 S | P 21 21 21 | 9.4559; 16.0249; 16.2168 90; 90; 90 | 2457.33 | Yang, Liangkun; Li, Wang-Yuren; Hou, Liuzhen; Zhan, Tangyu; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming NickelII-catalyzed asymmetric photoenolization/Mannich reaction of (2-alkylphenyl) ketones Chemical Science, 2022, 13, 8576-8582 |
| 1567157 | CIF | C30 H25 N O4 S | P 21 21 21 | 9.6145; 18.9746; 26.9615 90; 90; 90 | 4918.62 | Yang, Liangkun; Li, Wang-Yuren; Hou, Liuzhen; Zhan, Tangyu; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming NickelII-catalyzed asymmetric photoenolization/Mannich reaction of (2-alkylphenyl) ketones Chemical Science, 2022, 13, 8576-8582 |
| 1567161 | CIF | C29 H29 B2 Cl2 N2 P Ru S3 | P 1 21/n 1 | 9.9824; 23.4742; 13.6413 90; 94.6068; 90 | 3186.2 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567162 | CIF | C32 H45 B2 N2 P Ru S5 | P 1 21/c 1 | 17.2497; 15.0068; 19.7663 90; 115.089; 90 | 4634 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567163 | CIF | C33 H36 B2 Cl2 N2 Ru S4 | P -1 | 8.1421; 9.038; 11.991 91.746; 95.358; 91.618 | 877.7 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567164 | CIF | C40 H47 Cl2 N3 P Ru S6 | C 1 2/c 1 | 43.162; 11.6075; 17.077 90; 94.107; 90 | 8533.7 | Zafar, Mohammad; Ahmad, Asif; Saha, Suvam; Ramalakshmi, Rongala; Roisnel, Thierry; Ghosh, Sundargopal Cooperative B–H bond activation: dual site borane activation by redox active κ2-N,S-chelated complexes Chemical Science, 2022, 13, 8567-8575 |
| 1567165 | CIF | C16 H14 O2 | P 21 21 21 | 5.247; 8.2089; 28.1307 90; 90; 90 | 1211.65 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567166 | CIF | C12 H12 O3 | P 21 21 21 | 8.796; 10.4133; 10.7857 90; 90; 90 | 987.92 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567167 | CIF | C16 H14 O2 | P 21 21 21 | 5.9107; 13.8035; 15.3174 90; 90; 90 | 1249.72 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567168 | CIF | C14 H12 O2 | P 21 21 21 | 8.6793; 22.7043; 11.0413 90; 90; 90 | 2175.77 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567169 | CIF | C14 H17 Br O5 | P -1 | 7.8803; 9.7157; 10.6212 94.241; 94.434; 111.794 | 748.16 | Zhang, Chang-Sheng; Shao, Ya-Ping; Zhang, Fu-Min; Han, Xue; Zhang, Xiao-Ming; Zhang, Kun; Tu, Yong-Qiang Cu(ii)/SPDO complex catalyzed asymmetric Baeyer-Villiger oxidation of 2-arylcyclobutanones and its application for the total synthesis of eupomatilones 5 and 6. Chemical science, 2022, 13, 8429-8435 |
| 1567170 | CIF | C6 H12 N2 O4 | C 1 2/c 1 | 20.8643; 4.5307; 8.748 90; 102.292; 90 | 807.99 | Jang, Yoon-Jung; Sangroniz, Leire; Hillmyer, Marc A. Ductile gas barrier poly(ester–amide)s derived from glycolide Polymer Chemistry, 2022, 13, 3882-3891 |
| 1567171 | CIF | C8 H16 N2 O4 | P 1 21/c 1 | 8.1288; 7.536; 8.551 90; 113.285; 90 | 481.16 | Jang, Yoon-Jung; Sangroniz, Leire; Hillmyer, Marc A. Ductile gas barrier poly(ester–amide)s derived from glycolide Polymer Chemistry, 2022, 13, 3882-3891 |
| 1567172 | CIF | C10 H20 N2 O4 | C 1 2/c 1 | 25.3633; 5.2161; 8.9982 90; 103.025; 90 | 1159.81 | Jang, Yoon-Jung; Sangroniz, Leire; Hillmyer, Marc A. Ductile gas barrier poly(ester–amide)s derived from glycolide Polymer Chemistry, 2022, 13, 3882-3891 |
| 1567184 | CIF | C22 H56 Al O P Si4 | P -1 | 9.05033; 11.72687; 16.30904 94.4336; 96.4467; 108.884 | 1615.45 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567185 | CIF | C23 H55 Al O3 P Si4 | P 1 21/n 1 | 11.738; 28.6426; 11.8207 90; 119.12; 90 | 3471.9 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567186 | CIF | C30 H78 Al2 O4 Si8 | P 1 21/n 1 | 14.912; 9.33098; 17.8266 90; 104.662; 90 | 2399.68 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
| 1567187 | CIF | C23 H58 Al O3 P Si4 | P -1 | 12.51484; 16.89311; 17.04953 84.6973; 76.7333; 75.257 | 3390.6 | Wickemeyer, Lucas; Aders, Niklas; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Cabrera-Trujillo, Jorge J; Fernández, Israel; Mitzel, Norbert W. Carbon dioxide reduction by an Al-O-P frustrated Lewis pair. Chemical science, 2022, 13, 8088-8094 |
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