Crystallography Open Database

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Searching journal of publication like 'Chemical science' volume of publication is 9

COD ID: 1547705
CIF file Formula: - C39 H23 Cl8 Dy N5 Na O5 -
Comments: Miralles, Sara G.; Bedoya-Pinto, Amilcar; Baldoví, José J; Cañon-Mancisidor, Walter; Prado, Yoann; Prima-Garcia, Helena; Gaita-Ariño, Alejandro; Mínguez Espallargas, Guillermo; Hueso, Luis E.; Coronado, Eugenio Sublimable chloroquinolinate lanthanoid single-ion magnets deposited on ferromagnetic electrodes. Chemical science 9(1) (2018) 199-208
Space group: P 1 21/c 1
Cell volume: 4091.26
Cell parameters: 9.9819; 19.8256; 20.6783; 90; 91.212; 90;  

COD ID: 1547706
CIF file Formula: - C84 H58 Cl16 Dy2 K N11 O8 -
Comments: Miralles, Sara G.; Bedoya-Pinto, Amilcar; Baldoví, José J; Cañon-Mancisidor, Walter; Prado, Yoann; Prima-Garcia, Helena; Gaita-Ariño, Alejandro; Mínguez Espallargas, Guillermo; Hueso, Luis E.; Coronado, Eugenio Sublimable chloroquinolinate lanthanoid single-ion magnets deposited on ferromagnetic electrodes. Chemical science 9(1) (2018) 199-208
Space group: P -1
Cell volume: 4322.5
Cell parameters: 15.8989; 16.0286; 19.542; 98.384; 91.201; 118.115;  

COD ID: 1547707
CIF file Formula: - C44 H36 Cl8 Dy N5 O4 -
Comments: Miralles, Sara G.; Bedoya-Pinto, Amilcar; Baldoví, José J; Cañon-Mancisidor, Walter; Prado, Yoann; Prima-Garcia, Helena; Gaita-Ariño, Alejandro; Mínguez Espallargas, Guillermo; Hueso, Luis E.; Coronado, Eugenio Sublimable chloroquinolinate lanthanoid single-ion magnets deposited on ferromagnetic electrodes. Chemical science 9(1) (2018) 199-208
Space group: C 1 2/c 1
Cell volume: 8976
Cell parameters: 36.1061; 11.5705; 22.7831; 90; 109.429; 90;  

COD ID: 1547767
CIF file Formula: - C36 Al F30 N3 -
Comments: Kögel, J F; Sorokin, D. A.; Khvorost, A.; Scott, M.; Harms, K.; Himmel, D.; Krossing, I.; Sundermeyer, J. The Lewis superacid Al[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> and its higher homolog Ga[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> - structural features, theoretical investigation and reactions of a metal amide with higher fluoride ion affinity than SbF<sub>5</sub>. Chemical science 9(1) (2018) 245-253
Space group: P -1
Cell volume: 1809.2
Cell parameters: 10.86; 12.7006; 14.3671; 73.501; 72.779; 89.315;  

COD ID: 1547768
CIF file Formula: - C105 H31 Al2 F62 Li N6 -
Comments: Kögel, J F; Sorokin, D. A.; Khvorost, A.; Scott, M.; Harms, K.; Himmel, D.; Krossing, I.; Sundermeyer, J. The Lewis superacid Al[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> and its higher homolog Ga[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> - structural features, theoretical investigation and reactions of a metal amide with higher fluoride ion affinity than SbF<sub>5</sub>. Chemical science 9(1) (2018) 245-253
Space group: P -1
Cell volume: 5054.7
Cell parameters: 14.4989; 18.051; 21.909; 84.427; 73.249; 67.033;  

COD ID: 1547769
CIF file Formula: - C36 F30 Ga N3 -
Comments: Kögel, J F; Sorokin, D. A.; Khvorost, A.; Scott, M.; Harms, K.; Himmel, D.; Krossing, I.; Sundermeyer, J. The Lewis superacid Al[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> and its higher homolog Ga[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> - structural features, theoretical investigation and reactions of a metal amide with higher fluoride ion affinity than SbF<sub>5</sub>. Chemical science 9(1) (2018) 245-253
Space group: P 1 21/c 1
Cell volume: 3569.1
Cell parameters: 7.9908; 20.611; 22.8236; 90; 108.292; 90;  

COD ID: 1547770
CIF file Formula: - C57 H24 Al Cs F31 N3 -
Comments: Kögel, J F; Sorokin, D. A.; Khvorost, A.; Scott, M.; Harms, K.; Himmel, D.; Krossing, I.; Sundermeyer, J. The Lewis superacid Al[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> and its higher homolog Ga[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> - structural features, theoretical investigation and reactions of a metal amide with higher fluoride ion affinity than SbF<sub>5</sub>. Chemical science 9(1) (2018) 245-253
Space group: P 1 21/c 1
Cell volume: 5710.6
Cell parameters: 13.0294; 26.0373; 16.8481; 90; 92.421; 90;  

COD ID: 1547771
CIF file Formula: - C125 H52 As2 Cl2 F60 Ga2 N6 -
Comments: Kögel, J F; Sorokin, D. A.; Khvorost, A.; Scott, M.; Harms, K.; Himmel, D.; Krossing, I.; Sundermeyer, J. The Lewis superacid Al[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> and its higher homolog Ga[N(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sub>3</sub> - structural features, theoretical investigation and reactions of a metal amide with higher fluoride ion affinity than SbF<sub>5</sub>. Chemical science 9(1) (2018) 245-253
Space group: P -1
Cell volume: 2873
Cell parameters: 11.2887; 13.9044; 20.9274; 98.126; 103.279; 111.821;  

COD ID: 1547772
CIF file Formula: - C13 H19 N O -
Comments: Gao, Bao; Zhang, Guoying; Zhou, Xibing; Huang, Hanmin Palladium-catalyzed regiodivergent hydroaminocarbonylation of alkenes to primary amides with ammonium chloride. Chemical science 9(2) (2018) 380-386
Space group: P 1 21/c 1
Cell volume: 1205.9
Cell parameters: 19.555; 6.165; 10.117; 90; 98.628; 90;  

COD ID: 1547773
CIF file Formula: - C9 H10 Cl N O -
Comments: Gao, Bao; Zhang, Guoying; Zhou, Xibing; Huang, Hanmin Palladium-catalyzed regiodivergent hydroaminocarbonylation of alkenes to primary amides with ammonium chloride. Chemical science 9(2) (2018) 380-386
Space group: C 1 2/c 1
Cell volume: 1860.4
Cell parameters: 27.159; 7.49; 9.539; 90; 106.51; 90;  

COD ID: 1547774
CIF file Formula: - C21 H36 Cl O P Pd -
Comments: Gao, Bao; Zhang, Guoying; Zhou, Xibing; Huang, Hanmin Palladium-catalyzed regiodivergent hydroaminocarbonylation of alkenes to primary amides with ammonium chloride. Chemical science 9(2) (2018) 380-386
Space group: P -1
Cell volume: 1133.55
Cell parameters: 8.6745; 9.6624; 13.8499; 86.795; 81.245; 81.324;  

COD ID: 1547775
CIF file Formula: - C15 H15 N O -
Comments: Gao, Bao; Zhang, Guoying; Zhou, Xibing; Huang, Hanmin Palladium-catalyzed regiodivergent hydroaminocarbonylation of alkenes to primary amides with ammonium chloride. Chemical science 9(2) (2018) 380-386
Space group: P 1 21/c 1
Cell volume: 1210.6
Cell parameters: 12.295; 5.569; 18.014; 90; 101.033; 90;  

COD ID: 1547805
CIF file Formula: - C21 H19.5 N3 O0.5 -
Comments: Li, Wanfang; Boon, Jie Kang; Zhao, Yu Nickel-catalyzed difunctionalization of allyl moieties using organoboronic acids and halides with divergent regioselectivities. Chemical science 9(3) (2018) 600-607
Space group: C 1 2/c 1
Cell volume: 3477.76
Cell parameters: 35.5176; 4.6594; 23.3989; 90; 116.089; 90;  

COD ID: 1547835
CIF file Formula: - C19 H20 O3 -
Comments: Joyce, Leo A.; Nawrat, Christopher C.; Sherer, Edward C.; Biba, Mirlinda; Brunskill, Andrew; Martin, Gary E.; Cohen, Ryan D.; Davies, Ian W. Beyond optical rotation: what's left is not always right in total synthesis. Chemical science 9(2) (2018) 415-424
Space group: P 21 21 21
Cell volume: 1526.06
Cell parameters: 8.3146; 11.1767; 16.4216; 90; 90; 90;  

COD ID: 1547836
CIF file Formula: - C50 H34 Co Fe2 N14 O2 -
Comments: Jiang, Wenjing; Jiao, Chengqi; Meng, Yinshan; Zhao, Liang; Liu, Qiang; Liu, Tao Switching single chain magnet behavior <i>via</i> photoinduced bidirectional metal-to-metal charge transfer. Chemical science 9(3) (2018) 617-622
Space group: C 1 2/c 1
Cell volume: 4956
Cell parameters: 27.352; 15.144; 13.336; 90; 116.222; 90;  

COD ID: 1547843
CIF file Formula: - C26 H22 F2 N2 O2 -
Comments: Lv, Zhuang; Wei, Huanjie; Li, Qing; Su, Xianlong; Liu, Shujuan; Zhang, Kenneth Yin; Lv, Wen; Zhao, Qiang; Li, Xianghong; Huang, Wei Achieving efficient photodynamic therapy under both normoxia and hypoxia using cyclometalated Ru(ii) photosensitizer through type I photochemical process. Chemical science 9(2) (2018) 502-512
Space group: P 1 21/c 1
Cell volume: 2124.5
Cell parameters: 8.3521; 12.418; 20.681; 90; 97.923; 90;  

COD ID: 1547871
CIF file Formula: - C19 H24 N4 O S -
Comments: Wei, Peng; Yuan, Wei; Xue, Fengfeng; Zhou, Wei; Li, Ruohan; Zhang, Datong; Yi, Tao Deformylation reaction-based probe for <i>in vivo</i> imaging of HOCl. Chemical science 9(2) (2018) 495-501
Space group: P 1 21/n 1
Cell volume: 1807.4
Cell parameters: 5.9414; 15.879; 19.207; 90; 94.096; 90;  

COD ID: 1547872
CIF file Formula: - C17 H19 N3 O S -
Comments: Wei, Peng; Yuan, Wei; Xue, Fengfeng; Zhou, Wei; Li, Ruohan; Zhang, Datong; Yi, Tao Deformylation reaction-based probe for <i>in vivo</i> imaging of HOCl. Chemical science 9(2) (2018) 495-501
Space group: P 1 21/c 1
Cell volume: 1566.2
Cell parameters: 16.166; 8.073; 12.176; 90; 99.741; 90;  

COD ID: 1547877
CIF file Formula: - C30 H26 Eu F9 O9 S3 -
Comments: Babel, Lucille; Guénée, Laure; Besnard, Céline; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Cooperative loading of multisite receptors with lanthanide containers: an approach for organized luminescent metallopolymers. Chemical science 9(2) (2018) 325-335
Space group: P 1 21/c 1
Cell volume: 3592.68
Cell parameters: 11.81; 16.5659; 18.388; 90; 92.9627; 90;  

COD ID: 1547878
CIF file Formula: - C30 H26 F9 O9 S3 Y -
Comments: Babel, Lucille; Guénée, Laure; Besnard, Céline; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Cooperative loading of multisite receptors with lanthanide containers: an approach for organized luminescent metallopolymers. Chemical science 9(2) (2018) 325-335
Space group: P 1 21/c 1
Cell volume: 3625.29
Cell parameters: 10.5124; 18.3614; 18.9788; 90; 98.264; 90;  

COD ID: 1547879
CIF file Formula: - C72 H46 Cl2 Eu F24 N5 O6 -
Comments: Babel, Lucille; Guénée, Laure; Besnard, Céline; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Cooperative loading of multisite receptors with lanthanide containers: an approach for organized luminescent metallopolymers. Chemical science 9(2) (2018) 325-335
Space group: P 1 21/n 1
Cell volume: 7170.7
Cell parameters: 13.7492; 20.1925; 25.829; 90; 90.402; 90;  

COD ID: 1547880
CIF file Formula: - C36 H17 Eu F24 O9 -
Comments: Babel, Lucille; Guénée, Laure; Besnard, Céline; Eliseeva, Svetlana V.; Petoud, Stéphane; Piguet, Claude Cooperative loading of multisite receptors with lanthanide containers: an approach for organized luminescent metallopolymers. Chemical science 9(2) (2018) 325-335
Space group: P 1 21/c 1
Cell volume: 4238.4
Cell parameters: 8.38538; 27.3868; 18.8875; 90; 102.271; 90;  

COD ID: 1547881
CIF file Formula: - C19 H19 Br N2 Ni -
Comments: Jia, Xue-Gong; Guo, Peng; Duan, Jicheng; Shu, Xing-Zhong Dual nickel and Lewis acid catalysis for cross-electrophile coupling: the allylation of aryl halides with allylic alcohols. Chemical science 9(3) (2018) 640-645
Space group: P 1 21/c 1
Cell volume: 1717.4
Cell parameters: 8.4028; 11.9498; 17.1489; 90; 94.163; 90;  

COD ID: 1547882
CIF file Formula: - C22 H23 N O4 -
Comments: Liu, Kai; Xu, Guangyang; Sun, Jiangtao Gold-catalyzed stereoselective dearomatization/metal-free aerobic oxidation: access to 3-substituted indolines/oxindoles. Chemical science 9(3) (2018) 634-639
Space group: P -1
Cell volume: 958.74
Cell parameters: 8.7005; 10.2416; 11.4433; 76.304; 83.414; 75.816;  

COD ID: 1547883
CIF file Formula: - C20 H23 N O6 -
Comments: Liu, Kai; Xu, Guangyang; Sun, Jiangtao Gold-catalyzed stereoselective dearomatization/metal-free aerobic oxidation: access to 3-substituted indolines/oxindoles. Chemical science 9(3) (2018) 634-639
Space group: P 1 21/c 1
Cell volume: 1896.3
Cell parameters: 5.9171; 24.525; 13.126; 90; 95.432; 90;  

COD ID: 1547884
CIF file Formula: - C25 H23 N O4 -
Comments: Liu, Kai; Xu, Guangyang; Sun, Jiangtao Gold-catalyzed stereoselective dearomatization/metal-free aerobic oxidation: access to 3-substituted indolines/oxindoles. Chemical science 9(3) (2018) 634-639
Space group: P 1 21/c 1
Cell volume: 2085.8
Cell parameters: 10.5469; 20.177; 10.7298; 90; 114.01; 90;  

COD ID: 1547885
CIF file Formula: - C24 H21 N O4 -
Comments: Liu, Kai; Xu, Guangyang; Sun, Jiangtao Gold-catalyzed stereoselective dearomatization/metal-free aerobic oxidation: access to 3-substituted indolines/oxindoles. Chemical science 9(3) (2018) 634-639
Space group: C 1 2/c 1
Cell volume: 3878.3
Cell parameters: 23.476; 10.1603; 18.561; 90; 118.836; 90;  

COD ID: 1547942
CIF file Formula: - C24 H23 N O6 -
Comments: Kuang, Yulong; Shen, Bin; Dai, Li; Yao, Qian; Liu, Xiaohua; Lin, Lili; Feng, Xiaoming Diastereodivergent asymmetric Michael-alkylation reactions using chiral <i>N</i>,<i>N</i>'-dioxide/metal complexes. Chemical science 9(3) (2018) 688-692
Space group: P 1 21 1
Cell volume: 1098.21
Cell parameters: 10.5132; 9.6837; 10.8056; 90; 93.347; 90;  

COD ID: 1547943
CIF file Formula: - C24 H23 N O6 -
Comments: Kuang, Yulong; Shen, Bin; Dai, Li; Yao, Qian; Liu, Xiaohua; Lin, Lili; Feng, Xiaoming Diastereodivergent asymmetric Michael-alkylation reactions using chiral <i>N</i>,<i>N</i>'-dioxide/metal complexes. Chemical science 9(3) (2018) 688-692
Space group: P 1 21 1
Cell volume: 1088.01
Cell parameters: 6.6941; 8.926; 18.2322; 90; 92.895; 90;  

COD ID: 1547944
CIF file Formula: - C19 H16 Cl N O4 -
Comments: Kuang, Yulong; Shen, Bin; Dai, Li; Yao, Qian; Liu, Xiaohua; Lin, Lili; Feng, Xiaoming Diastereodivergent asymmetric Michael-alkylation reactions using chiral <i>N</i>,<i>N</i>'-dioxide/metal complexes. Chemical science 9(3) (2018) 688-692
Space group: P 1 21/n 1
Cell volume: 3557.55
Cell parameters: 12.3416; 17.221; 16.8272; 90; 95.88; 90;  

COD ID: 1548021
CIF file Formula: - C60 H76 Co3 N36 O8 W2 -
Comments: Zhang, Yuan-Zhu; Dolinar, Brian S.; Liu, Shihao; Brown, Andrew J.; Zhang, Xuan; Wang, Zhao-Xi; Dunbar, Kim R. Enforcing Ising-like magnetic anisotropy <i>via</i> trigonal distortion in the design of a W(v)-Co(ii) cyanide single-chain magnet. Chemical science 9(1) (2018) 119-124
Space group: P -1
Cell volume: 1954.6
Cell parameters: 11.91; 12.221; 15.587; 69.947; 81.802; 66.513;  

COD ID: 1548053
CIF file Formula: - C26 H17 N -
Comments: Suzuki, Tsuyoshi; Okada, Hiroshi; Nakagawa, Takafumi; Komatsu, Kazuki; Fujimoto, Chikako; Kagi, Hiroyuki; Matsuo, Yutaka A fluorenylidene-acridane that becomes dark in color upon grinding - ground state mechanochromism by conformational change. Chemical science 9(2) (2018) 475-482
Space group: P b c a
Cell volume: 3435
Cell parameters: 8.2997; 33.2041; 12.4646; 90; 90; 90;  

COD ID: 1548054
CIF file Formula: - C27 H19 N -
Comments: Suzuki, Tsuyoshi; Okada, Hiroshi; Nakagawa, Takafumi; Komatsu, Kazuki; Fujimoto, Chikako; Kagi, Hiroyuki; Matsuo, Yutaka A fluorenylidene-acridane that becomes dark in color upon grinding - ground state mechanochromism by conformational change. Chemical science 9(2) (2018) 475-482
Space group: P 1 21/a 1
Cell volume: 1466.6
Cell parameters: 7.379; 22.716; 9.381; 90; 111.14; 90;  

COD ID: 1548055
CIF file Formula: - C27 H19 N -
Comments: Suzuki, Tsuyoshi; Okada, Hiroshi; Nakagawa, Takafumi; Komatsu, Kazuki; Fujimoto, Chikako; Kagi, Hiroyuki; Matsuo, Yutaka A fluorenylidene-acridane that becomes dark in color upon grinding - ground state mechanochromism by conformational change. Chemical science 9(2) (2018) 475-482
Space group: P 1 21/a 1
Cell volume: 1788.9
Cell parameters: 8.5137; 21.963; 9.8776; 90; 104.406; 90;  

COD ID: 1548056
CIF file Formula: - C27 H19 N -
Comments: Suzuki, Tsuyoshi; Okada, Hiroshi; Nakagawa, Takafumi; Komatsu, Kazuki; Fujimoto, Chikako; Kagi, Hiroyuki; Matsuo, Yutaka A fluorenylidene-acridane that becomes dark in color upon grinding - ground state mechanochromism by conformational change. Chemical science 9(2) (2018) 475-482
Space group: P 1 21 1
Cell volume: 1817.24
Cell parameters: 7.3384; 18.5774; 13.3299; 90; 90.1024; 90;  

COD ID: 1548064
CIF file Formula: - C27 H24 Fe O3 -
Comments: Wang, Yong; Dansette, Patrick M.; Pigeon, Pascal; Top, Siden; McGlinchey, Michael J.; Mansuy, Daniel; Jaouen, Gérard A new generation of ferrociphenols leads to a great diversity of reactive metabolites, and exhibits remarkable antiproliferative properties. Chemical science 9(1) (2018) 70-78
Space group: P 1 21/n 1
Cell volume: 2037.97
Cell parameters: 11.0994; 8.5265; 21.7146; 90; 97.392; 90;  

COD ID: 1548110
CIF file Formula: - C14 H15 N O S -
Comments: Šiaučiulis, Mindaugas; Sapmaz, Selma; Pulis, Alexander P.; Procter, David J. Dual vicinal functionalisation of heterocycles <i>via</i> an interrupted Pummerer coupling/[3,3]-sigmatropic rearrangement cascade. Chemical science 9(3) (2018) 754-759
Space group: P 1 21/c 1
Cell volume: 2570.5
Cell parameters: 17.7719; 8.1203; 19.0328; 90; 110.633; 90;  

COD ID: 1548111
CIF file Formula: - C15 H17 N O S -
Comments: Šiaučiulis, Mindaugas; Sapmaz, Selma; Pulis, Alexander P.; Procter, David J. Dual vicinal functionalisation of heterocycles <i>via</i> an interrupted Pummerer coupling/[3,3]-sigmatropic rearrangement cascade. Chemical science 9(3) (2018) 754-759
Space group: P -1
Cell volume: 678.86
Cell parameters: 8.2973; 9.132; 9.7066; 104.937; 100.291; 100.461;  

COD ID: 1548134
CIF file Formula: - C88 H60 F12 N12 O12 Pd2 S8 -
Comments: Wang, Chen; Tian, Li; Zhu, Wei; Wang, Shiqiang; Gao, Ning; Zhou, Kang; Yin, Xianpeng; Zhang, Wanlin; Zhao, Liang; Li, Guangtao Molecular cage-bridged plasmonic structures with well-defined nanogaps as well as the capability of reversible and selective guest trapping. Chemical science 9(4) (2018) 889-895
Space group: P -1
Cell volume: 3099.8
Cell parameters: 12.284; 15.243; 17.55; 100.641; 102.198; 98.202;  

COD ID: 1548141
CIF file Formula: - C16 H56 Br10 N8 Sn -
Comments: Zhou, Chenkun; Lin, Haoran; Tian, Yu; Yuan, Zhao; Clark, Ronald; Chen, Banghao; van de Burgt, Lambertus J.; Wang, Jamie C.; Zhou, Yan; Hanson, Kenneth; Meisner, Quinton J.; Neu, Jennifer; Besara, Tiglet; Siegrist, Theo; Lambers, Eric; Djurovich, Peter; Ma, Biwu Luminescent zero-dimensional organic metal halide hybrids with near-unity quantum efficiency. Chemical science 9(3) (2018) 586-593
Space group: P -1
Cell volume: 1949.89
Cell parameters: 10.207; 10.6944; 18.5996; 94.043; 102.847; 97.904;  

COD ID: 1548142
CIF file Formula: - C18 H40 Cl5 N2 Sb -
Comments: Zhou, Chenkun; Lin, Haoran; Tian, Yu; Yuan, Zhao; Clark, Ronald; Chen, Banghao; van de Burgt, Lambertus J.; Wang, Jamie C.; Zhou, Yan; Hanson, Kenneth; Meisner, Quinton J.; Neu, Jennifer; Besara, Tiglet; Siegrist, Theo; Lambers, Eric; Djurovich, Peter; Ma, Biwu Luminescent zero-dimensional organic metal halide hybrids with near-unity quantum efficiency. Chemical science 9(3) (2018) 586-593
Space group: P 1 21/n 1
Cell volume: 2518.02
Cell parameters: 8.75618; 27.2439; 10.64297; 90; 97.3536; 90;  

COD ID: 1548143
CIF file Formula: - C16 H56 I10 N8 Sn -
Comments: Zhou, Chenkun; Lin, Haoran; Tian, Yu; Yuan, Zhao; Clark, Ronald; Chen, Banghao; van de Burgt, Lambertus J.; Wang, Jamie C.; Zhou, Yan; Hanson, Kenneth; Meisner, Quinton J.; Neu, Jennifer; Besara, Tiglet; Siegrist, Theo; Lambers, Eric; Djurovich, Peter; Ma, Biwu Luminescent zero-dimensional organic metal halide hybrids with near-unity quantum efficiency. Chemical science 9(3) (2018) 586-593
Space group: P -1
Cell volume: 1124.94
Cell parameters: 10.7464; 10.8924; 11.1796; 64.2658; 80.1825; 72.8331;  

COD ID: 1548144
CIF file Formula: - C247.73 H123.18 N2 -
Comments: Yokoi, Hiroki; Hiroto, Satoru; Sakamaki, Daisuke; Seki, Shu; Shinokubo, Hiroshi Supramolecular assemblies of a nitrogen-embedded buckybowl dimer with C<sub>60</sub>. Chemical science 9(4) (2018) 819-824
Space group: P 1 21/c 1
Cell volume: 15316.5
Cell parameters: 13.1579; 37.8588; 30.9277; 90; 96.192; 90;  

COD ID: 1548145
CIF file Formula: - C160 H94 N2 -
Comments: Yokoi, Hiroki; Hiroto, Satoru; Sakamaki, Daisuke; Seki, Shu; Shinokubo, Hiroshi Supramolecular assemblies of a nitrogen-embedded buckybowl dimer with C<sub>60</sub>. Chemical science 9(4) (2018) 819-824
Space group: P 1 21 1
Cell volume: 11029.6
Cell parameters: 17.0175; 28.9186; 22.7929; 90; 100.484; 90;  

COD ID: 1548236
CIF file Formula: - C39 H53 Cl3 O9 -
Comments: Cheng, Min-Jing; Cao, Jia-Qing; Yang, Xin-Yi; Zhong, Li-Ping; Hu, Li-Jun; Lu, Xi; Hou, Bao-Long; Hu, Ya-Jian; Wang, Ying; You, Xue-Fu; Wang, Lei; Ye, Wen-Cai; Li, Chuang-Chuang Catalytic asymmetric total syntheses of myrtucommuacetalone, myrtucommuacetalone B, and callistrilones A, C, D and E. Chemical science 9(6) (2018) 1488-1495
Space group: P -1
Cell volume: 2029.61
Cell parameters: 12.7541; 13.5008; 13.6961; 94.892; 105.455; 113.791;  

COD ID: 1548237
CIF file Formula: - C39 H54 O9 -
Comments: Cheng, Min-Jing; Cao, Jia-Qing; Yang, Xin-Yi; Zhong, Li-Ping; Hu, Li-Jun; Lu, Xi; Hou, Bao-Long; Hu, Ya-Jian; Wang, Ying; You, Xue-Fu; Wang, Lei; Ye, Wen-Cai; Li, Chuang-Chuang Catalytic asymmetric total syntheses of myrtucommuacetalone, myrtucommuacetalone B, and callistrilones A, C, D and E. Chemical science 9(6) (2018) 1488-1495
Space group: P -1
Cell volume: 1844.5
Cell parameters: 10.6706; 13.8828; 14.1078; 70.567; 84.605; 69.424;  

COD ID: 1548238
CIF file Formula: - C34 H44 O6 -
Comments: Cheng, Min-Jing; Cao, Jia-Qing; Yang, Xin-Yi; Zhong, Li-Ping; Hu, Li-Jun; Lu, Xi; Hou, Bao-Long; Hu, Ya-Jian; Wang, Ying; You, Xue-Fu; Wang, Lei; Ye, Wen-Cai; Li, Chuang-Chuang Catalytic asymmetric total syntheses of myrtucommuacetalone, myrtucommuacetalone B, and callistrilones A, C, D and E. Chemical science 9(6) (2018) 1488-1495
Space group: P 1 21 1
Cell volume: 6227.12
Cell parameters: 11.541; 16.4653; 32.9338; 90; 95.72; 90;  

COD ID: 1548239
CIF file Formula: - C34 H45 O7 -
Comments: Cheng, Min-Jing; Cao, Jia-Qing; Yang, Xin-Yi; Zhong, Li-Ping; Hu, Li-Jun; Lu, Xi; Hou, Bao-Long; Hu, Ya-Jian; Wang, Ying; You, Xue-Fu; Wang, Lei; Ye, Wen-Cai; Li, Chuang-Chuang Catalytic asymmetric total syntheses of myrtucommuacetalone, myrtucommuacetalone B, and callistrilones A, C, D and E. Chemical science 9(6) (2018) 1488-1495
Space group: P 21 21 21
Cell volume: 3100.71
Cell parameters: 6.3828; 14.8993; 32.605; 90; 90; 90;  

COD ID: 1548240
CIF file Formula: - C34 H46 O7 -
Comments: Cheng, Min-Jing; Cao, Jia-Qing; Yang, Xin-Yi; Zhong, Li-Ping; Hu, Li-Jun; Lu, Xi; Hou, Bao-Long; Hu, Ya-Jian; Wang, Ying; You, Xue-Fu; Wang, Lei; Ye, Wen-Cai; Li, Chuang-Chuang Catalytic asymmetric total syntheses of myrtucommuacetalone, myrtucommuacetalone B, and callistrilones A, C, D and E. Chemical science 9(6) (2018) 1488-1495
Space group: P 21 21 21
Cell volume: 3159.56
Cell parameters: 12.4836; 12.5791; 20.1204; 90; 90; 90;  

COD ID: 1548241
CIF file Formula: - C16 H23 N2 O2 -
Comments: Kim, Yechan; Kim, Seoung-Tae; Kang, Dahye; Sohn, Te-Ik; Jang, Eunyoung; Baik, Mu-Hyun; Hong, Sungwoo Stereoselective construction of sterically hindered oxaspirocycles <i>via</i> chiral bidentate directing group-mediated C(sp<sup>3</sup>)-O bond formation. Chemical science 9(6) (2018) 1473-1480
Space group: P 21 21 21
Cell volume: 1532.7
Cell parameters: 6.8237; 9.6779; 23.209; 90; 90; 90;  

COD ID: 1548292
CIF file Formula: - C164.05 H143.07 Cu2 F36 N29.98 O2.48 P6 Ru2 -
Comments: Hayes, Dugan; Kohler, Lars; Hadt, Ryan G.; Zhang, Xiaoyi; Liu, Cunming; Mulfort, Karen L.; Chen, Lin X. Excited state electron and energy relays in supramolecular dinuclear complexes revealed by ultrafast optical and X-ray transient absorption spectroscopy. Chemical science 9(4) (2018) 860-875
Space group: P -1
Cell volume: 4209
Cell parameters: 12.383; 18.49; 19.983; 69.381; 79.742; 88.826;  

COD ID: 1548293
CIF file Formula: - C53 H45 B3 F20 N4 O2 -
Comments: Zheng, Junhao; Li, Zhen Hua; Wang, Huadong Addition of dihydrogen to a borylborenium center. Chemical science 9(6) (2018) 1433-1438
Space group: P 1 21/c 1
Cell volume: 5304
Cell parameters: 8.281; 27.653; 23.173; 90; 91.817; 90;  

COD ID: 1548345
CIF file Formula: - C39 H38 N2 O3 S -
Comments: Yamamoto, Y.; Murayama, T.; Jiang, J.; Yasui, T.; Shibuya, M. The vinylogous Catellani reaction: a combined computational and experimental study. Chemical science 9(5) (2018) 1191-1199
Space group: P 1 21/c 1
Cell volume: 3101.5
Cell parameters: 16.5942; 8.7199; 21.4742; 90; 93.516; 90;  

COD ID: 1548346
CIF file Formula: - C204 H158 B8 F32 N40 O7 Zn4 -
Comments: Yang, Linlin; Jing, Xu; An, Bowen; He, Cheng; Yang, Yang; Duan, Chunying Binding of anions in triply interlocked coordination catenanes and dynamic allostery for dehalogenation reactions. Chemical science 9(4) (2018) 1050-1057
Space group: C 1 2/c 1
Cell volume: 79279
Cell parameters: 47.6161; 31.7486; 56.289; 90; 111.305; 90;  

COD ID: 1548347
CIF file Formula: - C206 H163 B3.5 F14 I4.5 N41 O8 Zn4 -
Comments: Yang, Linlin; Jing, Xu; An, Bowen; He, Cheng; Yang, Yang; Duan, Chunying Binding of anions in triply interlocked coordination catenanes and dynamic allostery for dehalogenation reactions. Chemical science 9(4) (2018) 1050-1057
Space group: C 1 2/c 1
Cell volume: 78535
Cell parameters: 47.061; 32.0425; 55.568; 90; 110.406; 90;  

COD ID: 1548380
CIF file Formula: - C58 H48 Ag5 F6 N17 O6 S2 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: C m c m
Cell volume: 6808
Cell parameters: 12.842; 21.083; 25.145; 90; 90; 90;  

COD ID: 1548381
CIF file Formula: - C59 H55 Ag5 F6 N17 O6 S2 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: P -1
Cell volume: 4125.97
Cell parameters: 14.3867; 15.4794; 18.9913; 101.197; 93.2; 94.368;  

COD ID: 1548382
CIF file Formula: - C64 H58 Ag4 F9 N17 O10 S2 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: C 1 2/c 1
Cell volume: 7152.2
Cell parameters: 32.1129; 12.1233; 24.0913; 90; 130.309; 90;  

COD ID: 1548383
CIF file Formula: - C73.5 H68 Ag5 F9 N18 O12.5 S3 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: P -1
Cell volume: 4310.55
Cell parameters: 14.8347; 15.7643; 18.6915; 96.459; 93.928; 95.369;  

COD ID: 1548384
CIF file Formula: - C63 H55 Ag5 Cl4.5 F12 N17 O13.25 S4 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: P -1
Cell volume: 4302
Cell parameters: 13.189; 13.561; 28.427; 103.51; 90.23; 118.57;  

COD ID: 1548385
CIF file Formula: - C67 H57 Ag5 F9 N17 O9 S3 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: P 1 21/c 1
Cell volume: 8240.3
Cell parameters: 14.3943; 31.0527; 22.6971; 90; 125.685; 90;  

COD ID: 1548386
CIF file Formula: - C58 H53 Ag5 F6 N17 O6 S2 -
Comments: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science 9(6) (2018) 1481-1487
Space group: P 1
Cell volume: 3403.7
Cell parameters: 12.278; 25.145; 12.408; 90; 117.31; 90;  

COD ID: 1548387
CIF file Formula: - C92 H118 As4 Co3 N16 O24 -
Comments: Srinivasan, Anandi; Cortijo, Miguel; Bulicanu, Vladimir; Naim, Ahmad; Clérac, Rodolphe; Sainctavit, Philippe; Rogalev, Andrei; Wilhelm, Fabrice; Rosa, Patrick; Hillard, Elizabeth A. Enantiomeric resolution and X-ray optical activity of a tricobalt extended metal atom chain. Chemical science 9(5) (2018) 1136-1143
Space group: P 4 21 2
Cell volume: 7199.8
Cell parameters: 20.6668; 20.6668; 16.8568; 90; 90; 90;  

COD ID: 1548388
CIF file Formula: - C56 H48 As2 Co3 N16 O12 -
Comments: Srinivasan, Anandi; Cortijo, Miguel; Bulicanu, Vladimir; Naim, Ahmad; Clérac, Rodolphe; Sainctavit, Philippe; Rogalev, Andrei; Wilhelm, Fabrice; Rosa, Patrick; Hillard, Elizabeth A. Enantiomeric resolution and X-ray optical activity of a tricobalt extended metal atom chain. Chemical science 9(5) (2018) 1136-1143
Space group: C 1 2/c 1
Cell volume: 5776
Cell parameters: 17.794; 19.121; 19.042; 90; 116.941; 90;  

COD ID: 1548389
CIF file Formula: - C50 H51 Co3 F12 N15 O P2 -
Comments: Srinivasan, Anandi; Cortijo, Miguel; Bulicanu, Vladimir; Naim, Ahmad; Clérac, Rodolphe; Sainctavit, Philippe; Rogalev, Andrei; Wilhelm, Fabrice; Rosa, Patrick; Hillard, Elizabeth A. Enantiomeric resolution and X-ray optical activity of a tricobalt extended metal atom chain. Chemical science 9(5) (2018) 1136-1143
Space group: P 1 21 1
Cell volume: 2845.5
Cell parameters: 11.7226; 21.8073; 12.0149; 90; 112.115; 90;  

COD ID: 1548390
CIF file Formula: - C92 H118 As4 Co3 N16 O24 -
Comments: Srinivasan, Anandi; Cortijo, Miguel; Bulicanu, Vladimir; Naim, Ahmad; Clérac, Rodolphe; Sainctavit, Philippe; Rogalev, Andrei; Wilhelm, Fabrice; Rosa, Patrick; Hillard, Elizabeth A. Enantiomeric resolution and X-ray optical activity of a tricobalt extended metal atom chain. Chemical science 9(5) (2018) 1136-1143
Space group: P 4 21 2
Cell volume: 7200.8
Cell parameters: 20.6481; 20.6481; 16.8896; 90; 90; 90;  

COD ID: 1548396
CIF file Formula: - C28 H30 N4 Ni2 O15 S -
Comments: Feng, Rui; Jia, Yan-Yuan; Li, Zhao-Yang; Chang, Ze; Bu, Xian-He Enhancing the stability and porosity of penetrated metal-organic frameworks through the insertion of coordination sites. Chemical science 9(4) (2018) 950-955
Space group: I a -3
Cell volume: 62847.3
Cell parameters: 39.7584; 39.7584; 39.7584; 90; 90; 90;  

COD ID: 1548397
CIF file Formula: - C36 H20 Co2 N6 O15 -
Comments: Feng, Rui; Jia, Yan-Yuan; Li, Zhao-Yang; Chang, Ze; Bu, Xian-He Enhancing the stability and porosity of penetrated metal-organic frameworks through the insertion of coordination sites. Chemical science 9(4) (2018) 950-955
Space group: F d -3 m :2
Cell volume: 101836
Cell parameters: 46.6983; 46.6983; 46.6983; 90; 90; 90;  

COD ID: 1548407
CIF file Formula: - C44 H44 B4 Cl6 Dy2 N24 O4 -
Comments: Zhang, Peng; Perfetti, Mauro; Kern, Michal; Hallmen, Philipp P.; Ungur, Liviu; Lenz, Samuel; Ringenberg, Mark R.; Frey, Wolfgang; Stoll, Hermann; Rauhut, Guntram; van Slageren, Joris Exchange coupling and single molecule magnetism in redox-active tetraoxolene-bridged dilanthanide complexes. Chemical science 9(5) (2018) 1221-1230
Space group: P 1 21/n 1
Cell volume: 2954.8
Cell parameters: 13.932; 15.014; 14.827; 90; 107.69; 90;  

COD ID: 1548408
CIF file Formula: - C44 H44 B4 Cl6 N24 O4 Y2 -
Comments: Zhang, Peng; Perfetti, Mauro; Kern, Michal; Hallmen, Philipp P.; Ungur, Liviu; Lenz, Samuel; Ringenberg, Mark R.; Frey, Wolfgang; Stoll, Hermann; Rauhut, Guntram; van Slageren, Joris Exchange coupling and single molecule magnetism in redox-active tetraoxolene-bridged dilanthanide complexes. Chemical science 9(5) (2018) 1221-1230
Space group: P 1 21/n 1
Cell volume: 2957.7
Cell parameters: 13.937; 15.046; 14.786; 90; 107.46; 90;  

COD ID: 1548409
CIF file Formula: - C44 H44 B4 Cl6 Gd2 N24 O4 -
Comments: Zhang, Peng; Perfetti, Mauro; Kern, Michal; Hallmen, Philipp P.; Ungur, Liviu; Lenz, Samuel; Ringenberg, Mark R.; Frey, Wolfgang; Stoll, Hermann; Rauhut, Guntram; van Slageren, Joris Exchange coupling and single molecule magnetism in redox-active tetraoxolene-bridged dilanthanide complexes. Chemical science 9(5) (2018) 1221-1230
Space group: P 1 21/n 1
Cell volume: 3071.3
Cell parameters: 14.15; 15.225; 14.969; 90; 107.75; 90;  

COD ID: 1548410
CIF file Formula: - C44 H44 B4 Cl6 N24 O4 Tb2 -
Comments: Zhang, Peng; Perfetti, Mauro; Kern, Michal; Hallmen, Philipp P.; Ungur, Liviu; Lenz, Samuel; Ringenberg, Mark R.; Frey, Wolfgang; Stoll, Hermann; Rauhut, Guntram; van Slageren, Joris Exchange coupling and single molecule magnetism in redox-active tetraoxolene-bridged dilanthanide complexes. Chemical science 9(5) (2018) 1221-1230
Space group: P 1 21/n 1
Cell volume: 2984
Cell parameters: 14.003; 15.079; 14.825; 90; 107.59; 90;  

COD ID: 1548427
CIF file Formula: - C38 H48 B2 N2 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/a 1
Cell volume: 6889.6
Cell parameters: 17.6; 19.466; 20.232; 90; 96.305; 90;  

COD ID: 1548428
CIF file Formula: - C48 H56 B2 F3 N3 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/c 1
Cell volume: 4367
Cell parameters: 11.335; 10.991; 35.202; 90; 95.263; 90;  

COD ID: 1548429
CIF file Formula: - C29 H39 B2 N O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/n 1
Cell volume: 2712.9
Cell parameters: 8.723; 23.773; 13.264; 90; 99.499; 90;  

COD ID: 1548430
CIF file Formula: - C28 H38 B2 N2 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/n 1
Cell volume: 2592.7
Cell parameters: 10.134; 18.98; 13.58; 90; 96.976; 90;  

COD ID: 1548431
CIF file Formula: - C40 H50 B2 N2 O4 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P -1
Cell volume: 3710.6
Cell parameters: 8.4242; 15.698; 28.081; 89.956; 87.717; 89.896;  

COD ID: 1548432
CIF file Formula: - C49 H59 B2 N3 O4 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P -1
Cell volume: 2228.7
Cell parameters: 10.951; 14.21; 16.118; 104.201; 92.6541; 111.94;  

COD ID: 1548433
CIF file Formula: - C54 H69 B2 N3 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/c 1
Cell volume: 4893.7
Cell parameters: 10.6242; 20.635; 22.708; 90; 100.578; 90;  

COD ID: 1548434
CIF file Formula: - C37 H47 B2 N3 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/n 1
Cell volume: 3259.5
Cell parameters: 10.981; 10.43; 28.55; 90; 94.578; 90;  

COD ID: 1548435
CIF file Formula: - C37 H47 B2 N3 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/a 1
Cell volume: 3423
Cell parameters: 15.319; 13.7912; 17.481; 90; 112.051; 90;  

COD ID: 1548436
CIF file Formula: - C38 H48 B2 N2 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/n 1
Cell volume: 3393
Cell parameters: 8.565; 33.036; 11.991; 90; 90.444; 90;  

COD ID: 1548437
CIF file Formula: - C48 H56 B2 F3 N3 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/n 1
Cell volume: 4302
Cell parameters: 14.692; 11.21; 27.115; 90; 105.567; 90;  

COD ID: 1548438
CIF file Formula: - C45 H62 B2 N2 O4 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P -1
Cell volume: 2046.2
Cell parameters: 11.4491; 12.8149; 15.929; 74.652; 86.76; 65.452;  

COD ID: 1548439
CIF file Formula: - C49 H59 B2 N3 O4 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P -1
Cell volume: 2187.4
Cell parameters: 8.034; 10.856; 26.173; 97.069; 97.132; 102.212;  

COD ID: 1548440
CIF file Formula: - C53 H63 B2 N3 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P -1
Cell volume: 2289.8
Cell parameters: 11.821; 12.93; 16.755; 101.05; 95.8819; 111.862;  

COD ID: 1548441
CIF file Formula: - C39 H37 B2 F3 N2 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 21 21 21
Cell volume: 11280
Cell parameters: 16.004; 21.403; 32.93; 90; 90; 90;  

COD ID: 1548442
CIF file Formula: - C39 H47 B2 F3 N2 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/c 1
Cell volume: 3707.8
Cell parameters: 14.252; 17.527; 14.877; 90; 93.855; 90;  

COD ID: 1548443
CIF file Formula: - C89 H112 B4 N4 O4 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P -1
Cell volume: 1973.3
Cell parameters: 9.894; 12.714; 16.323; 101.384; 91.511; 100.757;  

COD ID: 1548444
CIF file Formula: - C38 H47 B2 Cl N2 O2 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P 1 21/c 1
Cell volume: 3481
Cell parameters: 10.777; 8.468; 38.298; 90; 95.088; 90;  

COD ID: 1548445
CIF file Formula: - C45 H64 B2 N2 O3 -
Comments: Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science 9(5) (2018) 1301-1310
Space group: P n a 21
Cell volume: 4096.2
Cell parameters: 19.208; 13.253; 16.091; 90; 90; 90;  

COD ID: 1548455
CIF file Formula: - C22 H25 N O4 -
Comments: Carter, Nicholas; Li, Xiabing; Reavey, Lewis; Meijer, Anthony J. H. M.; Coldham, Iain Synthesis and kinetic resolution of substituted tetrahydroquinolines by lithiation then electrophilic quench. Chemical science 9(5) (2018) 1352-1357
Space group: P 21 21 21
Cell volume: 1991.31
Cell parameters: 10.3192; 11.0867; 17.4057; 90; 90; 90;  

COD ID: 1548456
CIF file Formula: - C20 H23 N O2 -
Comments: Carter, Nicholas; Li, Xiabing; Reavey, Lewis; Meijer, Anthony J. H. M.; Coldham, Iain Synthesis and kinetic resolution of substituted tetrahydroquinolines by lithiation then electrophilic quench. Chemical science 9(5) (2018) 1352-1357
Space group: P 21 21 21
Cell volume: 1731.24
Cell parameters: 6.1094; 14.2823; 19.8409; 90; 90; 90;  

COD ID: 1548457
CIF file Formula: - C27 H21 N O2 -
Comments: Carter, Nicholas; Li, Xiabing; Reavey, Lewis; Meijer, Anthony J. H. M.; Coldham, Iain Synthesis and kinetic resolution of substituted tetrahydroquinolines by lithiation then electrophilic quench. Chemical science 9(5) (2018) 1352-1357
Space group: P -1
Cell volume: 996.24
Cell parameters: 7.9717; 9.2791; 14.2492; 95.3798; 105.336; 98.2795;  

COD ID: 1548458
CIF file Formula: - C23 H27 N O4 -
Comments: Carter, Nicholas; Li, Xiabing; Reavey, Lewis; Meijer, Anthony J. H. M.; Coldham, Iain Synthesis and kinetic resolution of substituted tetrahydroquinolines by lithiation then electrophilic quench. Chemical science 9(5) (2018) 1352-1357
Space group: P 1 21 1
Cell volume: 1011.91
Cell parameters: 9.495; 8.8357; 12.0617; 90; 90.258; 90;  

COD ID: 1548459
CIF file Formula: - C106 H66 B4 F40 O2 P2 -
Comments: Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science 9(6) (2018) 1544-1550
Space group: P n a 21
Cell volume: 10639.8
Cell parameters: 23.2043; 30.9754; 14.803; 90; 90; 90;  

COD ID: 1548460
CIF file Formula: - C88 H62 B4 F40 O2 P2 -
Comments: Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science 9(6) (2018) 1544-1550
Space group: P -1
Cell volume: 4238.6
Cell parameters: 11.163; 16.2067; 24.8378; 76.432; 87.505; 76.034;  

COD ID: 1548461
CIF file Formula: - C31 H32 B F10 P -
Comments: Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science 9(6) (2018) 1544-1550
Space group: P 1 21/n 1
Cell volume: 2919.2
Cell parameters: 17.6792; 8.532; 19.5972; 90; 99.052; 90;  

COD ID: 1548462
CIF file Formula: - C40 H34 B F10 P -
Comments: Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science 9(6) (2018) 1544-1550
Space group: P 1 21/n 1
Cell volume: 4165.7
Cell parameters: 13.2212; 16.1944; 19.5088; 90; 94.223; 90;  

COD ID: 1548463
CIF file Formula: - C34 H38 B F10 P -
Comments: Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science 9(6) (2018) 1544-1550
Space group: P -1
Cell volume: 3213.5
Cell parameters: 13.2091; 14.4202; 17.4143; 102.465; 96.491; 91.561;  

COD ID: 1548464
CIF file Formula: - C141 H111 B6 F60 O3 P3 -
Comments: Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science 9(6) (2018) 1544-1550
Space group: P 1 21/n 1
Cell volume: 16443.8
Cell parameters: 12.2916; 38.2278; 34.996; 90; 90.268; 90;  

COD ID: 1548465
CIF file Formula: - C144 H72 Mn3 N12 O70 Zr12 -
Comments: Gallagher, Audrey T.; Lee, Jung Yoon; Kathiresan, Venkatesan; Anderson, John S.; Hoffman, Brian M.; Harris, T. David A structurally-characterized peroxomanganese(iv) porphyrin from reversible O<sub>2</sub> binding within a metal-organic framework. Chemical science 9(6) (2018) 1596-1603
Space group: I m -3 m
Cell volume: 56630
Cell parameters: 38.4015; 38.4015; 38.4015; 90; 90; 90;  

COD ID: 1548466
CIF file Formula: - C144 H72 Mn3 N12 O52 Zr12 -
Comments: Gallagher, Audrey T.; Lee, Jung Yoon; Kathiresan, Venkatesan; Anderson, John S.; Hoffman, Brian M.; Harris, T. David A structurally-characterized peroxomanganese(iv) porphyrin from reversible O<sub>2</sub> binding within a metal-organic framework. Chemical science 9(6) (2018) 1596-1603
Space group: I m -3 m
Cell volume: 57835
Cell parameters: 38.672; 38.672; 38.672; 90; 90; 90;  

COD ID: 1548488
CIF file Formula: - C14 H30 Cl4 N4 Ni O4 -
Comments: Craig, Gavin A.; Sarkar, Arup; Woodall, Christopher H.; Hay, Moya A.; Marriott, Katie E. R.; Kamenev, Konstantin V.; Moggach, Stephen A.; Brechin, Euan K.; Parsons, Simon; Rajaraman, Gopalan; Murrie, Mark Probing the origin of the giant magnetic anisotropy in trigonal bipyramidal Ni(ii) under high pressure. Chemical science 9(6) (2018) 1551-1559
Space group: P c a 21
Cell volume: 2145
Cell parameters: 12.5175; 13.082; 13.0989; 90; 90; 90;  

COD ID: 1548489
CIF file Formula: - C14 H30 Cl4 N4 Ni O4 -
Comments: Craig, Gavin A.; Sarkar, Arup; Woodall, Christopher H.; Hay, Moya A.; Marriott, Katie E. R.; Kamenev, Konstantin V.; Moggach, Stephen A.; Brechin, Euan K.; Parsons, Simon; Rajaraman, Gopalan; Murrie, Mark Probing the origin of the giant magnetic anisotropy in trigonal bipyramidal Ni(ii) under high pressure. Chemical science 9(6) (2018) 1551-1559
Space group: P c a 21
Cell volume: 1937.2
Cell parameters: 11.9968; 12.5527; 12.8642; 90; 90; 90;  

COD ID: 1548490
CIF file Formula: - C14 H30 Cl4 N4 Ni O4 -
Comments: Craig, Gavin A.; Sarkar, Arup; Woodall, Christopher H.; Hay, Moya A.; Marriott, Katie E. R.; Kamenev, Konstantin V.; Moggach, Stephen A.; Brechin, Euan K.; Parsons, Simon; Rajaraman, Gopalan; Murrie, Mark Probing the origin of the giant magnetic anisotropy in trigonal bipyramidal Ni(ii) under high pressure. Chemical science 9(6) (2018) 1551-1559
Space group: P c a 21
Cell volume: 1936.4
Cell parameters: 11.9924; 12.5546; 12.8611; 90; 90; 90;  

COD ID: 1548491
CIF file Formula: - C14 H30 Cl4 N4 Ni O4 -
Comments: Craig, Gavin A.; Sarkar, Arup; Woodall, Christopher H.; Hay, Moya A.; Marriott, Katie E. R.; Kamenev, Konstantin V.; Moggach, Stephen A.; Brechin, Euan K.; Parsons, Simon; Rajaraman, Gopalan; Murrie, Mark Probing the origin of the giant magnetic anisotropy in trigonal bipyramidal Ni(ii) under high pressure. Chemical science 9(6) (2018) 1551-1559
Space group: P c a 21
Cell volume: 2062.61
Cell parameters: 12.3181; 12.8429; 13.038; 90; 90; 90;  

COD ID: 1548492
CIF file Formula: - C14 H30 Cl4 N4 Ni O4 -
Comments: Craig, Gavin A.; Sarkar, Arup; Woodall, Christopher H.; Hay, Moya A.; Marriott, Katie E. R.; Kamenev, Konstantin V.; Moggach, Stephen A.; Brechin, Euan K.; Parsons, Simon; Rajaraman, Gopalan; Murrie, Mark Probing the origin of the giant magnetic anisotropy in trigonal bipyramidal Ni(ii) under high pressure. Chemical science 9(6) (2018) 1551-1559
Space group: P c a 21
Cell volume: 2018.2
Cell parameters: 12.2089; 12.7469; 12.9686; 90; 90; 90;  

COD ID: 1548493
CIF file Formula: - C3 H4 Br Cl0 O2 Pb -
Comments: Peng, Chengdong; Zhuang, Zewen; Yang, Huimin; Zhang, Guiyang; Fei, Honghan Ultrastable, cationic three-dimensional lead bromide frameworks that intrinsically emit broadband white-light. Chemical science 9(6) (2018) 1627-1633
Space group: P 41 21 2
Cell volume: 1166.5
Cell parameters: 9.0035; 9.0035; 14.39; 90; 90; 90;  

COD ID: 1548494
CIF file Formula: - C4 H4 Br4 O4 Pb3 -
Comments: Peng, Chengdong; Zhuang, Zewen; Yang, Huimin; Zhang, Guiyang; Fei, Honghan Ultrastable, cationic three-dimensional lead bromide frameworks that intrinsically emit broadband white-light. Chemical science 9(6) (2018) 1627-1633
Space group: P b c n
Cell volume: 1298.56
Cell parameters: 8.2193; 14.718; 10.7344; 90; 90; 90;  

COD ID: 1548495
CIF file Formula: - C3 H4 Br O2 Pb -
Comments: Peng, Chengdong; Zhuang, Zewen; Yang, Huimin; Zhang, Guiyang; Fei, Honghan Ultrastable, cationic three-dimensional lead bromide frameworks that intrinsically emit broadband white-light. Chemical science 9(6) (2018) 1627-1633
Space group: P 41 21 2
Cell volume: 1160.5
Cell parameters: 8.9917; 8.9917; 14.354; 90; 90; 90;  

COD ID: 1548531
CIF file Formula: - C19 H46 Cl4 Eu N8 O Zn -
Comments: Jenks, Tyler C.; Bailey, Matthew D.; Hovey, Jessica L.; Fernando, Shanilke; Basnayake, Gihan; Cross, Michael E.; Li, Wen; Allen, Matthew J. First use of a divalent lanthanide for visible-light-promoted photoredox catalysis. Chemical science 9(5) (2018) 1273-1278
Space group: P b c a
Cell volume: 5917.1
Cell parameters: 16.9858; 18.4496; 18.8816; 90; 90; 90;  

COD ID: 1548532
CIF file Formula: - C15 H12 N2 -
Comments: Joost, Maximilian; Transue, Wesley J.; Cummins, Christopher C. Diazomethane umpolung atop anthracene: an electrophilic methylene transfer reagent. Chemical science 9(6) (2018) 1540-1543
Space group: C 1 2/c 1
Cell volume: 2193.5
Cell parameters: 22.851; 5.7145; 16.97; 90; 98.174; 90;  

COD ID: 1548533
CIF file Formula: - C27 H41 O2 W0.5 -
Comments: Joost, Maximilian; Transue, Wesley J.; Cummins, Christopher C. Diazomethane umpolung atop anthracene: an electrophilic methylene transfer reagent. Chemical science 9(6) (2018) 1540-1543
Space group: P 21 21 2
Cell volume: 2580.3
Cell parameters: 15.0937; 17.6924; 9.6626; 90; 90; 90;  

COD ID: 1548534
CIF file Formula: - C68 H87 O4 P W -
Comments: Joost, Maximilian; Transue, Wesley J.; Cummins, Christopher C. Diazomethane umpolung atop anthracene: an electrophilic methylene transfer reagent. Chemical science 9(6) (2018) 1540-1543
Space group: P -1
Cell volume: 3021.7
Cell parameters: 13.4644; 13.7709; 18.7517; 106.468; 110.976; 96.554;  

COD ID: 1548543
CIF file Formula: - C14 H18 N2 O4 -
Comments: Zeng, Qingying; Mukherjee, Arijit; Müller, Peter; Rogers, Robin D.; Myerson, Allan S. Exploring the role of ionic liquids to tune the polymorphic outcome of organic compounds. Chemical science 9(6) (2018) 1510-1520
Space group: P -1
Cell volume: 353
Cell parameters: 6.746; 7.246; 7.434; 77.801; 83.65; 88.409;  

COD ID: 1548565
CIF file Formula: - C37 H51.88 Br4 Co N3 O Zn -
Comments: Werth, Jacob; Uyeda, Christopher Regioselective Simmons-Smith-type cyclopropanations of polyalkenes enabled by transition metal catalysis. Chemical science 9(6) (2018) 1604-1609
Space group: P 21 21 21
Cell volume: 4120.4
Cell parameters: 12.6608; 17.559; 18.5345; 90; 90; 90;  

COD ID: 1548566
CIF file Formula: - C19 H14 B F6 N O -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 873.89
Cell parameters: 9.0343; 10.2063; 11.0348; 66.3381; 70.1856; 78.1262;  

COD ID: 1548567
CIF file Formula: - C27 H26 B Cl2 N O2 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P 1 21/n 1
Cell volume: 2387.44
Cell parameters: 14.1158; 8.9604; 18.8756; 90; 90.0788; 90;  

COD ID: 1548568
CIF file Formula: - C29 H24 B F6 N O2 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 2584.47
Cell parameters: 10.014; 11.7859; 23.0748; 103.818; 98.0649; 96.9376;  

COD ID: 1548569
CIF file Formula: - C18 H6 B3 F9 O3 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: C 1 2/c 1
Cell volume: 1830
Cell parameters: 12.8358; 12.6583; 12.8851; 90; 119.06; 90;  

COD ID: 1548570
CIF file Formula: - C28 H22 B2 I2 O5 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 1336.36
Cell parameters: 10.635; 11.4814; 12.2457; 83.1389; 87.0947; 64.1817;  

COD ID: 1548571
CIF file Formula: - C29 H28 B Cl2 N O2 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 1314.22
Cell parameters: 9.2006; 11.4729; 13.1121; 101.57; 99.773; 98.085;  

COD ID: 1548572
CIF file Formula: - C26 H18 B F6 N O2 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P 1 21/n 1
Cell volume: 2259.56
Cell parameters: 10.1019; 11.7656; 19.567; 90; 103.69; 90;  

COD ID: 1548573
CIF file Formula: - C14.5 H13 B Cl1.5 D0.5 F6 N2 O -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P 1 c 1
Cell volume: 1695.95
Cell parameters: 11.75; 11.0269; 13.1973; 90; 97.3307; 90;  

COD ID: 1548574
CIF file Formula: - C25 H15 B3 F9 N O3 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 1232.74
Cell parameters: 10.372; 11.1795; 12.3123; 106.545; 111.492; 96.8493;  

COD ID: 1548575
CIF file Formula: - C18 H6 B3 F9 O3 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P b c n
Cell volume: 1787.1
Cell parameters: 17.083; 13.093; 7.99; 90; 90; 90;  

COD ID: 1548576
CIF file Formula: - C46 H51 B3 N4 O3 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P 1 21/c 1
Cell volume: 4087.9
Cell parameters: 21.212; 11.2705; 18.8494; 90; 114.886; 90;  

COD ID: 1548577
CIF file Formula: - C28 H22 B2 Cl2 O5 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 1262.39
Cell parameters: 10.4296; 11.147; 11.7996; 84.748; 87.958; 67.5356;  

COD ID: 1548578
CIF file Formula: - C32 H33 B3 N2 O3 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: P -1
Cell volume: 2900.27
Cell parameters: 11.2396; 15.2054; 17.9361; 89.7333; 72.0196; 84.3291;  

COD ID: 1548579
CIF file Formula: - C18 H6 B3 F9 O3 -
Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072
Space group: C 1 2/c 1
Cell volume: 1808.74
Cell parameters: 12.8086; 12.6262; 12.8625; 90; 119.598; 90;  

COD ID: 1548590
CIF file Formula: - C39 H42 B N O -
Comments: Shi, Yong-Gang; Wang, Jun-Wei; Li, Haijun; Hu, Guo-Fei; Li, Xue; Mellerup, Soren K.; Wang, Nan; Peng, Tai; Wang, Suning A simple multi-responsive system based on aldehyde functionalized amino-boranes. Chemical science 9(7) (2018) 1902-1911
Space group: C 1 2/c 1
Cell volume: 6222
Cell parameters: 38.4003; 9.7146; 18.3058; 90; 114.338; 90;  

COD ID: 1548591
CIF file Formula: - C25 H27 B O -
Comments: Shi, Yong-Gang; Wang, Jun-Wei; Li, Haijun; Hu, Guo-Fei; Li, Xue; Mellerup, Soren K.; Wang, Nan; Peng, Tai; Wang, Suning A simple multi-responsive system based on aldehyde functionalized amino-boranes. Chemical science 9(7) (2018) 1902-1911
Space group: P -1
Cell volume: 1075.07
Cell parameters: 8.488; 10.8609; 12.4693; 97.707; 98.593; 105.796;  

COD ID: 1548592
CIF file Formula: - C27 H32 B N O -
Comments: Shi, Yong-Gang; Wang, Jun-Wei; Li, Haijun; Hu, Guo-Fei; Li, Xue; Mellerup, Soren K.; Wang, Nan; Peng, Tai; Wang, Suning A simple multi-responsive system based on aldehyde functionalized amino-boranes. Chemical science 9(7) (2018) 1902-1911
Space group: P 1 21/n 1
Cell volume: 2285.7
Cell parameters: 12.3452; 9.0371; 20.4924; 90; 91.199; 90;  

COD ID: 1548593
CIF file Formula: - C28 H34 B N O -
Comments: Shi, Yong-Gang; Wang, Jun-Wei; Li, Haijun; Hu, Guo-Fei; Li, Xue; Mellerup, Soren K.; Wang, Nan; Peng, Tai; Wang, Suning A simple multi-responsive system based on aldehyde functionalized amino-boranes. Chemical science 9(7) (2018) 1902-1911
Space group: P 1 21/c 1
Cell volume: 2722.9
Cell parameters: 10.146; 16.684; 16.55; 90; 103.602; 90;  

COD ID: 1548594
CIF file Formula: - C23 H37 B N2 Se2 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P 1 21/c 1
Cell volume: 4832
Cell parameters: 17.551; 15.552; 17.729; 90; 93.183; 90;  

COD ID: 1548595
CIF file Formula: - C49 H70 B2 N4 S -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P 1 21/c 1
Cell volume: 4616.3
Cell parameters: 18.966; 13.037; 18.816; 90; 97.143; 90;  

COD ID: 1548596
CIF file Formula: - C50 H78 B2 N4 O2 Se3 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: C 1 2/c 1
Cell volume: 4926.1
Cell parameters: 16.059; 17.563; 17.928; 90; 103.042; 90;  

COD ID: 1548597
CIF file Formula: - C50 H78 B2 N4 O2 S3 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: C 1 2/c 1
Cell volume: 4883.5
Cell parameters: 15.945; 17.53; 17.924; 90; 102.905; 90;  

COD ID: 1548598
CIF file Formula: - C37 H49 B N2 O Se2 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P 1 21/n 1
Cell volume: 3457
Cell parameters: 10.784; 16.852; 19.026; 90; 91.03; 90;  

COD ID: 1548599
CIF file Formula: - C48 H68 B2 N4 S2 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P -1
Cell volume: 1095.24
Cell parameters: 8.8508; 8.8654; 14.6186; 75.639; 86.11; 80.401;  

COD ID: 1548600
CIF file Formula: - C42 H62 B2 N4 Se -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P b c a
Cell volume: 8488.8
Cell parameters: 17.8352; 16.7797; 28.365; 90; 90; 90;  

COD ID: 1548601
CIF file Formula: - C54 H86 B2 N4 O3 S4 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P b c a
Cell volume: 11049
Cell parameters: 16.39; 17.61; 38.28; 90; 90; 90;  

COD ID: 1548602
CIF file Formula: - C37 H49 B N2 O S2 -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P 1 21/n 1
Cell volume: 3391
Cell parameters: 10.672; 16.818; 18.902; 90; 91.75; 90;  

COD ID: 1548603
CIF file Formula: - C24 H34 B N2 Se -
Comments: Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian D.; Kupfer, Thomas; Böhnke, Julian; Braunschweig, Holger Closely related yet different: a borylene and its dimer are non-interconvertible but connected through reactivity. Chemical science 9(8) (2018) 2252-2260
Space group: P -1
Cell volume: 1093
Cell parameters: 8.8289; 8.8405; 14.667; 85.939; 75.916; 79.987;  

COD ID: 1548613
CIF file Formula: - C17 H14 Br N O -
Comments: Luo, Hongwen; Yang, Zheng; Lin, Weilong; Zheng, Yangguangyan; Ma, Shengming A catalytic highly enantioselective allene approach to oxazolines. Chemical science 9(7) (2018) 1964-1969
Space group: P 21 21 21
Cell volume: 1430.7
Cell parameters: 6.1624; 7.7041; 30.136; 90; 90; 90;  

COD ID: 1548614
CIF file Formula: - C33 H37.5 B I2 N O -
Comments: Qi, Yanyu; Xu, Wenjun; Kang, Rui; Ding, Nannan; Wang, Yelei; He, Gang; Fang, Yu Discrimination of saturated alkanes and relevant volatile compounds <i>via</i> the utilization of a conceptual fluorescent sensor array based on organoboron-containing polymers. Chemical science 9(7) (2018) 1892-1901
Space group: P 1 21/n 1
Cell volume: 6401
Cell parameters: 13.751; 16.557; 28.155; 90; 93.121; 90;  

COD ID: 1548615
CIF file Formula: - C35.5 H61 Li Ni O8.25 -
Comments: Iwasaki, Takanori; Fukuoka, Asuka; Yokoyama, Wataru; Min, Xin; Hisaki, Ichiro; Yang, Tao; Ehara, Masahiro; Kuniyasu, Hitoshi; Kambe, Nobuaki Nickel-catalyzed coupling reaction of alkyl halides with aryl Grignard reagents in the presence of 1,3-butadiene: mechanistic studies of four-component coupling and competing cross-coupling reactions. Chemical science 9(8) (2018) 2195-2211
Space group: P -1
Cell volume: 7273.2
Cell parameters: 11.4664; 24.2697; 28.3765; 67.455; 88.576; 85.754;  

COD ID: 1548634
CIF file Formula: - C19 H27 N O S -
Comments: Shen, Xianwang; Gong, Honghong; Zhou, Yang; Zhao, Yucheng; Lin, Jun; Chen, Mao Unsymmetrical difunctionalization of cyclooctadiene under continuous flow conditions: expanding the scope of ring opening metathesis polymerization. Chemical science 9(7) (2018) 1846-1853
Space group: P b c a
Cell volume: 3524.2
Cell parameters: 13.4779; 8.1983; 31.894; 90; 90; 90;  

COD ID: 1548635
CIF file Formula: - C23 H24 O2 -
Comments: Zheng, Xinxin; Guo, Rui; Zhang, Guozhu; Zhang, Dayong Rhodium(i)-catalyzed asymmetric [4 + 2] cycloaddition reactions of 2-alkylenecyclobutanols with cyclic enones through C-C bond cleavage: efficient access to <i>trans</i>-bicyclic compounds. Chemical science 9(7) (2018) 1873-1877
Space group: P 21 21 21
Cell volume: 1826.55
Cell parameters: 9.7798; 10.6568; 17.5257; 90; 90; 90;  

COD ID: 1548636
CIF file Formula: - C8 H14 Ag N O4 -
Comments: Fang, Yinzhi; Zhang, Han; Huang, Zhen; Scinto, Samuel L.; Yang, Jeffrey C.; Am Ende, Christopher W.; Dmitrenko, Olga; Johnson, Douglas S.; Fox, Joseph M. Photochemical syntheses, transformations, and bioorthogonal chemistry of <i>trans</i>-cycloheptene and sila <i>trans</i>-cycloheptene Ag(i) complexes. Chemical science 9(7) (2018) 1953-1963
Space group: P 21 21 21
Cell volume: 1004.7
Cell parameters: 7.786; 8.024; 16.081; 90; 90; 90;  

COD ID: 1548637
CIF file Formula: - C18 H20 Ag N O3 Si -
Comments: Fang, Yinzhi; Zhang, Han; Huang, Zhen; Scinto, Samuel L.; Yang, Jeffrey C.; Am Ende, Christopher W.; Dmitrenko, Olga; Johnson, Douglas S.; Fox, Joseph M. Photochemical syntheses, transformations, and bioorthogonal chemistry of <i>trans</i>-cycloheptene and sila <i>trans</i>-cycloheptene Ag(i) complexes. Chemical science 9(7) (2018) 1953-1963
Space group: P 1 21/c 1
Cell volume: 1765.53
Cell parameters: 16.509; 8.4282; 13.9655; 90; 114.69; 90;  

COD ID: 1548638
CIF file Formula: - C30.71 H44.57 Br1.14 Fe N2 O2.86 -
Comments: Fleischauer, Valerie E.; Muñoz Iii, Salvador B; Neate, Peter G. N.; Brennessel, William W.; Neidig, Michael L. NHC and nucleophile chelation effects on reactive iron(ii) species in alkyl-alkyl cross-coupling. Chemical science 9(7) (2018) 1878-1891
Space group: I 1 a 1
Cell volume: 3232.4
Cell parameters: 15.186; 13.4178; 17.1643; 90; 112.449; 90;  

COD ID: 1548639
CIF file Formula: - C39 H60 Fe N2 O4 -
Comments: Fleischauer, Valerie E.; Muñoz Iii, Salvador B; Neate, Peter G. N.; Brennessel, William W.; Neidig, Michael L. NHC and nucleophile chelation effects on reactive iron(ii) species in alkyl-alkyl cross-coupling. Chemical science 9(7) (2018) 1878-1891
Space group: P -1
Cell volume: 1885.9
Cell parameters: 10.0953; 10.9483; 17.657; 88.7501; 75.1691; 88.9205;  

COD ID: 1548640
CIF file Formula: - C33 H46 Fe N2 O4 -
Comments: Fleischauer, Valerie E.; Muñoz Iii, Salvador B; Neate, Peter G. N.; Brennessel, William W.; Neidig, Michael L. NHC and nucleophile chelation effects on reactive iron(ii) species in alkyl-alkyl cross-coupling. Chemical science 9(7) (2018) 1878-1891
Space group: C 1 c 1
Cell volume: 4056.2
Cell parameters: 11.2603; 22.9235; 16.1864; 90; 103.878; 90;  

COD ID: 1548651
CIF file Formula: - C250.5 H168.5 B5 Co6 F41 N47 O21.25 S7 -
Comments: Rizzuto, Felix J.; Kieffer, Marion; Nitschke, Jonathan R. Quantified structural speciation in self-sorted CoII6L<sub>4</sub> cage systems. Chemical science 9(7) (2018) 1925-1930
Space group: P -1
Cell volume: 15407.3
Cell parameters: 21.2508; 21.6182; 39.5929; 93.208; 101.624; 118.521;  

COD ID: 1548652
CIF file Formula: - C273 H263.5 B60.5 Co6 F19.5 N62.5 O20.5 S6.5 -
Comments: Rizzuto, Felix J.; Kieffer, Marion; Nitschke, Jonathan R. Quantified structural speciation in self-sorted CoII6L<sub>4</sub> cage systems. Chemical science 9(7) (2018) 1925-1930
Space group: P -1
Cell volume: 19472.1
Cell parameters: 25.0303; 26.7592; 34.5514; 68.113; 88.8092; 66.5154;  

COD ID: 1548653
CIF file Formula: - C92 H130 Cl2 N4 Ni2 O5 -
Comments: Clarke, Ryan M.; Jeen, Tiffany; Rigo, Serena; Thompson, John R.; Kaake, Loren G.; Thomas, Fabrice; Storr, Tim Exploiting exciton coupling of ligand radical intervalence charge transfer transitions to tune NIR absorption. Chemical science 9(6) (2018) 1610-1620
Space group: P 1 21/n 1
Cell volume: 9364.1
Cell parameters: 15.5829; 39.582; 16.2027; 90; 110.448; 90;  

COD ID: 1548654
CIF file Formula: - C72 H96 N6 Ni2 O4 -
Comments: Clarke, Ryan M.; Jeen, Tiffany; Rigo, Serena; Thompson, John R.; Kaake, Loren G.; Thomas, Fabrice; Storr, Tim Exploiting exciton coupling of ligand radical intervalence charge transfer transitions to tune NIR absorption. Chemical science 9(6) (2018) 1610-1620
Space group: P -1
Cell volume: 3510.7
Cell parameters: 11.4567; 13.1358; 25.5529; 82.482; 89.48; 67.19;  

COD ID: 1548655
CIF file Formula: - C89 H139 N4 Ni2 O4 -
Comments: Clarke, Ryan M.; Jeen, Tiffany; Rigo, Serena; Thompson, John R.; Kaake, Loren G.; Thomas, Fabrice; Storr, Tim Exploiting exciton coupling of ligand radical intervalence charge transfer transitions to tune NIR absorption. Chemical science 9(6) (2018) 1610-1620
Space group: P b c a
Cell volume: 17396.5
Cell parameters: 29.9305; 12.1234; 47.9429; 90; 90; 90;  

COD ID: 1548656
CIF file Formula: - C192 H133 Ca2 O29 P4 -
Comments: Uno, Brice E.; Dicken, Rachel D.; Redfern, Louis R.; Stern, Charlotte M.; Krzywicki, Greg G.; Scheidt, Karl A. Calcium(ii)-catalyzed enantioselective conjugate additions of amines. Chemical science 9(6) (2018) 1634-1639
Space group: P 21 21 21
Cell volume: 19209.5
Cell parameters: 13.7157; 21.388; 65.483; 90; 90; 90;  

COD ID: 1548657
CIF file Formula: - C18 H17 Br N2 O2 -
Comments: Uno, Brice E.; Dicken, Rachel D.; Redfern, Louis R.; Stern, Charlotte M.; Krzywicki, Greg G.; Scheidt, Karl A. Calcium(ii)-catalyzed enantioselective conjugate additions of amines. Chemical science 9(6) (2018) 1634-1639
Space group: P 1
Cell volume: 397.25
Cell parameters: 4.681; 6.1091; 14.2048; 100.603; 92.652; 94.55;  

COD ID: 1548659
CIF file Formula: - C78 H78 B2 Fe2 N8 O2 P2 Zn2 -
Comments: Abubekerov, Mark; Wei, Junnian; Swartz, Kevin R.; Xie, Zhixin; Pei, Qibing; Diaconescu, Paula L. Preparation of multiblock copolymers <i>via</i> step-wise addition of l-lactide and trimethylene carbonate. Chemical science 9(8) (2018) 2168-2178
Space group: P 1 2/c 1
Cell volume: 3912.1
Cell parameters: 13.855; 9.378; 30.742; 90; 101.648; 90;  

COD ID: 1548660
CIF file Formula: - C27 H35 B9 Hf2 -
Comments: De, Anangsha; Zhang, Qian-Fan; Mondal, Bijan; Cheung, Ling Fung; Kar, Sourav; Saha, Koushik; Varghese, Babu; Wang, Lai-Sheng; Ghosh, Sundargopal [(Cp<sub>2</sub>M)<sub>2</sub>B<sub>9</sub>H<sub>11</sub>] (M = Zr or Hf): early transition metal 'guarded' heptaborane with strong covalent and electrostatic bonding. Chemical science 9(7) (2018) 1976-1981
Space group: P 1 21/c 1
Cell volume: 3048.1
Cell parameters: 17.2181; 12.9003; 14.6113; 90; 110.082; 90;  

COD ID: 1548661
CIF file Formula: - C27 H39 B9 Zr2 -
Comments: De, Anangsha; Zhang, Qian-Fan; Mondal, Bijan; Cheung, Ling Fung; Kar, Sourav; Saha, Koushik; Varghese, Babu; Wang, Lai-Sheng; Ghosh, Sundargopal [(Cp<sub>2</sub>M)<sub>2</sub>B<sub>9</sub>H<sub>11</sub>] (M = Zr or Hf): early transition metal 'guarded' heptaborane with strong covalent and electrostatic bonding. Chemical science 9(7) (2018) 1976-1981
Space group: P 1 21/c 1
Cell volume: 3057.85
Cell parameters: 17.2544; 12.8796; 14.6295; 90; 109.855; 90;  

COD ID: 1548662
CIF file Formula: - C20 H24 B5 Hf2 -
Comments: De, Anangsha; Zhang, Qian-Fan; Mondal, Bijan; Cheung, Ling Fung; Kar, Sourav; Saha, Koushik; Varghese, Babu; Wang, Lai-Sheng; Ghosh, Sundargopal [(Cp<sub>2</sub>M)<sub>2</sub>B<sub>9</sub>H<sub>11</sub>] (M = Zr or Hf): early transition metal 'guarded' heptaborane with strong covalent and electrostatic bonding. Chemical science 9(7) (2018) 1976-1981
Space group: P 1 c 1
Cell volume: 1075.33
Cell parameters: 9.3061; 7.8838; 14.9171; 90; 100.72; 90;  

COD ID: 1548696
CIF file Formula: - C12 H20 B10 -
Comments: Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science 9(8) (2018) 2284-2289
Space group: P 1 21/n 1
Cell volume: 1666.5
Cell parameters: 10.039; 14.627; 11.432; 90; 96.919; 90;  

COD ID: 1548697
CIF file Formula: - C5 H14 B10 S -
Comments: Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science 9(8) (2018) 2284-2289
Space group: P 1 21/n 1
Cell volume: 1190.27
Cell parameters: 11.7439; 8.5035; 12.5486; 90; 108.228; 90;  

COD ID: 1548698
CIF file Formula: - C5 H16 B10 O2 -
Comments: Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science 9(8) (2018) 2284-2289
Space group: P 21 21 21
Cell volume: 1259.3
Cell parameters: 6.955; 10.8072; 16.754; 90; 90; 90;  

COD ID: 1548699
CIF file Formula: - C6 H17 B10 N -
Comments: Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science 9(8) (2018) 2284-2289
Space group: P 1 21/n 1
Cell volume: 1286
Cell parameters: 11.9424; 8.5259; 13.3359; 90; 108.729; 90;  

COD ID: 1548700
CIF file Formula: - C14 H19 B10 N -
Comments: Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science 9(8) (2018) 2284-2289
Space group: P -1
Cell volume: 871.46
Cell parameters: 8.9977; 9.8055; 11.2475; 87.61; 66.4692; 73.9029;  

COD ID: 1548701
CIF file Formula: - C36 H67 B10 Li O10 -
Comments: Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science 9(8) (2018) 2284-2289
Space group: P -1
Cell volume: 2158
Cell parameters: 11.9668; 12.4954; 14.9348; 87.27; 75.356; 88.638;  

COD ID: 1548702
CIF file Formula: - C29 H25 N O3 S -
Comments: Zhou, Leijie; Yuan, Chunhao; Zeng, Yuan; Liu, Honglei; Wang, Chang; Gao, Xing; Wang, Qijun; Zhang, Cheng; Guo, Hongchao Phosphine-catalyzed [5+1] annulation of δ-sulfonamido-substituted enones with <i>N</i>-sulfonylimines: a facile synthesis of tetrahydropyridines. Chemical science 9(7) (2018) 1831-1835
Space group: P 1 21 1
Cell volume: 1172.5
Cell parameters: 9.769; 13.123; 10.039; 90; 114.345; 90;  

COD ID: 1548722
CIF file Formula: - C12 H15 O P -
Comments: Zhang, Kui; Cai, Lingchao; Yang, Zhongyue; Houk, K. N.; Kwon, Ohyun Bridged [2.2.1] bicyclic phosphine oxide facilitates catalytic γ-umpolung addition-Wittig olefination. Chemical science 9(7) (2018) 1867-1872
Space group: P 21 21 21
Cell volume: 1028.57
Cell parameters: 8.6681; 10.3977; 11.4123; 90; 90; 90;  

COD ID: 1548738
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1036.04
Cell parameters: 14.6048; 7.4486; 9.5237; 90; 90; 90;  

COD ID: 1548739
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1039.41
Cell parameters: 14.7295; 7.3639; 9.5828; 90; 90; 90;  

COD ID: 1548740
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1040.31
Cell parameters: 14.7688; 7.3395; 9.5973; 90; 90; 90;  

COD ID: 1548741
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1036.35
Cell parameters: 14.5868; 7.4684; 9.513; 90; 90; 90;  

COD ID: 1548742
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1032.1
Cell parameters: 14.471; 7.5428; 9.4556; 90; 90; 90;  

COD ID: 1548743
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1040.12
Cell parameters: 14.7589; 7.348; 9.5909; 90; 90; 90;  

COD ID: 1548744
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1034.77
Cell parameters: 14.5467; 7.4933; 9.4931; 90; 90; 90;  

COD ID: 1548745
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1038.45
Cell parameters: 14.6615; 7.4138; 9.5536; 90; 90; 90;  

COD ID: 1548746
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1039.07
Cell parameters: 14.7005; 7.3877; 9.5676; 90; 90; 90;  

COD ID: 1548747
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1037.12
Cell parameters: 14.6166; 7.4465; 9.5286; 90; 90; 90;  

COD ID: 1548748
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1032.93
Cell parameters: 14.4836; 7.5409; 9.4574; 90; 90; 90;  

COD ID: 1548749
CIF file Formula: - Cl Co H15 N7 O5 -
Comments: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science 9(8) (2018) 2319-2335
Space group: P n m a
Cell volume: 1040.76
Cell parameters: 14.8308; 7.2957; 9.6188; 90; 90; 90;  

COD ID: 1548752
CIF file Formula: - C34 H33 F4 Mg N3 -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P c a 21
Cell volume: 6207.39
Cell parameters: 24.8934; 13.45834; 18.5282; 90; 90; 90;  

COD ID: 1548753
CIF file Formula: - C58.5 H81 Mg N4 Zn -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P -1
Cell volume: 2729
Cell parameters: 11.7887; 12.0703; 21.6822; 80.152; 74.593; 66.945;  

COD ID: 1548754
CIF file Formula: - C81 H115 F3 Mg3 N6 -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P -1
Cell volume: 3896.7
Cell parameters: 14.5708; 14.6964; 18.2421; 91.379; 93.348; 91.651;  

COD ID: 1548755
CIF file Formula: - C35.5 H36.5 F4 Mg N3 -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P -1
Cell volume: 3257.4
Cell parameters: 11.8799; 16.0457; 17.2413; 83.738; 85.661; 88.935;  

COD ID: 1548756
CIF file Formula: - C59 H84 Mg N6 Zn -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: C 1 2/c 1
Cell volume: 5635.01
Cell parameters: 10.18598; 24.1833; 23.1663; 90; 99.0832; 90;  

COD ID: 1548757
CIF file Formula: - C46 H58 Mg N4 Zn -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P 1 2/n 1
Cell volume: 2137.75
Cell parameters: 13.4443; 8.2978; 19.6313; 90; 102.544; 90;  

COD ID: 1548758
CIF file Formula: - C46.5 H56 F4 N3 Zn -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: I 1 2/a 1
Cell volume: 8722.1
Cell parameters: 15.6052; 24.2499; 23.5838; 90; 102.23; 90;  

COD ID: 1548759
CIF file Formula: - C56 H78 Mg N4 O Zn -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P 1 21/n 1
Cell volume: 5287
Cell parameters: 12.3877; 22.4084; 19.0461; 90; 90.149; 90;  

COD ID: 1548760
CIF file Formula: - C65 H99 Al Mg N4 -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: I 1 2/a 1
Cell volume: 12638.5
Cell parameters: 21.9257; 15.7003; 37.0659; 90; 97.8995; 90;  

COD ID: 1548761
CIF file Formula: - C58 H82 N4 Zn3 -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P 1 21/n 1
Cell volume: 2823.07
Cell parameters: 12.7429; 17.3446; 13.026; 90; 101.313; 90;  

COD ID: 1548762
CIF file Formula: - C54 H75 Al N4 Zn -
Comments: Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science 9(8) (2018) 2348-2356
Space group: P 21 21 21
Cell volume: 5110.34
Cell parameters: 13.75991; 13.8927; 26.733; 90; 90; 90;  

COD ID: 1548769
CIF file Formula: - C17 H19 Cl O4 -
Comments: Ngamnithiporn, Aurapat; Jette, Carina I.; Bachman, Shoshana; Virgil, Scott C.; Stoltz, Brian M. Nickel-catalyzed enantioselective allylic alkylation of lactones and lactams with unactivated allylic alcohols. Chemical science 9(9) (2018) 2547-2551
Space group: P 21 21 21
Cell volume: 1572.1
Cell parameters: 6.9832; 8.5007; 26.483; 90; 90; 90;  

COD ID: 1548770
CIF file Formula: - C17 H6 Cl7 N2 -
Comments: Kimura, Shun; Tanushi, Akira; Kusamoto, Tetsuro; Kochi, Shuntaro; Sato, Tohru; Nishihara, Hiroshi A luminescent organic radical with two pyridyl groups: high photostability and dual stimuli-responsive properties, with theoretical analyses of photophysical processes. Chemical science 9(7) (2018) 1996-2007
Space group: P 1 21/n 1
Cell volume: 1848.9
Cell parameters: 8.7015; 14.84; 14.86; 90; 105.517; 90;  

COD ID: 1548829
CIF file Formula: - C260 H338 Au42 S26 -
Comments: Zhuang, Shengli; Liao, Lingwen; Zhao, Yan; Yuan, Jinyun; Yao, Chuanhao; Liu, Xu; Li, Jin; Deng, Haiteng; Yang, Jinlong; Wu, Zhikun Is the kernel-staples match a key-lock match? Chemical science 9(9) (2018) 2437-2442
Space group: P -1
Cell volume: 17553
Cell parameters: 24.328; 24.845; 32.217; 67.732; 76.94; 84.496;  

COD ID: 1548838
CIF file Formula: - C18 H26 N4 O6 S -
Comments: Lee, Jisun; Joullié, Madeleine M Total synthesis of the reported structure of ceanothine D <i>via</i> a novel macrocyclization strategy. Chemical science 9(9) (2018) 2432-2436
Space group: P 1
Cell volume: 2559.1
Cell parameters: 7.4225; 16.5812; 21.1102; 82.789; 85.375; 84.403;  

COD ID: 1548839
CIF file Formula: - C21 H23 Ni0.5 O4 -
Comments: Vijaykumar, Gonela; Pariyar, Anand; Ahmed, Jasimuddin; Shaw, Bikash Kumar; Adhikari, Debashis; Mandal, Swadhin K. Tuning the redox non-innocence of a phenalenyl ligand toward efficient nickel-assisted catalytic hydrosilylation. Chemical science 9(10) (2018) 2817-2825
Space group: P 1 21/n 1
Cell volume: 1740.8
Cell parameters: 9.6006; 15.4568; 11.7534; 90; 93.542; 90;  

COD ID: 1548853
CIF file Formula: - C23 H26 N2 O2 S2 -
Comments: Suzuki, Naoya; Suda, Kayo; Yokogawa, Daisuke; Kitoh-Nishioka, Hirotaka; Irle, Stephan; Ando, Akihiro; Abegão, Luis M G; Kamada, Kenji; Fukazawa, Aiko; Yamaguchi, Shigehiro Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffold. Chemical science 9(10) (2018) 2666-2673
Space group: P -1
Cell volume: 1053.02
Cell parameters: 7.4148; 10.3516; 14.6348; 82.054; 79.877; 73.007;  

COD ID: 1548854
CIF file Formula: - C25 H30 N2 O2 S2 -
Comments: Suzuki, Naoya; Suda, Kayo; Yokogawa, Daisuke; Kitoh-Nishioka, Hirotaka; Irle, Stephan; Ando, Akihiro; Abegão, Luis M G; Kamada, Kenji; Fukazawa, Aiko; Yamaguchi, Shigehiro Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffold. Chemical science 9(10) (2018) 2666-2673
Space group: P 1 21/a 1
Cell volume: 2379.1
Cell parameters: 10.7685; 14.2394; 16.386; 90; 108.759; 90;  

COD ID: 1548856
CIF file Formula: - C44 H36 N2 -
Comments: Sun, Xianglang; Xue, Qifan; Zhu, Zonglong; Xiao, Qi; Jiang, Kui; Yip, Hin-Lap; Yan, He; Li, Zhong'an Fluoranthene-based dopant-free hole transporting materials for efficient perovskite solar cells. Chemical science 9(10) (2018) 2698-2704
Space group: P 1 21/c 1
Cell volume: 1626.1
Cell parameters: 8.6947; 17.563; 10.737; 90; 97.361; 90;  

COD ID: 1548857
CIF file Formula: - C46 H34 N4 O4 -
Comments: Sun, Xianglang; Xue, Qifan; Zhu, Zonglong; Xiao, Qi; Jiang, Kui; Yip, Hin-Lap; Yan, He; Li, Zhong'an Fluoranthene-based dopant-free hole transporting materials for efficient perovskite solar cells. Chemical science 9(10) (2018) 2698-2704
Space group: P 1 21/c 1
Cell volume: 3604.1
Cell parameters: 14.1565; 17.917; 14.4208; 90; 99.826; 90;  

COD ID: 1548858
CIF file Formula: - C46 H34 N4 -
Comments: Sun, Xianglang; Xue, Qifan; Zhu, Zonglong; Xiao, Qi; Jiang, Kui; Yip, Hin-Lap; Yan, He; Li, Zhong'an Fluoranthene-based dopant-free hole transporting materials for efficient perovskite solar cells. Chemical science 9(10) (2018) 2698-2704
Space group: P -1
Cell volume: 1739.8
Cell parameters: 11.856; 12.147; 13.446; 102.687; 111.422; 93.005;  

COD ID: 1548860
CIF file Formula: - C42 H36.34 N O2.17 P -
Comments: Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science 9(9) (2018) 2628-2632
Space group: P 21 21 21
Cell volume: 6609.5
Cell parameters: 13.9558; 15.4622; 30.6296; 90; 90; 90;  

COD ID: 1548861
CIF file Formula: - C22 H20 Cl F6 N -
Comments: Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science 9(9) (2018) 2628-2632
Space group: P 1 21 1
Cell volume: 1040.49
Cell parameters: 11.4023; 8.446; 12.168; 90; 117.387; 90;  

COD ID: 1548862
CIF file Formula: - C24 H30 Cl N -
Comments: Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science 9(9) (2018) 2628-2632
Space group: P 21 21 21
Cell volume: 2105.2
Cell parameters: 8.332; 11.3877; 22.1875; 90; 90; 90;  

COD ID: 1548863
CIF file Formula: - C46.5 H39 Cl N O2 P -
Comments: Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science 9(9) (2018) 2628-2632
Space group: P 1 21 1
Cell volume: 3713.47
Cell parameters: 13.9275; 18.6673; 15.2746; 90; 110.757; 90;  

COD ID: 1548864
CIF file Formula: - C42.45 H36.9 Cl0.9 N O2 P -
Comments: Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science 9(9) (2018) 2628-2632
Space group: P 21 21 2
Cell volume: 3420.18
Cell parameters: 24.2085; 16.0031; 8.8283; 90; 90; 90;  

COD ID: 1548865
CIF file Formula: - C50 H82 B Cl N6 Ni O2 Si2 -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: C 1 2/c 1
Cell volume: 14138.5
Cell parameters: 27.8322; 21.4898; 26.4066; 90; 116.468; 90;  

COD ID: 1548866
CIF file Formula: - C44 H71 B Cl N5 Ni O3 Si2 -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: P 1 21/c 1
Cell volume: 4897.1
Cell parameters: 10.8782; 25.2119; 17.866; 90; 91.948; 90;  

COD ID: 1548867
CIF file Formula: - C38 H63 B Cl N5 O2 -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: P -1
Cell volume: 1938.4
Cell parameters: 9.8905; 12.6054; 16.945; 69.66; 89.159; 78.594;  

COD ID: 1548868
CIF file Formula: - C66 H105 B Cl N6 Ni O6 Si2 -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: P -1
Cell volume: 3428.1
Cell parameters: 11.0148; 14.6131; 22.793; 84.552; 83.601; 70.398;  

COD ID: 1548869
CIF file Formula: - C27 H49 B Cl N5 -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: P 1 21/n 1
Cell volume: 3095.16
Cell parameters: 13.7173; 15.3059; 15.7157; 90; 110.275; 90;  

COD ID: 1548870
CIF file Formula: - C33 H59 B Cl N5 O -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: P b c a
Cell volume: 7136.9
Cell parameters: 15.6878; 12.3457; 36.8495; 90; 90; 90;  

COD ID: 1548871
CIF file Formula: - C51 H78 B Cl N6 Ni O2 Si2 -
Comments: Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science 9(9) (2018) 2595-2600
Space group: P 1 21/c 1
Cell volume: 6643
Cell parameters: 14.0633; 26.4632; 18.1718; 90; 100.801; 90;  

COD ID: 1548872
CIF file Formula: - C15 H12 F6 N O P -
Comments: Sun, Y.; Cramer, N. Tailored trisubstituted chiral Cp <sup> <i>x</i> </sup> Rh<sup>III</sup> catalysts for kinetic resolutions of phosphinic amides. Chemical science 9(11) (2018) 2981-2985
Space group: P 1 21 1
Cell volume: 1585.46
Cell parameters: 10.17707; 8.43885; 18.8541; 90; 101.724; 90;  

COD ID: 1548873
CIF file Formula: - C65 H60 Cl6 O4 Rh2 -
Comments: Sun, Y.; Cramer, N. Tailored trisubstituted chiral Cp <sup> <i>x</i> </sup> Rh<sup>III</sup> catalysts for kinetic resolutions of phosphinic amides. Chemical science 9(11) (2018) 2981-2985
Space group: P 21 21 21
Cell volume: 5936.3
Cell parameters: 9.524; 17.1108; 36.4272; 90; 90; 90;  

COD ID: 1548874
CIF file Formula: - C32 H72 B20 Cl2 Cu2 O8 P4 Ru2 -
Comments: Eleazer, Bennett J.; Smith, Mark D.; Popov, Alexey A.; Peryshkov, Dmitry V. Expansion of the (BB) 〉metallacycle with coinage metal cations: formation of B-M-Ru-B (M = Cu, Ag, Au) dimetalacyclodiboryls. Chemical science 9(9) (2018) 2601-2608
Space group: P 1 21/n 1
Cell volume: 2815.5
Cell parameters: 10.4786; 16.101; 16.7081; 90; 92.821; 90;  

COD ID: 1548875
CIF file Formula: - C18 H39 Ag B10 N2 O7 P2 Ru -
Comments: Eleazer, Bennett J.; Smith, Mark D.; Popov, Alexey A.; Peryshkov, Dmitry V. Expansion of the (BB) 〉metallacycle with coinage metal cations: formation of B-M-Ru-B (M = Cu, Ag, Au) dimetalacyclodiboryls. Chemical science 9(9) (2018) 2601-2608
Space group: P 1 n 1
Cell volume: 1576.57
Cell parameters: 10.6009; 13.8331; 11.0738; 90; 103.867; 90;  

COD ID: 1548876
CIF file Formula: - C32 H72 Au2 B20 Cl2 O8 P4 Ru2 -
Comments: Eleazer, Bennett J.; Smith, Mark D.; Popov, Alexey A.; Peryshkov, Dmitry V. Expansion of the (BB) 〉metallacycle with coinage metal cations: formation of B-M-Ru-B (M = Cu, Ag, Au) dimetalacyclodiboryls. Chemical science 9(9) (2018) 2601-2608
Space group: P 1 21/c 1
Cell volume: 2925.4
Cell parameters: 12.421; 12.596; 19.0782; 90; 101.457; 90;  

COD ID: 1548877
CIF file Formula: - C60 H36 Fe N14 S2 -
Comments: Wang, Jun-Li; Liu, Qiang; Meng, Yin-Shan; Liu, Xin; Zheng, Hui; Shi, Quan; Duan, Chun-Ying; Liu, Tao Fluorescence modulation <i>via</i> photoinduced spin crossover switched energy transfer from fluorophores to Fe<sup>II</sup> ions. Chemical science 9(11) (2018) 2892-2897
Space group: P -1
Cell volume: 1180.51
Cell parameters: 7.945; 8.8188; 17.5482; 77.665; 82.466; 81.092;  

COD ID: 1548878
CIF file Formula: - C60 H36 Fe N14 S2 -
Comments: Wang, Jun-Li; Liu, Qiang; Meng, Yin-Shan; Liu, Xin; Zheng, Hui; Shi, Quan; Duan, Chun-Ying; Liu, Tao Fluorescence modulation <i>via</i> photoinduced spin crossover switched energy transfer from fluorophores to Fe<sup>II</sup> ions. Chemical science 9(11) (2018) 2892-2897
Space group: P -1
Cell volume: 1233.2
Cell parameters: 8.002; 9.1057; 17.7358; 76.787; 82.257; 80.099;  

COD ID: 1548879
CIF file Formula: - C20 H36 B2 Co F8 N6 O2 -
Comments: Khosrowabadi Kotyk, Juliet F.; Hanna, Caitlin M.; Combs, Rebecca L.; Ziller, Joseph W.; Yang, Jenny Y. Intramolecular hydrogen-bonding in a cobalt aqua complex and electrochemical water oxidation activity. Chemical science 9(10) (2018) 2750-2755
Space group: P 1 2/n 1
Cell volume: 1306.27
Cell parameters: 8.3869; 7.9947; 19.4819; 90; 90.1405; 90;  

COD ID: 1548880
CIF file Formula: - C22 H37 B2 Co F8 N7 O -
Comments: Khosrowabadi Kotyk, Juliet F.; Hanna, Caitlin M.; Combs, Rebecca L.; Ziller, Joseph W.; Yang, Jenny Y. Intramolecular hydrogen-bonding in a cobalt aqua complex and electrochemical water oxidation activity. Chemical science 9(10) (2018) 2750-2755
Space group: C 1 2/c 1
Cell volume: 5808.5
Cell parameters: 28.1807; 13.2001; 20.3454; 90; 129.871; 90;  

COD ID: 1548881
CIF file Formula: - C20 H28 B2 Co F8 N6 -
Comments: Khosrowabadi Kotyk, Juliet F.; Hanna, Caitlin M.; Combs, Rebecca L.; Ziller, Joseph W.; Yang, Jenny Y. Intramolecular hydrogen-bonding in a cobalt aqua complex and electrochemical water oxidation activity. Chemical science 9(10) (2018) 2750-2755
Space group: P 21 21 21
Cell volume: 2563
Cell parameters: 9.8793; 14.9748; 17.3244; 90; 90; 90;  

COD ID: 1548882
CIF file Formula: - C24 H38 B2 Co F8 N8 -
Comments: Khosrowabadi Kotyk, Juliet F.; Hanna, Caitlin M.; Combs, Rebecca L.; Ziller, Joseph W.; Yang, Jenny Y. Intramolecular hydrogen-bonding in a cobalt aqua complex and electrochemical water oxidation activity. Chemical science 9(10) (2018) 2750-2755
Space group: C 1 2/c 1
Cell volume: 9116.5
Cell parameters: 30.4582; 20.3058; 17.0511; 90; 120.178; 90;  

COD ID: 1548883
CIF file Formula: - C52 H54 Ba2 F12 Fe2 N6 O24 S4 -
Comments: Chantarojsiri, Teera; Ziller, Joseph W.; Yang, Jenny Y. Incorporation of redox-inactive cations promotes iron catalyzed aerobic C-H oxidation at mild potentials. Chemical science 9(9) (2018) 2567-2574
Space group: P -1
Cell volume: 1705.3
Cell parameters: 10.8491; 11.7518; 14.5176; 75.9118; 86.5298; 71.8096;  

COD ID: 1548884
CIF file Formula: - C46 H48 F6 Fe2 K2 N4 O19 S2 -
Comments: Chantarojsiri, Teera; Ziller, Joseph W.; Yang, Jenny Y. Incorporation of redox-inactive cations promotes iron catalyzed aerobic C-H oxidation at mild potentials. Chemical science 9(9) (2018) 2567-2574
Space group: C 1 2/c 1
Cell volume: 5617.7
Cell parameters: 32.941; 8.2524; 21.7664; 90; 108.302; 90;  

COD ID: 1548885
CIF file Formula: - C26 H27 Ba Cl F6 Fe N3 O12 S2 -
Comments: Chantarojsiri, Teera; Ziller, Joseph W.; Yang, Jenny Y. Incorporation of redox-inactive cations promotes iron catalyzed aerobic C-H oxidation at mild potentials. Chemical science 9(9) (2018) 2567-2574
Space group: P -1
Cell volume: 1747.82
Cell parameters: 9.7023; 12.7853; 15.6368; 106.971; 104.413; 98.178;  

COD ID: 1548886
CIF file Formula: - C23 H24 Cl F3 Fe K N2 O9 S -
Comments: Chantarojsiri, Teera; Ziller, Joseph W.; Yang, Jenny Y. Incorporation of redox-inactive cations promotes iron catalyzed aerobic C-H oxidation at mild potentials. Chemical science 9(9) (2018) 2567-2574
Space group: P 1 21/n 1
Cell volume: 2701.1
Cell parameters: 11.253; 17.652; 13.5982; 90; 90.075; 90;  

COD ID: 1548887
CIF file Formula: - C26 H27 Ba F6 Fe N3 O12.5 S2 -
Comments: Chantarojsiri, Teera; Ziller, Joseph W.; Yang, Jenny Y. Incorporation of redox-inactive cations promotes iron catalyzed aerobic C-H oxidation at mild potentials. Chemical science 9(9) (2018) 2567-2574
Space group: P b c m
Cell volume: 7500.8
Cell parameters: 9.5075; 27.3543; 28.8412; 90; 90; 90;  

COD ID: 1548897
CIF file Formula: - C16 H23 Cl Co F6 N4 O6 S2 -
Comments: Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. Chemical science 9(9) (2018) 2609-2619
Space group: P 1 21/n 1
Cell volume: 2402.1
Cell parameters: 8.8511; 24.5258; 11.1501; 90; 97.066; 90;  

COD ID: 1548898
CIF file Formula: - C19 H28 Co F6 N4 O8 S2 -
Comments: Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. Chemical science 9(9) (2018) 2609-2619
Space group: C 1 c 1
Cell volume: 2693.9
Cell parameters: 12.8115; 24.0973; 8.7902; 90; 96.927; 90;  

COD ID: 1548899
CIF file Formula: - C21 H29 Co F6 N7 O6 S2 -
Comments: Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. Chemical science 9(9) (2018) 2609-2619
Space group: P 1 21/n 1
Cell volume: 2900.46
Cell parameters: 14.2091; 13.4658; 15.184; 90; 93.295; 90;  

COD ID: 1548900
CIF file Formula: - C16 H24 Co F6 N4 O6 S2 -
Comments: Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. Chemical science 9(9) (2018) 2609-2619
Space group: P b c a
Cell volume: 4657.6
Cell parameters: 9.312; 16.956; 29.498; 90; 90; 90;  

COD ID: 1548901
CIF file Formula: - C18 H29 Co F6 N5 O6 S2 -
Comments: Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. Chemical science 9(9) (2018) 2609-2619
Space group: P 1 21/n 1
Cell volume: 2779.2
Cell parameters: 8.802; 24.936; 12.694; 90; 94.038; 90;  

COD ID: 1548902
CIF file Formula: - C19 H30 Co F6 N4 O7 S2 -
Comments: Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. Chemical science 9(9) (2018) 2609-2619
Space group: P 1 21/c 1
Cell volume: 2789.6
Cell parameters: 11.9921; 15.4423; 15.8756; 90; 108.403; 90;  

COD ID: 1548904
CIF file Formula: - C27 H32 B2 N Na O5 -
Comments: Zhang, Li; Jiao, Lei Super electron donors derived from diboron. Chemical science 9(10) (2018) 2711-2722
Space group: P b c m
Cell volume: 2902.8
Cell parameters: 14.245; 17.905; 11.3809; 90; 90; 90;  

COD ID: 1548905
CIF file Formula: - C32 H38 B K N2 O4 -
Comments: Zhang, Li; Jiao, Lei Super electron donors derived from diboron. Chemical science 9(10) (2018) 2711-2722
Space group: P 1 21 1
Cell volume: 6484
Cell parameters: 12.3892; 40.276; 12.9956; 90; 90.798; 90;  

COD ID: 1548906
CIF file Formula: - C52 H57 N O2 P2 S2 Ti -
Comments: Kurogi, Takashi; Won, Joonghee; Park, Bohyun; Trofymchuk, Oleksandra S.; Carroll, Patrick J.; Baik, Mu-Hyun; Mindiola, Daniel J. Room temperature olefination of methane with titanium-carbon multiple bonds. Chemical science 9(13) (2018) 3376-3385
Space group: P 1 21/c 1
Cell volume: 4617
Cell parameters: 14.314; 12.233; 27.034; 90; 102.751; 90;  

COD ID: 1548907
CIF file Formula: - C56 H65 N7 P2 Ti -
Comments: Kurogi, Takashi; Won, Joonghee; Park, Bohyun; Trofymchuk, Oleksandra S.; Carroll, Patrick J.; Baik, Mu-Hyun; Mindiola, Daniel J. Room temperature olefination of methane with titanium-carbon multiple bonds. Chemical science 9(13) (2018) 3376-3385
Space group: P 1 21/n 1
Cell volume: 4978.4
Cell parameters: 11.835; 19.146; 22.47; 90; 102.101; 90;  

COD ID: 1548910
CIF file Formula: - C20 H28 Cl3 N4 O4 Ru -
Comments: Tse, Chun-Wai; Liu, Yungen; Wai-Shan Chow, Toby; Ma, Chaoqun; Yip, Wing-Ping; Chang, Xiao-Yong; Low, Kam-Hung; Huang, Jie-Sheng; Che, Chi-Ming <i>cis</i>-Oxoruthenium complexes supported by chiral tetradentate amine (N<sub>4</sub>) ligands for hydrocarbon oxidations. Chemical science 9(10) (2018) 2803-2816
Space group: P 1 21/c 1
Cell volume: 2309.5
Cell parameters: 11.0085; 13.2457; 15.8552; 90; 92.636; 90;  

COD ID: 1548911
CIF file Formula: - C22 H29 Cl3 N5 O4 Ru -
Comments: Tse, Chun-Wai; Liu, Yungen; Wai-Shan Chow, Toby; Ma, Chaoqun; Yip, Wing-Ping; Chang, Xiao-Yong; Low, Kam-Hung; Huang, Jie-Sheng; Che, Chi-Ming <i>cis</i>-Oxoruthenium complexes supported by chiral tetradentate amine (N<sub>4</sub>) ligands for hydrocarbon oxidations. Chemical science 9(10) (2018) 2803-2816
Space group: P 21 21 21
Cell volume: 2555.7
Cell parameters: 8.6233; 12.5838; 23.552; 90; 90; 90;  

COD ID: 1548912
CIF file Formula: - C22 H32 Cl3 N4 O4 Ru -
Comments: Tse, Chun-Wai; Liu, Yungen; Wai-Shan Chow, Toby; Ma, Chaoqun; Yip, Wing-Ping; Chang, Xiao-Yong; Low, Kam-Hung; Huang, Jie-Sheng; Che, Chi-Ming <i>cis</i>-Oxoruthenium complexes supported by chiral tetradentate amine (N<sub>4</sub>) ligands for hydrocarbon oxidations. Chemical science 9(10) (2018) 2803-2816
Space group: P 1 2 1
Cell volume: 1270.4
Cell parameters: 10.505; 10.579; 11.649; 90; 101.09; 90;  

COD ID: 1548913
CIF file Formula: - C32 H38 Cl2 N6 O8 Ru -
Comments: Tse, Chun-Wai; Liu, Yungen; Wai-Shan Chow, Toby; Ma, Chaoqun; Yip, Wing-Ping; Chang, Xiao-Yong; Low, Kam-Hung; Huang, Jie-Sheng; Che, Chi-Ming <i>cis</i>-Oxoruthenium complexes supported by chiral tetradentate amine (N<sub>4</sub>) ligands for hydrocarbon oxidations. Chemical science 9(10) (2018) 2803-2816
Space group: P 1 21 1
Cell volume: 1692.9
Cell parameters: 8.1503; 16.4241; 12.805; 90; 99.016; 90;  

COD ID: 1548914
CIF file Formula: - C31.65 H36.48 Cl2 N6.83 O8 Ru -
Comments: Tse, Chun-Wai; Liu, Yungen; Wai-Shan Chow, Toby; Ma, Chaoqun; Yip, Wing-Ping; Chang, Xiao-Yong; Low, Kam-Hung; Huang, Jie-Sheng; Che, Chi-Ming <i>cis</i>-Oxoruthenium complexes supported by chiral tetradentate amine (N<sub>4</sub>) ligands for hydrocarbon oxidations. Chemical science 9(10) (2018) 2803-2816
Space group: P -1
Cell volume: 3588.2
Cell parameters: 9.912; 17.5103; 21.2883; 81.245; 80.941; 83.022;  

COD ID: 1548915
CIF file Formula: - C78 H58 Mn3.5 N4 O24 S10 -
Comments: Yamamoto, S.; Pirillo, J.; Hijikata, Y.; Zhang, Z.; Awaga, K. Nanopore-induced host-guest charge transfer phenomena in a metal-organic framework. Chemical science 9(13) (2018) 3282-3289
Space group: P -1
Cell volume: 4399.85
Cell parameters: 14.38; 15.3958; 21.7726; 74.25; 71.751; 82.351;  

COD ID: 1548916
CIF file Formula: - C100 H17.5 Mn3.5 N10 O24 -
Comments: Yamamoto, S.; Pirillo, J.; Hijikata, Y.; Zhang, Z.; Awaga, K. Nanopore-induced host-guest charge transfer phenomena in a metal-organic framework. Chemical science 9(13) (2018) 3282-3289
Space group: P -1
Cell volume: 4591.03
Cell parameters: 14.639; 16.743; 20.551; 100.913; 106.78; 100.119;  

COD ID: 1548917
CIF file Formula: - C32 H68 N8 Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P -1
Cell volume: 1849.26
Cell parameters: 10.383; 11.3585; 17.4827; 89.777; 89.404; 63.76;  

COD ID: 1548918
CIF file Formula: - C35 H69 N9 Si Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/c 1
Cell volume: 4199.3
Cell parameters: 16.9023; 11.4723; 21.7432; 90; 95.127; 90;  

COD ID: 1548919
CIF file Formula: - C30 H62 N6 O2 Si Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P -1
Cell volume: 1848
Cell parameters: 9.4981; 11.95; 16.888; 90.32; 99.06; 102.29;  

COD ID: 1548920
CIF file Formula: - C29 H62 N6 O Si Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P -1
Cell volume: 3662.3
Cell parameters: 12.986; 16.992; 17.337; 103.843; 97.592; 93.871;  

COD ID: 1548921
CIF file Formula: - C13.75 H25 N3 Th0.5 -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P -1
Cell volume: 1576.47
Cell parameters: 11.5082; 12.3194; 12.8462; 61.8432; 79.157; 86.2752;  

COD ID: 1548922
CIF file Formula: - C37 H71 N7 Si Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/n 1
Cell volume: 4199
Cell parameters: 10.9839; 20.99; 18.246; 90; 93.46; 90;  

COD ID: 1548923
CIF file Formula: - C34 H67 N7 Si Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/n 1
Cell volume: 3874.9
Cell parameters: 12.6373; 17.8743; 17.1544; 90; 90.033; 90;  

COD ID: 1548924
CIF file Formula: - C56 H87 B N6 O2 Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/c 1
Cell volume: 5429.2
Cell parameters: 18.6971; 15.8036; 18.9111; 90; 103.688; 90;  

COD ID: 1548925
CIF file Formula: - C32 H67 B N6 Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/n 1
Cell volume: 3677.5
Cell parameters: 12.1573; 18.4711; 16.3766; 90; 90.215; 90;  

COD ID: 1548926
CIF file Formula: - C33 H58 N6 Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/c 1
Cell volume: 3553
Cell parameters: 19.0249; 10.3942; 19.133; 90; 110.105; 90;  

COD ID: 1548927
CIF file Formula: - C33 H63 N6 P Th -
Comments: Settineri, Nicholas S.; Arnold, John Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex. Chemical science 9(10) (2018) 2831-2841
Space group: P 1 21/n 1
Cell volume: 7522.9
Cell parameters: 22.5782; 13.2908; 25.4828; 90; 100.332; 90;  

COD ID: 1548939
CIF file Formula: - C22 H23 N O2 Si -
Comments: Rodriguez, Kevin X.; Pilato, Tara C.; Ashfeld, Brandon L. An unusual stereoretentive 1,3-quaternary carbon shift resulting in an enantioselective Rh<sup>II</sup>-catalyzed formal [4+1]-cycloaddition between diazo compounds and vinyl ketenes. Chemical science 9(12) (2018) 3221-3226
Space group: P 1 21 1
Cell volume: 979.92
Cell parameters: 10.4794; 7.0464; 13.4791; 90; 100.094; 90;  

COD ID: 1548940
CIF file Formula: - C22 H23 N O2 Si -
Comments: Rodriguez, Kevin X.; Pilato, Tara C.; Ashfeld, Brandon L. An unusual stereoretentive 1,3-quaternary carbon shift resulting in an enantioselective Rh<sup>II</sup>-catalyzed formal [4+1]-cycloaddition between diazo compounds and vinyl ketenes. Chemical science 9(12) (2018) 3221-3226
Space group: P 21 21 21
Cell volume: 1892.08
Cell parameters: 9.4164; 11.6775; 17.207; 90; 90; 90;  

COD ID: 1548941
CIF file Formula: - C69.17 H38.35 B Cl2.35 F28 I N Na0 O P2 Rh -
Comments: Carreras, Lucas; Serrano-Torné, Marta; van Leeuwen, Piet W. N. M.; Vidal-Ferran, Anton <b>XBphos-Rh</b>: a halogen-bond assembled supramolecular catalyst. Chemical science 9(15) (2018) 3644-3648
Space group: P -1
Cell volume: 3557.34
Cell parameters: 12.9788; 15.9249; 18.4205; 77.6077; 73.186; 88.345;  

COD ID: 1548942
CIF file Formula: - C70.5 H46 B F24 I N O P2 Rh -
Comments: Carreras, Lucas; Serrano-Torné, Marta; van Leeuwen, Piet W. N. M.; Vidal-Ferran, Anton <b>XBphos-Rh</b>: a halogen-bond assembled supramolecular catalyst. Chemical science 9(15) (2018) 3644-3648
Space group: P -1
Cell volume: 3518.3
Cell parameters: 12.9235; 15.961; 18.3296; 79.049; 71.52; 88.475;  

COD ID: 1548943
CIF file Formula: - C18 H22 N2 O3 S -
Comments: Giri, Sovan Sundar; Liu, Rai-Shung Gold-catalyzed [4+3]- and [4+2]-annulations of 3-en-1-ynamides with isoxazoles <i>via</i> novel 6π-electrocyclizations of 3-azahepta trienyl cations. Chemical science 9(11) (2018) 2991-2995
Space group: P 1 21/c 1
Cell volume: 1728.58
Cell parameters: 17.417; 7.3299; 13.5997; 90; 95.37; 90;  

COD ID: 1548944
CIF file Formula: - C28 H26 N2 O3 S -
Comments: Giri, Sovan Sundar; Liu, Rai-Shung Gold-catalyzed [4+3]- and [4+2]-annulations of 3-en-1-ynamides with isoxazoles <i>via</i> novel 6π-electrocyclizations of 3-azahepta trienyl cations. Chemical science 9(11) (2018) 2991-2995
Space group: P 1 21/c 1
Cell volume: 2432.21
Cell parameters: 13.9904; 8.4064; 21.36; 90; 104.491; 90;  

COD ID: 1548945
CIF file Formula: - C18 H22 N2 O3 S -
Comments: Giri, Sovan Sundar; Liu, Rai-Shung Gold-catalyzed [4+3]- and [4+2]-annulations of 3-en-1-ynamides with isoxazoles <i>via</i> novel 6π-electrocyclizations of 3-azahepta trienyl cations. Chemical science 9(11) (2018) 2991-2995
Space group: P 1 21/c 1
Cell volume: 1762.8
Cell parameters: 12.3308; 16.1714; 8.8646; 90; 94.241; 90;  

COD ID: 1548946
CIF file Formula: - C21 H26 N2 O3 S -
Comments: Giri, Sovan Sundar; Liu, Rai-Shung Gold-catalyzed [4+3]- and [4+2]-annulations of 3-en-1-ynamides with isoxazoles <i>via</i> novel 6π-electrocyclizations of 3-azahepta trienyl cations. Chemical science 9(11) (2018) 2991-2995
Space group: P 1 21/n 1
Cell volume: 1948.61
Cell parameters: 9.0836; 21.4854; 9.9912; 90; 92.112; 90;  

COD ID: 1548947
CIF file Formula: - C24 H26 N2 O3 S -
Comments: Giri, Sovan Sundar; Liu, Rai-Shung Gold-catalyzed [4+3]- and [4+2]-annulations of 3-en-1-ynamides with isoxazoles <i>via</i> novel 6π-electrocyclizations of 3-azahepta trienyl cations. Chemical science 9(11) (2018) 2991-2995
Space group: P 1 21/c 1
Cell volume: 2153.37
Cell parameters: 9.8261; 13.6201; 16.2063; 90; 96.868; 90;  

COD ID: 1548948
CIF file Formula: - C16 H18 N2 O3 S -
Comments: Giri, Sovan Sundar; Liu, Rai-Shung Gold-catalyzed [4+3]- and [4+2]-annulations of 3-en-1-ynamides with isoxazoles <i>via</i> novel 6π-electrocyclizations of 3-azahepta trienyl cations. Chemical science 9(11) (2018) 2991-2995
Space group: C 1 2/c 1
Cell volume: 3124.6
Cell parameters: 10.99; 9.6096; 29.66; 90; 94.047; 90;  

COD ID: 1548949
CIF file Formula: - C12 H12 F4 O -
Comments: Rodil, Andrea; Bosisio, Stefano; Ayoup, Mohammed Salah; Quinn, Laura; Cordes, David B.; Slawin, Alexandra M. Z.; Murphy, Cormac D.; Michel, Julien; O'Hagan, David Metabolism and hydrophilicity of the polarised 'Janus face' all-<i>cis</i> tetrafluorocyclohexyl ring, a candidate motif for drug discovery. Chemical science 9(11) (2018) 3023-3028
Space group: P 21 21 21
Cell volume: 1099.4
Cell parameters: 6.0422; 11.778; 15.448; 90; 90; 90;  

COD ID: 1548950
CIF file Formula: - C12 H14 F2 O -
Comments: Rodil, Andrea; Bosisio, Stefano; Ayoup, Mohammed Salah; Quinn, Laura; Cordes, David B.; Slawin, Alexandra M. Z.; Murphy, Cormac D.; Michel, Julien; O'Hagan, David Metabolism and hydrophilicity of the polarised 'Janus face' all-<i>cis</i> tetrafluorocyclohexyl ring, a candidate motif for drug discovery. Chemical science 9(11) (2018) 3023-3028
Space group: P 21 21 21
Cell volume: 1049.83
Cell parameters: 5.25889; 9.75241; 20.4698; 90; 90; 90;  

COD ID: 1548951
CIF file Formula: - C12 H14 F2 O -
Comments: Rodil, Andrea; Bosisio, Stefano; Ayoup, Mohammed Salah; Quinn, Laura; Cordes, David B.; Slawin, Alexandra M. Z.; Murphy, Cormac D.; Michel, Julien; O'Hagan, David Metabolism and hydrophilicity of the polarised 'Janus face' all-<i>cis</i> tetrafluorocyclohexyl ring, a candidate motif for drug discovery. Chemical science 9(11) (2018) 3023-3028
Space group: P 1 21/a 1
Cell volume: 2070.88
Cell parameters: 13.5173; 5.57303; 27.4909; 90; 90.469; 90;  

COD ID: 1548952
CIF file Formula: - C12 H14 F2 O -
Comments: Rodil, Andrea; Bosisio, Stefano; Ayoup, Mohammed Salah; Quinn, Laura; Cordes, David B.; Slawin, Alexandra M. Z.; Murphy, Cormac D.; Michel, Julien; O'Hagan, David Metabolism and hydrophilicity of the polarised 'Janus face' all-<i>cis</i> tetrafluorocyclohexyl ring, a candidate motif for drug discovery. Chemical science 9(11) (2018) 3023-3028
Space group: P 1 21/c 1
Cell volume: 2057.2
Cell parameters: 10.536; 19.983; 10.272; 90; 107.972; 90;  

COD ID: 1548953
CIF file Formula: - C12 H15 F O -
Comments: Rodil, Andrea; Bosisio, Stefano; Ayoup, Mohammed Salah; Quinn, Laura; Cordes, David B.; Slawin, Alexandra M. Z.; Murphy, Cormac D.; Michel, Julien; O'Hagan, David Metabolism and hydrophilicity of the polarised 'Janus face' all-<i>cis</i> tetrafluorocyclohexyl ring, a candidate motif for drug discovery. Chemical science 9(11) (2018) 3023-3028
Space group: P 21 21 21
Cell volume: 1030.74
Cell parameters: 5.33024; 9.6528; 20.0332; 90; 90; 90;  

COD ID: 1548954
CIF file Formula: - C31 H34 O4 S -
Comments: Zhao, Jian; Jonker, Sybrand J. T.; Meyer, Denise N.; Schulz, Göran; Tran, C. Duc; Eriksson, Lars; Szabó, Kálmán J Copper-catalyzed synthesis of allenylboronic acids. Access to sterically encumbered homopropargylic alcohols and amines by propargylboration. Chemical science 9(13) (2018) 3305-3312
Space group: P 61
Cell volume: 4405.8
Cell parameters: 21.247; 21.247; 11.2694; 90; 90; 120;  

COD ID: 1548969
CIF file Formula: - C31 H27 N3 O3 -
Comments: Xiong, Yaoyao; Vargas Jentzsch, Andreas; Osterrieth, Johannes W. M.; Sezgin, Erdinc; Sazanovich, Igor V.; Reglinski, Katharina; Galiani, Silvia; Parker, Anthony W.; Eggeling, Christian; Anderson, Harry L. Spironaphthoxazine switchable dyes for biological imaging. Chemical science 9(11) (2018) 3029-3040
Space group: P -1
Cell volume: 1218.2
Cell parameters: 7.6914; 8.8535; 18.0798; 91.235; 97.803; 92.431;  

COD ID: 1548970
CIF file Formula: - C308 H374 N23 O12 P3 -
Comments: Fatila, Elisabeth M.; Pink, Maren; Twum, Eric B.; Karty, Jonathan A.; Flood, Amar H. Phosphate-phosphate oligomerization drives higher order co-assemblies with stacks of cyanostar macrocycles. Chemical science 9(11) (2018) 2863-2872
Space group: P -1
Cell volume: 7942
Cell parameters: 21.138; 21.616; 21.948; 118.123; 106.659; 99.169;  

COD ID: 1548971
CIF file Formula: - C365.84 H508.52 Cl14.16 N26 O29.28 P7 -
Comments: Fatila, Elisabeth M.; Pink, Maren; Twum, Eric B.; Karty, Jonathan A.; Flood, Amar H. Phosphate-phosphate oligomerization drives higher order co-assemblies with stacks of cyanostar macrocycles. Chemical science 9(11) (2018) 2863-2872
Space group: P -1
Cell volume: 9208.2
Cell parameters: 19.692; 22.3708; 25.201; 97.908; 108.437; 113.456;  

COD ID: 1548975
CIF file Formula: - C26 H15 N6 O11 Zn2 -
Comments: Zhao, He; Ni, Jun; Zhang, Jian-Jun; Liu, Shu-Qin; Sun, Ying-Ji; Zhou, Huajun; Li, Yan-Qin; Duan, Chun-Ying A trichromatic MOF composite for multidimensional ratiometric luminescent sensing. Chemical science 9(11) (2018) 2918-2926
Space group: I 4
Cell volume: 13741
Cell parameters: 27.458; 27.458; 18.225; 90; 90; 90;  

COD ID: 1548976
CIF file Formula: - C58.5 H43.5 F6 N6.5 O2.5 Zn -
Comments: Nichols, Eva M.; Derrick, Jeffrey S.; Nistanaki, Sepand K.; Smith, Peter T.; Chang, Christopher J. Positional effects of second-sphere amide pendants on electrochemical CO<sub>2</sub> reduction catalyzed by iron porphyrins. Chemical science 9(11) (2018) 2952-2960
Space group: P 1 21/n 1
Cell volume: 10261.5
Cell parameters: 10.7604; 51.619; 18.6745; 90; 98.394; 90;  

COD ID: 1548977
CIF file Formula: - C9.4 H4 D5.61 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2779.58
Cell parameters: 15.1723; 15.1723; 12.0747; 90; 90; 90;  

COD ID: 1548978
CIF file Formula: - C10.63 H4 D8.95 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2776.85
Cell parameters: 15.1668; 15.1668; 12.0716; 90; 90; 90;  

COD ID: 1548979
CIF file Formula: - C9.01 H4 D4.06 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2776.21
Cell parameters: 15.16316; 15.16316; 12.0746; 90; 90; 90;  

COD ID: 1548980
CIF file Formula: - C10 H4 D2 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2774.17
Cell parameters: 15.1613; 15.1613; 12.0687; 90; 90; 90;  

COD ID: 1548981
CIF file Formula: - C10.14 H4 D4.28 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2774.01
Cell parameters: 15.1594; 15.1594; 12.071; 90; 90; 90;  

COD ID: 1548982
CIF file Formula: - C10.07 H4 D6.2 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2776.8
Cell parameters: 15.1661; 15.1661; 12.0725; 90; 90; 90;  

COD ID: 1548983
CIF file Formula: - C11.56 H4 D3.56 O5 V -
Comments: Lu, Zhenzhong; Godfrey, Harry G. W.; da Silva, Ivan; Cheng, Yongqiang; Savage, Mathew; Manuel, Pascal; Rudić, Svemir; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schröder, Martin Direct observation of supramolecular binding of light hydrocarbons in vanadium(iii) and (iv) metal-organic framework materials. Chemical science 9(13) (2018) 3401-3408
Space group: I 41 2 2
Cell volume: 2764.61
Cell parameters: 15.1457; 15.1457; 12.0519; 90; 90; 90;  

COD ID: 1548984
CIF file Formula: - C15 H10 B5 F30 K5 -
Comments: Phelan, James P.; Wiles, Rebecca J.; Lang, Simon B.; Kelly, Christopher B.; Molander, Gary A. Rapid access to diverse, trifluoromethyl-substituted alkenes using complementary strategies. Chemical science 9(12) (2018) 3215-3220
Space group: P -1
Cell volume: 1699.54
Cell parameters: 10.9621; 12.9672; 13.9252; 111.325; 99.442; 105.532;  

COD ID: 1548989
CIF file Formula: - C21 H15 F6 N2 O P -
Comments: Rosenberg, M.; Rostgaard, K. R.; Liao, Z.; Madsen, A Ø; Martinez, K. L.; Vosch, T.; Laursen, B. W. Design, synthesis, and time-gated cell imaging of carbon-bridged triangulenium dyes with long fluorescence lifetime and red emission. Chemical science 9(12) (2018) 3122-3130
Space group: C 1 2/c 1
Cell volume: 1737.8
Cell parameters: 6.861; 10.695; 23.818; 90; 96.101; 90;  

COD ID: 1548990
CIF file Formula: - C22 H15 F6 O2 P -
Comments: Rosenberg, M.; Rostgaard, K. R.; Liao, Z.; Madsen, A Ø; Martinez, K. L.; Vosch, T.; Laursen, B. W. Design, synthesis, and time-gated cell imaging of carbon-bridged triangulenium dyes with long fluorescence lifetime and red emission. Chemical science 9(12) (2018) 3122-3130
Space group: P -1
Cell volume: 917.65
Cell parameters: 8.4805; 8.5013; 14.7698; 74.017; 89.013; 64.503;  

COD ID: 1548991
CIF file Formula: - C23 H18 F6 N O P -
Comments: Rosenberg, M.; Rostgaard, K. R.; Liao, Z.; Madsen, A Ø; Martinez, K. L.; Vosch, T.; Laursen, B. W. Design, synthesis, and time-gated cell imaging of carbon-bridged triangulenium dyes with long fluorescence lifetime and red emission. Chemical science 9(12) (2018) 3122-3130
Space group: P -1
Cell volume: 3826.1
Cell parameters: 14.162; 15.264; 20.039; 87.939; 85.555; 62.365;  

COD ID: 1548992
CIF file Formula: - C24 H21 F6 N2 P -
Comments: Rosenberg, M.; Rostgaard, K. R.; Liao, Z.; Madsen, A Ø; Martinez, K. L.; Vosch, T.; Laursen, B. W. Design, synthesis, and time-gated cell imaging of carbon-bridged triangulenium dyes with long fluorescence lifetime and red emission. Chemical science 9(12) (2018) 3122-3130
Space group: P c c n
Cell volume: 4106.2
Cell parameters: 14.5591; 21.6499; 13.0273; 90; 90; 90;  

COD ID: 1548993
CIF file Formula: - C35 H35 Cl2 F3 N8 Ni O3 S -
Comments: Grübel, Michael; Bosque, Irene; Altmann, Philipp J.; Bach, Thorsten; Hess, Corinna R. Redox and photocatalytic properties of a Ni<sup>II</sup> complex with a macrocyclic biquinazoline (Mabiq) ligand. Chemical science 9(13) (2018) 3313-3317
Space group: P -1
Cell volume: 1757.6
Cell parameters: 10.0222; 12.1506; 16.0254; 69.063; 75.075; 81.389;  

COD ID: 1548994
CIF file Formula: - C22 H35 N -
Comments: Grübel, Michael; Bosque, Irene; Altmann, Philipp J.; Bach, Thorsten; Hess, Corinna R. Redox and photocatalytic properties of a Ni<sup>II</sup> complex with a macrocyclic biquinazoline (Mabiq) ligand. Chemical science 9(13) (2018) 3313-3317
Space group: P 1 21/c 1
Cell volume: 1896
Cell parameters: 17.6983; 6.2954; 17.442; 90; 102.677; 90;  

COD ID: 1548995
CIF file Formula: - C33 H33 N8 Ni -
Comments: Grübel, Michael; Bosque, Irene; Altmann, Philipp J.; Bach, Thorsten; Hess, Corinna R. Redox and photocatalytic properties of a Ni<sup>II</sup> complex with a macrocyclic biquinazoline (Mabiq) ligand. Chemical science 9(13) (2018) 3313-3317
Space group: P 21 21 21
Cell volume: 5546.4
Cell parameters: 10.1802; 20.4136; 26.689; 90; 90; 90;  

COD ID: 1548996
CIF file Formula: - C16 H12 F3 N O4 S -
Comments: Das, Pulakesh; Gondo, Satoshi; Nagender, Punna; Uno, Hiroto; Tokunaga, Etsuko; Shibata, Norio Access to benzo-fused nine-membered heterocyclic alkenes with a trifluoromethyl carbinol moiety <i>via</i> a double decarboxylative formal ring-expansion process under palladium catalysis. Chemical science 9(13) (2018) 3276-3281
Space group: P -1
Cell volume: 776.24
Cell parameters: 8.4561; 8.5762; 12.4229; 110.047; 111.941; 90.1156;  


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