Search results

Formula: - C16 F6 N4 -
Comments: Li, Jing; Duchemin, Ivan; Roscioni, Otello Maria; Friederich, Pascal; Anderson, Marie; Da Como, Enrico; Kociok-Köhn, Gabriele; Wenzel, Wolfgang; Zannoni, Claudio; Beljonne, David; Blase, Xavier; D'Avino, Gabriele Host dependence of the electron affinity of molecular dopants Materials Horizons 6(1) (2019) 107
Space group: R -3 :H
Cell volume: 3057.3
Cell parameters: 17.533; 17.533; 11.484; 90; 90; 120;

COD ID: 1550032

Formula: - C34 H13 F28 N4 O Zn -
Comments: Sadhu, Subha; Aqueche, Kyler; Buffeteau, Thierry; Vincent, Jean-Marc; Hirsch, Lionel; Bassani, Dario M. Unexpected surface interactions between fluorocarbons and hybrid organic inorganic perovskites evidenced by PM-IRRAS and their application towards tuning the surface potential Materials Horizons 6(1) (2019) 192
Space group: P -1
Cell volume: 4171.3
Cell parameters: 13.983; 16.9424; 19.1273; 77.146; 74.236; 75.997;

COD ID: 1550036

Formula: - C55 H95 Co Li Mn O10 -
Comments: Han, Haixiang; Wei, Zheng; Filatov, Alexander S.; Carozza, Jesse C.; Alkan, Melisa; Rogachev, Andrey Yu; Shevtsov, Andrey; Abakumov, Artem; Pak, Chongin; Shatruk, Michael; Chen, Yu-Sheng; Dikarev, Evgeny V. Three to Tango Requires a Site-Specific Substitution: Heterotrimetallic Molecular Precursors for High-Voltage Rechargeable Batteries Chemical Science (2019)
Space group: P -1
Cell volume: 5990.4
Cell parameters: 11.581; 20.328; 27.709; 68.687; 88.434; 80.525;

COD ID: 1550037

Formula: - C55 H95 Co0.5 Li Mn1.5 O10 -
Comments: Han, Haixiang; Wei, Zheng; Filatov, Alexander S.; Carozza, Jesse C.; Alkan, Melisa; Rogachev, Andrey Yu; Shevtsov, Andrey; Abakumov, Artem; Pak, Chongin; Shatruk, Michael; Chen, Yu-Sheng; Dikarev, Evgeny V. Three to Tango Requires a Site-Specific Substitution: Heterotrimetallic Molecular Precursors for High-Voltage Rechargeable Batteries Chemical Science (2019)
Space group: P -1
Cell volume: 5971.7
Cell parameters: 11.5679; 20.2647; 27.742; 68.6974; 88.552; 80.5081;

COD ID: 1550039
CIF file	Formula: - C27 H41 Cr N8 O9 - Comments: Seo, Junghee; Cabelof, Alyssa; Chen, Chun-Hsing; Caulton, Kenneth G. Selective Deoxygenation of Nitrate to Nitrosyl using Trivalent Chromium and the Mashima Reagent: Reductive Silylation Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 6830 Cell parameters: 30.214; 10.381; 23.797; 90; 113.791; 90;

COD ID: 1550045
CIF file	Formula: - C268 H484 Ag80 F48 Mo16 N8 O120 S52 - Comments: SU, Yanmin; Wang, Zhi; Zhuang, Gui-lin; Zhao, Quanqin; Wang, Xing-Po; Tung, Chen-Ho; Sun, Di Unusual fcc-Structured Ag10 Kernel Trapped in Ag70 Nanocluster Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 24557.4 Cell parameters: 25.1615; 30.4928; 32.0095; 90; 90.675; 90;

COD ID: 1550046
CIF file	Formula: - C142 H294 Ag80 F48 Mo16 N6 O114 S52 - Comments: SU, Yanmin; Wang, Zhi; Zhuang, Gui-lin; Zhao, Quanqin; Wang, Xing-Po; Tung, Chen-Ho; Sun, Di Unusual fcc-Structured Ag10 Kernel Trapped in Ag70 Nanocluster Chemical Science (2019) Space group: P -1 Cell volume: 9646.4 Cell parameters: 21.9533; 22.169; 22.999; 111.88; 109.228; 92.0299;

COD ID: 1550051
CIF file	Formula: - C18 H23 N5 O - Comments: Choi, Yoona; Kim, Heejun; Park, Seung Bum Divergent Synthetic Pathway for Pyrimidine-Embedded Medium-Sized Azacycles through N-quaternizing Strategy Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 1695.3 Cell parameters: 8.8828; 19.2484; 10.8095; 90; 113.471; 90;

COD ID: 1550052
CIF file	Formula: - C17 H22 N5 O - Comments: Choi, Yoona; Kim, Heejun; Park, Seung Bum Divergent Synthetic Pathway for Pyrimidine-Embedded Medium-Sized Azacycles through N-quaternizing Strategy Chemical Science (2019) Space group: P -1 Cell volume: 1628.9 Cell parameters: 9.7756; 12.9665; 12.9912; 84.4412; 86.9004; 84.193;

COD ID: 1550053
CIF file	Formula: - C50 H84 N2 O8 V - Comments: Lin, Chun-Yi; Ngendahimana, Thacien; Eaton, Gareth; Eaton, Sandra S.; Zadrozny, Joseph Counterion Influence on Dynamic Spin Properties in a V(IV) Complex Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 4927.9 Cell parameters: 12.8268; 21.9164; 17.7812; 90; 99.648; 90;

COD ID: 1550054
CIF file	Formula: - C54 H92 N2 O6 V - Comments: Lin, Chun-Yi; Ngendahimana, Thacien; Eaton, Gareth; Eaton, Sandra S.; Zadrozny, Joseph Counterion Influence on Dynamic Spin Properties in a V(IV) Complex Chemical Science (2019) Space group: C 1 c 1 Cell volume: 5568 Cell parameters: 21.013; 23.356; 15.4; 90; 132.546; 90;

COD ID: 1550095

Formula: - C22 H14 N2 O -
Comments: Sirbu, Dumitru; Wales, Rebecca; Geary, David R.; Waddell, Paul G.; Benniston, Andrew C. Rosindone revisited: a computational and photophysical study of 7-phenylbenzo[a]phenazine-5(7H)-one (PBP). Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(1) (2019) 140-147
Space group: P b c a
Cell volume: 3089.43
Cell parameters: 8.23403; 10.88902; 34.457; 90; 90; 90;

COD ID: 1550096

Formula: - C41 H56 N8 O20 S4 -
Comments: Sozzani, Piero; Xing, Guolong; Bassanetti, Irene; Bracco, Silvia; Negroni, Mattia; Bezuidenhout, Charl; Ben, Teng; Comotti, Angiolina Double Helix of Opposite Charges to Form Channels with Unique CO2 Selectivity and Dynamics Chemical Science (2019)
Space group: I 41/a :2
Cell volume: 5110.1
Cell parameters: 25.7276; 25.7276; 7.7202; 90; 90; 90;

COD ID: 1550097

Formula: - C41 H40 N8 O12 S4 -
Comments: Sozzani, Piero; Xing, Guolong; Bassanetti, Irene; Bracco, Silvia; Negroni, Mattia; Bezuidenhout, Charl; Ben, Teng; Comotti, Angiolina Double Helix of Opposite Charges to Form Channels with Unique CO2 Selectivity and Dynamics Chemical Science (2019)
Space group: I 41/a :2
Cell volume: 4839.2
Cell parameters: 25.1179; 25.1179; 7.6702; 90; 90; 90;

COD ID: 1550098

Formula: - C52 H58 Cl2 N10 O8 Pd -
Comments: Kartha, Kalathil K.; Allampally, Naveen Kumar; Politi, Antiope T.; Prabhu, Deepak Dayanandan; Ouchi, Hayato; Albuquerque, Rodrigo Q.; Yagai, Shiki; Fernandez, Gustavo Influence of Metal Coordination and Light Irradiation on Hierarchical Self-Assembly Processes Chemical Science (2019)
Space group: P -1
Cell volume: 1276.66
Cell parameters: 10.6996; 11.6143; 11.6936; 73.834; 68.49; 74.621;

COD ID: 1550126
CIF file	Formula: - C36 H60 K6 N12 O68 Rh4 S12 Zn4 - Comments: Yoshinari, Nobuto; Yamashita, Satoshi; Fukuda, Yosuke; Nakazawa, Yasuhiro; Konno, Takumi Mobility of hydrated alkali metal ions in metallosupramolecular ionic crystals Chemical Science (2019) Space group: P 21 3 Cell volume: 13020.5 Cell parameters: 23.5257; 23.5257; 23.5257; 90; 90; 90;

COD ID: 1550127
CIF file	Formula: - C36 H60 N12 Na O79 Rh4 S12 Zn4 - Comments: Yoshinari, Nobuto; Yamashita, Satoshi; Fukuda, Yosuke; Nakazawa, Yasuhiro; Konno, Takumi Mobility of hydrated alkali metal ions in metallosupramolecular ionic crystals Chemical Science (2019) Space group: P 21 3 Cell volume: 13101 Cell parameters: 23.574; 23.574; 23.574; 90; 90; 90;

COD ID: 1550128
CIF file	Formula: - C36 H60 N12 O77.5 Rh4 S12 Zn4 - Comments: Yoshinari, Nobuto; Yamashita, Satoshi; Fukuda, Yosuke; Nakazawa, Yasuhiro; Konno, Takumi Mobility of hydrated alkali metal ions in metallosupramolecular ionic crystals Chemical Science (2019) Space group: P 21 3 Cell volume: 13061 Cell parameters: 23.55; 23.55; 23.55; 90; 90; 90;

COD ID: 1550131
CIF file	Formula: - C16 H20 O2 - Comments: Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science (2019) Space group: P 21 21 21 Cell volume: 1323.6 Cell parameters: 5.5263; 7.588; 31.5641; 90; 90; 90;

COD ID: 1550132
CIF file	Formula: - C11 H16 O - Comments: Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science (2019) Space group: I 41/a Cell volume: 3913.68 Cell parameters: 22.7253; 22.7253; 7.5782; 90; 90; 90;

COD ID: 1550133
CIF file	Formula: - C24 H32 O8 - Comments: Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science (2019) Space group: P 1 21 1 Cell volume: 1134.71 Cell parameters: 7.4736; 20.0163; 8.2616; 90; 113.345; 90;

COD ID: 1550134
CIF file	Formula: - C19 H18 F2 O - Comments: Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science (2019) Space group: R -3 Cell volume: 7009.36 Cell parameters: 26.8452; 26.8452; 11.2309; 90; 90; 120;

COD ID: 1550135
CIF file	Formula: - C24 H32 O9 - Comments: Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science (2019) Space group: P 1 21 1 Cell volume: 1169.41 Cell parameters: 11.1125; 8.0779; 13.1558; 90; 98.011; 90;

COD ID: 1550136
CIF file	Formula: - C18 H24 O5 - Comments: Condakes, Matthew; Rosen, Rachel; Harwood, Stephen; Maimone, Thomas A Copper-Catalyzed Double Coupling Enables a 3-Step Synthesis of the Quassinoid Core Architecture Chemical Science (2019) Space group: P 1 21 1 Cell volume: 821.49 Cell parameters: 8.032; 6.3518; 16.1371; 90; 93.7797; 90;

COD ID: 1550137

Formula: - C128 H72 Cd4 N16 O16 S8 Se4 -
Comments: Ding, Bowen; Hua, Carol; Kepert, Cameron J.; D'Alessandro, Deanna Michelle Influence of Structure-Activity Relationships on Through-Space Intervalence Charge Transfer in Metal-Organic Frameworks with Cofacial Redox-Active Units Chemical Science (2019)
Space group: P -1
Cell volume: 7841
Cell parameters: 15.868; 19.123; 26.124; 82.02; 87.25; 89.73;

COD ID: 1550138

Formula: - C64 H36 N8 O8 S4 Se2 Zn2 -
Comments: Ding, Bowen; Hua, Carol; Kepert, Cameron J.; D'Alessandro, Deanna Michelle Influence of Structure-Activity Relationships on Through-Space Intervalence Charge Transfer in Metal-Organic Frameworks with Cofacial Redox-Active Units Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 7593
Cell parameters: 25.811; 18.453; 15.943; 90; 90.91; 90;

COD ID: 1550149
CIF file	Formula: - C40 H47 Cl3 Co F6 Ni P3 S2 - Comments: Wang, Wenguang; Chu, Xiaoxiao; Jin, Jihao; Ming, Bangrong; Pang, Maofu; Yu, Xin; Tung, Chen-Ho Bimetallic Nickel-Cobalt Hydride in H2 Activation and Catalytic Proton Reduction Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 4666.6 Cell parameters: 14.1464; 13.3562; 25.4313; 90; 103.789; 90;

COD ID: 1550150
CIF file	Formula: - C41 H49 B Cl4 Co F4 Ni P2 S2 - Comments: Wang, Wenguang; Chu, Xiaoxiao; Jin, Jihao; Ming, Bangrong; Pang, Maofu; Yu, Xin; Tung, Chen-Ho Bimetallic Nickel-Cobalt Hydride in H2 Activation and Catalytic Proton Reduction Chemical Science (2019) Space group: P -1 Cell volume: 2276.23 Cell parameters: 10.9745; 13.331; 17.0646; 78.527; 79.83; 69.506;

COD ID: 1550151
CIF file	Formula: - C40 H47 B Cl2 Co F4 Ni P2 S2 - Comments: Wang, Wenguang; Chu, Xiaoxiao; Jin, Jihao; Ming, Bangrong; Pang, Maofu; Yu, Xin; Tung, Chen-Ho Bimetallic Nickel-Cobalt Hydride in H2 Activation and Catalytic Proton Reduction Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 4237.04 Cell parameters: 12.9111; 20.1158; 16.543; 90; 99.543; 90;

COD ID: 1550152
CIF file	Formula: - C39 H45 Co Ni P2 S2 - Comments: Wang, Wenguang; Chu, Xiaoxiao; Jin, Jihao; Ming, Bangrong; Pang, Maofu; Yu, Xin; Tung, Chen-Ho Bimetallic Nickel-Cobalt Hydride in H2 Activation and Catalytic Proton Reduction Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 3579.53 Cell parameters: 12.4735; 15.403; 19.4262; 90; 106.452; 90;

COD ID: 1550153
CIF file	Formula: - C49 H60 B2 Co F8 N5 Ni P2 S2 - Comments: Wang, Wenguang; Chu, Xiaoxiao; Jin, Jihao; Ming, Bangrong; Pang, Maofu; Yu, Xin; Tung, Chen-Ho Bimetallic Nickel-Cobalt Hydride in H2 Activation and Catalytic Proton Reduction Chemical Science (2019) Space group: P c a 21 Cell volume: 5371.4 Cell parameters: 21.9622; 11.6996; 20.9046; 90; 90; 90;

COD ID: 1550154
CIF file	Formula: - C124 H56 Lu2 N4 Ni S0 - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 5743.5 Cell parameters: 23.1698; 13.7779; 18.0308; 90; 93.776; 90;

COD ID: 1550155
CIF file	Formula: - C126 H56 Lu2 N4 Ni - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 7404 Cell parameters: 25.274; 14.939; 19.653; 90; 93.796; 90;

COD ID: 1550156
CIF file	Formula: - C126 H50 Lu2 N4 Ni - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 7623 Cell parameters: 25.41; 15.11; 19.917; 90; 94.51; 90;

COD ID: 1550157
CIF file	Formula: - C130 H50 Lu2 N4 Ni - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: P -1 Cell volume: 3846 Cell parameters: 14.604; 15.012; 19.852; 85.556; 88.966; 62.445;

COD ID: 1550158
CIF file	Formula: - C136 H53.6 Lu2 N4 Ni S0.8 - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: P -1 Cell volume: 3899 Cell parameters: 14.749; 15.029; 19.899; 84.624; 88.62; 62.644;

COD ID: 1550159
CIF file	Formula: - C292 H144 Lu4 N12 Ni3 - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 9632 Cell parameters: 24.454; 18.039; 22.303; 90; 101.767; 90;

COD ID: 1550160
CIF file	Formula: - C128 H56 Lu2 N4 Ni - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 7470 Cell parameters: 25.186; 15.099; 19.694; 90; 94.158; 90;

COD ID: 1550161
CIF file	Formula: - C296 H144 Lu6 N14 Ni3 - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 9927 Cell parameters: 24.634; 17.744; 23.328; 90; 103.22; 90;

COD ID: 1550162
CIF file	Formula: - C136 H56 Lu2 N4 Ni S0 - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 8115 Cell parameters: 24.121; 18.19; 18.497; 90; 90.466; 90;

COD ID: 1550163
CIF file	Formula: - C134 H56 Lu2 N4 Ni - Comments: Lu, Xing; Shen, Wangqiang; Bao, Lipiao; Hu, Shuaifeng; Yang, Le; Jin, Peng; Xie, Yun-Peng; Akasaka, Takeshi Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster Selection by Cage Size Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 8044 Cell parameters: 24.149; 18.02; 18.486; 90; 90.22; 90;

COD ID: 1550164
CIF file	Formula: - B4.09 Ba4 Bi2 O29 Si7.91 - Comments: Tang, Ruling; Hu, Chun-Li; Mao, Feifei; Feng, Jianghe; Mao, Jianggao Ba4Bi2(Si8-xB4+xO29)(x=0.09): A New Acentric Metal Borosilicate as Promising Nonlinear Optical Material Chemical Science (2019) Space group: I -4 2 m Cell volume: 1263.74 Cell parameters: 11.0254; 11.0254; 10.3961; 90; 90; 90;

COD ID: 1550165
CIF file	Formula: - C25 H39 Ir O2 Si - Comments: Cramer, Nicolai; Audic, Benoit; Wodrich, Matthew D. Mild complexation protocol for chiral CpxRh and Ir complexes suitable for in situ catalysis Chemical Science (2019) Space group: P 21 21 21 Cell volume: 2383.08 Cell parameters: 7.70304; 11.49824; 26.9058; 90; 90; 90;

COD ID: 1550166
CIF file	Formula: - C22 H31 Ir O2 - Comments: Cramer, Nicolai; Audic, Benoit; Wodrich, Matthew D. Mild complexation protocol for chiral CpxRh and Ir complexes suitable for in situ catalysis Chemical Science (2019) Space group: I 1 2 1 Cell volume: 1962.86 Cell parameters: 10.8334; 8.23239; 22.2298; 90; 98.0838; 90;

COD ID: 1550167
CIF file	Formula: - C17 H28 O2 Si - Comments: Cramer, Nicolai; Audic, Benoit; Wodrich, Matthew D. Mild complexation protocol for chiral CpxRh and Ir complexes suitable for in situ catalysis Chemical Science (2019) Space group: P 21 21 21 Cell volume: 1749.39 Cell parameters: 7.53335; 10.27117; 22.6089; 90; 90; 90;

COD ID: 1550168
CIF file	Formula: - C40 H43 Ir O2 Si - Comments: Cramer, Nicolai; Audic, Benoit; Wodrich, Matthew D. Mild complexation protocol for chiral CpxRh and Ir complexes suitable for in situ catalysis Chemical Science (2019) Space group: P 1 21 1 Cell volume: 3236.86 Cell parameters: 10.1531; 14.0965; 23.1228; 90; 102.019; 90;

COD ID: 1550174

Formula: - C33 H33 N3 O2 -
Comments: Das, Dipankar; Alam, Rabiul; Katarkar, Atul; Ali, Mahammad A differentially selective probe for trivalent chemosensor upon single excitation with cell imaging application: potential applications in combinatorial logic circuit and memory devices. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(1) (2019) 242-252
Space group: P -1
Cell volume: 1331.5
Cell parameters: 9.0397; 12.5823; 12.8196; 86.214; 73.428; 72.357;

COD ID: 1550175

Formula: - C25 H21 Ba N O10 -
Comments: Rought, Peter; Marsh, Christopher; Pili, Simona; Silverwood, Ian Philip; Garcia Sakai, Victoria; Li, Ming; Brown, Martyn; Argent, Stephen; Vitorica-Yrzebal, Inigo; Whitehead, George F. S.; Warren, Mark R.; Yang, Sihai; Schroder, Martin Modulating proton diffusion and conductivity in metal-organic frameworks by incorporation of accessible free carboxylic acid groups Chemical Science (2019)
Space group: P -1
Cell volume: 1200.53
Cell parameters: 7.9225; 12.5631; 14.0398; 114.96; 94.483; 104.346;

COD ID: 1550176

Formula: - C24.5 H31.5 Ba2 N0.5 O19.5 -
Comments: Rought, Peter; Marsh, Christopher; Pili, Simona; Silverwood, Ian Philip; Garcia Sakai, Victoria; Li, Ming; Brown, Martyn; Argent, Stephen; Vitorica-Yrzebal, Inigo; Whitehead, George F. S.; Warren, Mark R.; Yang, Sihai; Schroder, Martin Modulating proton diffusion and conductivity in metal-organic frameworks by incorporation of accessible free carboxylic acid groups Chemical Science (2019)
Space group: P -1
Cell volume: 1634.27
Cell parameters: 9.3111; 12.4288; 14.3649; 83.592; 85.579; 82.416;

COD ID: 1550177

Formula: - C26.5 H25.5 Ba2 N1.5 O11 -
Comments: Rought, Peter; Marsh, Christopher; Pili, Simona; Silverwood, Ian Philip; Garcia Sakai, Victoria; Li, Ming; Brown, Martyn; Argent, Stephen; Vitorica-Yrzebal, Inigo; Whitehead, George F. S.; Warren, Mark R.; Yang, Sihai; Schroder, Martin Modulating proton diffusion and conductivity in metal-organic frameworks by incorporation of accessible free carboxylic acid groups Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 2802.1
Cell parameters: 11.44352; 17.2735; 14.1871; 90; 92.302; 90;

COD ID: 1550178

Formula: - C20 H24 Cl2 N2 Ru -
Comments: Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiaochun; Jiang, Gaoxi Brønsted Acid-Catalyzed Aromatic Annulation of Alkoxyallenes with Naphthols: A Reaction Sequence to Larger π-Conjugated Naphthopyrans with Aggregation-Induced Emission Characters Chemical Science (2019)
Space group: P -1
Cell volume: 980.91
Cell parameters: 8.2597; 10.958; 12.6335; 66.777; 75.242; 70.583;

COD ID: 1550179

Formula: - C100 H121 K N4 O10 Ru4 -
Comments: Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiaochun; Jiang, Gaoxi Brønsted Acid-Catalyzed Aromatic Annulation of Alkoxyallenes with Naphthols: A Reaction Sequence to Larger π-Conjugated Naphthopyrans with Aggregation-Induced Emission Characters Chemical Science (2019)
Space group: P -1
Cell volume: 2194.55
Cell parameters: 9.3201; 15.1082; 17.7752; 110.273; 96.128; 106.322;

COD ID: 1550180

Formula: - C42 H40 N2 Ru2 -
Comments: Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiaochun; Jiang, Gaoxi Brønsted Acid-Catalyzed Aromatic Annulation of Alkoxyallenes with Naphthols: A Reaction Sequence to Larger π-Conjugated Naphthopyrans with Aggregation-Induced Emission Characters Chemical Science (2019)
Space group: P -1
Cell volume: 3403.4
Cell parameters: 13.4659; 14.5842; 17.9402; 83.467; 80.563; 79.39;

COD ID: 1550181

Formula: - C76 H107.92 K2 N2 O16 Ru2 -
Comments: Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiaochun; Jiang, Gaoxi Brønsted Acid-Catalyzed Aromatic Annulation of Alkoxyallenes with Naphthols: A Reaction Sequence to Larger π-Conjugated Naphthopyrans with Aggregation-Induced Emission Characters Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 7708
Cell parameters: 13.8109; 28.5059; 19.585; 90; 91.4431; 90;

COD ID: 1550182

Formula: - C42.94 H37 F3 N2 O4.5 Ru2 S -
Comments: Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiaochun; Jiang, Gaoxi Brønsted Acid-Catalyzed Aromatic Annulation of Alkoxyallenes with Naphthols: A Reaction Sequence to Larger π-Conjugated Naphthopyrans with Aggregation-Induced Emission Characters Chemical Science (2019)
Space group: P 21 21 2
Cell volume: 7889
Cell parameters: 21.316; 29.316; 12.6238; 90; 90; 90;

COD ID: 1550185
CIF file	Formula: - C14.4 H23.21 N2 Ni S2 - Comments: Yang, Xuemei; Elrod, Lindy C.; Reibenspies, Joseph; Hall, Michael B.; Darensbourg, Marcetta Y. Oxygen Uptake in Complexes Related to [NiFeS] and [NiFeSe] Hydrogenase Active Sites Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1526.32 Cell parameters: 9.613; 10.3609; 15.3479; 90; 93.156; 90;

COD ID: 1550186
CIF file	Formula: - C14 H22 N2 Ni S Se - Comments: Yang, Xuemei; Elrod, Lindy C.; Reibenspies, Joseph; Hall, Michael B.; Darensbourg, Marcetta Y. Oxygen Uptake in Complexes Related to [NiFeS] and [NiFeSe] Hydrogenase Active Sites Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1490.6 Cell parameters: 8.3021; 16.204; 11.629; 90; 107.667; 90;

COD ID: 1550187
CIF file	Formula: - C21 H30 B Cl2 F4 Fe N2 Ni O2 S Se - Comments: Yang, Xuemei; Elrod, Lindy C.; Reibenspies, Joseph; Hall, Michael B.; Darensbourg, Marcetta Y. Oxygen Uptake in Complexes Related to [NiFeS] and [NiFeSe] Hydrogenase Active Sites Chemical Science (2019) Space group: P -1 Cell volume: 1328.1 Cell parameters: 11.436; 11.886; 12.406; 108.489; 114.188; 103.182;

COD ID: 1550188
CIF file	Formula: - C20 H27 B F4 Fe N2 Ni O S Se - Comments: Yang, Xuemei; Elrod, Lindy C.; Reibenspies, Joseph; Hall, Michael B.; Darensbourg, Marcetta Y. Oxygen Uptake in Complexes Related to [NiFeS] and [NiFeSe] Hydrogenase Active Sites Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 2350.95 Cell parameters: 8.7518; 21.0078; 13.1915; 90; 104.227; 90;

COD ID: 1550189
CIF file	Formula: - C20 H27 B F4 Fe N2 Ni O S Se - Comments: Yang, Xuemei; Elrod, Lindy C.; Reibenspies, Joseph; Hall, Michael B.; Darensbourg, Marcetta Y. Oxygen Uptake in Complexes Related to [NiFeS] and [NiFeSe] Hydrogenase Active Sites Chemical Science (2019) Space group: P b c a Cell volume: 4628.8 Cell parameters: 16.309; 11.4239; 24.8441; 90; 90; 90;

COD ID: 1550190
CIF file	Formula: - C20 H27 B0.78 Cl0.22 F3.13 Fe N2 Ni O S2 - Comments: Yang, Xuemei; Elrod, Lindy C.; Reibenspies, Joseph; Hall, Michael B.; Darensbourg, Marcetta Y. Oxygen Uptake in Complexes Related to [NiFeS] and [NiFeSe] Hydrogenase Active Sites Chemical Science (2019) Space group: P b c a Cell volume: 4574.8 Cell parameters: 16.2504; 11.3127; 24.8851; 90; 90; 90;

COD ID: 1550191
CIF file	Formula: - C52 H56 Co N5 Ni - Comments: Chang, Mu-Chieh; Jesse, Kate A.; Filatov, Alexander S.; Anderson, John S. Reversible Homolytic Activation of Water via Metal-Ligand Cooperativity in a T-Shaped Ni(II) Complex Chemical Science (2019) Space group: P 1 c 1 Cell volume: 2167.1 Cell parameters: 11.6597; 16.9613; 12.2584; 90; 116.63; 90;

COD ID: 1550192
CIF file	Formula: - C135 H111 N20 Ni4 - Comments: Chang, Mu-Chieh; Jesse, Kate A.; Filatov, Alexander S.; Anderson, John S. Reversible Homolytic Activation of Water via Metal-Ligand Cooperativity in a T-Shaped Ni(II) Complex Chemical Science (2019) Space group: C 1 2 1 Cell volume: 5448.6 Cell parameters: 28.6944; 7.3064; 28.2539; 90; 113.099; 90;

COD ID: 1550193
CIF file	Formula: - C45 H48 N6 Ni O2 - Comments: Chang, Mu-Chieh; Jesse, Kate A.; Filatov, Alexander S.; Anderson, John S. Reversible Homolytic Activation of Water via Metal-Ligand Cooperativity in a T-Shaped Ni(II) Complex Chemical Science (2019) Space group: P -1 Cell volume: 1908.9 Cell parameters: 11.8068; 13.0124; 13.3226; 71.802; 84.699; 79.232;

COD ID: 1550194
CIF file	Formula: - C37 H31 N6 Ni - Comments: Chang, Mu-Chieh; Jesse, Kate A.; Filatov, Alexander S.; Anderson, John S. Reversible Homolytic Activation of Water via Metal-Ligand Cooperativity in a T-Shaped Ni(II) Complex Chemical Science (2019) Space group: P -1 Cell volume: 1535.01 Cell parameters: 10.8266; 12.1078; 12.8979; 91.267; 114.454; 93.084;

COD ID: 1550195
CIF file	Formula: - C64 H54 N10 Ni2 O - Comments: Chang, Mu-Chieh; Jesse, Kate A.; Filatov, Alexander S.; Anderson, John S. Reversible Homolytic Activation of Water via Metal-Ligand Cooperativity in a T-Shaped Ni(II) Complex Chemical Science (2019) Space group: P -1 Cell volume: 6138.6 Cell parameters: 12.0657; 23.067; 23.079; 76.493; 81.913; 81.444;

COD ID: 1550196
CIF file	Formula: - C32 H48 Cl2 Fe7 N52 O8 - Comments: Alexandropoulos, Dimitris I.; Vignesh, Kuduva R.; Stamatatos, Theocharis; Dunbar, Kim R. Rare “Janus”-Faced {FeII7} Single-Molecule Magnet Exhibiting Intramolecular Ferromagnetic Interactions Chemical Science (2019) Space group: P -1 Cell volume: 1888.2 Cell parameters: 11.4046; 12.5476; 13.4127; 93.108; 94.573; 98.46;

COD ID: 1550201
CIF file	Formula: - C27 H36 N Sc Si2 - Comments: Liu, Bo; Wang, Lingfang; Wu, Chunji; Cui, Dongmei Sequence-controlled ethylene/styrene copolymerization catalyzed by scandium complexes Polymer Chemistry 10(2) (2019) 235 Space group: P 21 21 21 Cell volume: 2771.3 Cell parameters: 10.299; 15.4938; 17.3672; 90; 90; 90;

COD ID: 1550202

Formula: - C100 H158 Ag10 N70 O60 -
Comments: Linares, Fátima; Garcia-Fernandez, Emilio; López-Garzón, F Javier; Domingo-Garcia, Maria; Orte, Angel; Rodríguez Diéguez, Antonio; Galindo Cuesta, Miguel Angel Multifunctional Behavior of Molecules Comprising Stacked Cytosine-AgI-Cytosine Base Pairs; Towards Conducting and Photoluminescence Silver-DNA Nanowires Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 15626.8
Cell parameters: 25.5741; 26.2813; 24.8077; 90; 110.412; 90;

COD ID: 1550203

Formula: - C80 H112 Ag8 B8 F32 N48 O16 -
Comments: Linares, Fátima; Garcia-Fernandez, Emilio; López-Garzón, F Javier; Domingo-Garcia, Maria; Orte, Angel; Rodríguez Diéguez, Antonio; Galindo Cuesta, Miguel Angel Multifunctional Behavior of Molecules Comprising Stacked Cytosine-AgI-Cytosine Base Pairs; Towards Conducting and Photoluminescence Silver-DNA Nanowires Chemical Science (2019)
Space group: P 21 21 21
Cell volume: 12844.8
Cell parameters: 21.799; 22.6096; 26.0615; 90; 90; 90;

COD ID: 1550204

Formula: - C80 H112 Ag8 Cl8 N48 O48 -
Comments: Linares, Fátima; Garcia-Fernandez, Emilio; López-Garzón, F Javier; Domingo-Garcia, Maria; Orte, Angel; Rodríguez Diéguez, Antonio; Galindo Cuesta, Miguel Angel Multifunctional Behavior of Molecules Comprising Stacked Cytosine-AgI-Cytosine Base Pairs; Towards Conducting and Photoluminescence Silver-DNA Nanowires Chemical Science (2019)
Space group: P 21 21 21
Cell volume: 13126.5
Cell parameters: 21.9528; 22.8449; 26.174; 90; 90; 90;

COD ID: 1550206
CIF file	Formula: - C10 H28 I4 N2 Pb - Comments: Li, Tianyang; Dunlap-Shohl, Wiley; Reinheimer, Eric W.; LeMagueres, Pierre; Mitzi, David B. Melting Temperature Suppression of Layered Hybrid Lead Halide Perovskites via Organic Ammonium Cation Branching Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1144.85 Cell parameters: 15.0424; 9.2398; 8.5756; 90; 106.155; 90;

COD ID: 1550207
CIF file	Formula: - C8 H26 I4 N2 Pb - Comments: Li, Tianyang; Dunlap-Shohl, Wiley; Reinheimer, Eric W.; LeMagueres, Pierre; Mitzi, David B. Melting Temperature Suppression of Layered Hybrid Lead Halide Perovskites via Organic Ammonium Cation Branching Chemical Science (2019) Space group: P 42/n c m Cell volume: 1993.08 Cell parameters: 8.9353; 8.9353; 24.9636; 90; 90; 90;

COD ID: 1550208
CIF file	Formula: - C16 H40 I4 N2 Pb - Comments: Li, Tianyang; Dunlap-Shohl, Wiley; Reinheimer, Eric W.; LeMagueres, Pierre; Mitzi, David B. Melting Temperature Suppression of Layered Hybrid Lead Halide Perovskites via Organic Ammonium Cation Branching Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1456.53 Cell parameters: 18.6958; 8.8497; 8.8421; 90; 95.3669; 90;

COD ID: 1550209
CIF file	Formula: - C14 H36 I4 N2 Pb - Comments: Li, Tianyang; Dunlap-Shohl, Wiley; Reinheimer, Eric W.; LeMagueres, Pierre; Mitzi, David B. Melting Temperature Suppression of Layered Hybrid Lead Halide Perovskites via Organic Ammonium Cation Branching Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1350.06 Cell parameters: 17.4586; 9.2513; 8.5864; 90; 103.223; 90;

COD ID: 1550210

Formula: - C25 H22 B F2 N O4 -
Comments: Louis, Marine; Sethy, Ramarani; Kumar, Jatish; Katao, Shouhei; Guillot, Régis; Nakashima, Takuya; Allain, Clémence; Kawai, Tsuyoshi; Métivier, Rémi Mechano-responsive circularly polarized luminescence of organic solid-state chiral emitters Chemical Science (2019)
Space group: P 1 21 1
Cell volume: 1072.31
Cell parameters: 5.3887; 13.7558; 14.4712; 90; 91.531; 90;

COD ID: 1550211

Formula: - C23 H26 B F2 N O4 -
Comments: Louis, Marine; Sethy, Ramarani; Kumar, Jatish; Katao, Shouhei; Guillot, Régis; Nakashima, Takuya; Allain, Clémence; Kawai, Tsuyoshi; Métivier, Rémi Mechano-responsive circularly polarized luminescence of organic solid-state chiral emitters Chemical Science (2019)
Space group: P 1
Cell volume: 2166.2
Cell parameters: 10.235; 10.796; 20.224; 92.916; 103.825; 90.9;

COD ID: 1550212

Formula: - C69.5 H32 N2 O36 Zr6 -
Comments: Lyu, Jiafei; Zhang, Xuan; Otake, Ken-ichi; Wang, Xingjie; Li, Peng; Li, Zhanyong; Chen, Zhijie; Zhang, Yuanyuan; Wasson, Megan C.; Yang, Ying; Bai, Peng; Guo, Xianghai; Islamoglu, Timur; Farha, Omar K. Topology and Porosity Control of Metal‒Organic Frameworks through Linker Functionalization Chemical Science (2019)
Space group: P 1 2/m 1
Cell volume: 4218.3
Cell parameters: 19.6381; 12.631; 19.6354; 90; 119.994; 90;

COD ID: 1550213

Formula: - C69 H32 Br4 O32 Zr6 -
Comments: Lyu, Jiafei; Zhang, Xuan; Otake, Ken-ichi; Wang, Xingjie; Li, Peng; Li, Zhanyong; Chen, Zhijie; Zhang, Yuanyuan; Wasson, Megan C.; Yang, Ying; Bai, Peng; Guo, Xianghai; Islamoglu, Timur; Farha, Omar K. Topology and Porosity Control of Metal‒Organic Frameworks through Linker Functionalization Chemical Science (2019)
Space group: P 6/m m m
Cell volume: 16538.4
Cell parameters: 39.5745; 39.5745; 12.1936; 90; 90; 120;

COD ID: 1550214

Formula: - C70 H106 Co2 N4 O -
Comments: Roy, Lisa; Al-Afyouni, Malik H.; DeRosha, Daniel E.; Mondal, Bhaskar; DiMucci, Ida M.; Lancaster, Kyle M.; Shearer, Jason; Bill, Eckhard; Brennessel, William W.; Neese, Frank; Ye, Shengfa; Holland, Patrick L. Reduction of CO2 by a masked two-coordinate cobalt(i) complex and characterization of a proposed oxodicobalt(ii) intermediate Chemical Science (2019)
Space group: P -1
Cell volume: 7059.9
Cell parameters: 13.4757; 21.712; 25.061; 95.195; 102.214; 97.097;

COD ID: 1550215

Formula: - C71 H106 Co2 N4 O3 -
Comments: Roy, Lisa; Al-Afyouni, Malik H.; DeRosha, Daniel E.; Mondal, Bhaskar; DiMucci, Ida M.; Lancaster, Kyle M.; Shearer, Jason; Bill, Eckhard; Brennessel, William W.; Neese, Frank; Ye, Shengfa; Holland, Patrick L. Reduction of CO2 by a masked two-coordinate cobalt(i) complex and characterization of a proposed oxodicobalt(ii) intermediate Chemical Science (2019)
Space group: C 1 c 1
Cell volume: 13152
Cell parameters: 20.919; 28.234; 24.42; 90; 114.237; 90;

COD ID: 1550218
CIF file	Formula: - C44 H36 D24 Mo2 O12 S4 - Comments: Knöfel, Nicolai D.; Rothfuss, Hannah; Barner-Kowollik, Christopher; Roesky, Peter W. M24+ paddlewheel clusters as junction points in single-chain nanoparticles Polymer Chemistry 10(1) (2019) 86 Space group: P -1 Cell volume: 1260.8 Cell parameters: 10.066; 11.5; 12.806; 67.91; 88.31; 67.8;

COD ID: 1550219
CIF file	Formula: - C44 H60 Cu2 O12 S4 - Comments: Knöfel, Nicolai D.; Rothfuss, Hannah; Barner-Kowollik, Christopher; Roesky, Peter W. M24+ paddlewheel clusters as junction points in single-chain nanoparticles Polymer Chemistry 10(1) (2019) 86 Space group: P n a 21 Cell volume: 4947.5 Cell parameters: 14.0648; 22.4851; 15.6445; 90; 90; 90;

COD ID: 1550220

Formula: - C19 H17 N O -
Comments: Liu, Rai-Shung; Singh, RahulKumar Rajmani; Skaria, Manisha; Chen, Liang-Yu; Cheng, Mu-Jeng Gold-catalyzed (4+3)-Annulations of 2-Alkenyl-1-Alkynylbenzenes with Anthranils with Alkyne-Dependent Chemoselectivity: Skeletal Rearrangement versus Non-Rearrangement Chemical Science (2019)
Space group: P 21 21 21
Cell volume: 1429.85
Cell parameters: 6.2744; 14.5625; 15.6489; 90; 90; 90;

COD ID: 1550221

Formula: - C28 H26 N2 O2 -
Comments: Liu, Rai-Shung; Singh, RahulKumar Rajmani; Skaria, Manisha; Chen, Liang-Yu; Cheng, Mu-Jeng Gold-catalyzed (4+3)-Annulations of 2-Alkenyl-1-Alkynylbenzenes with Anthranils with Alkyne-Dependent Chemoselectivity: Skeletal Rearrangement versus Non-Rearrangement Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 4499.3
Cell parameters: 21.9831; 13.325; 16.5868; 90; 112.177; 90;

COD ID: 1550222

Formula: - C27 H28 N2 O2 -
Comments: Liu, Rai-Shung; Singh, RahulKumar Rajmani; Skaria, Manisha; Chen, Liang-Yu; Cheng, Mu-Jeng Gold-catalyzed (4+3)-Annulations of 2-Alkenyl-1-Alkynylbenzenes with Anthranils with Alkyne-Dependent Chemoselectivity: Skeletal Rearrangement versus Non-Rearrangement Chemical Science (2019)
Space group: P -1
Cell volume: 1056.9
Cell parameters: 7.5024; 9.4863; 15.949; 93.783; 95.871; 109.707;

COD ID: 1550223

Formula: - C27 H25 N2 O -
Comments: Liu, Rai-Shung; Singh, RahulKumar Rajmani; Skaria, Manisha; Chen, Liang-Yu; Cheng, Mu-Jeng Gold-catalyzed (4+3)-Annulations of 2-Alkenyl-1-Alkynylbenzenes with Anthranils with Alkyne-Dependent Chemoselectivity: Skeletal Rearrangement versus Non-Rearrangement Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 2076.34
Cell parameters: 9.3848; 17.3334; 12.7967; 90; 94.091; 90;

COD ID: 1550224
CIF file	Formula: - C80 H140 K4 N4 O8 Si4 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 8947.5 Cell parameters: 17.2292; 21.1408; 24.5871; 90; 92.4269; 90;

COD ID: 1550225
CIF file	Formula: - C80 H140 K4 N4 O14 Si4 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P -1 Cell volume: 2274.16 Cell parameters: 11.7068; 13.9065; 14.2431; 93.271; 99.115; 95.176;

COD ID: 1550226
CIF file	Formula: - C28 H46 Cl2 In K N2 O Si2 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: I 1 2/a 1 Cell volume: 6836.1 Cell parameters: 18.8952; 13.1861; 27.8641; 90; 100.042; 90;

COD ID: 1550227
CIF file	Formula: - C31 H49 Cl2 In K N2 O Si2 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: I 1 2/a 1 Cell volume: 7272.86 Cell parameters: 18.7078; 13.15883; 30.1739; 90; 101.73; 90;

COD ID: 1550228
CIF file	Formula: - C36 H66 K2 N2 O3 Si2 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P -1 Cell volume: 2112.72 Cell parameters: 10.0422; 11.962; 17.7445; 93.171; 96.478; 92.102;

COD ID: 1550229
CIF file	Formula: - C59 H99 In2 K2 N4 O2 Si4 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: I 1 2/a 1 Cell volume: 13913.9 Cell parameters: 23.2852; 17.27697; 36.472; 90; 108.506; 90;

COD ID: 1550230
CIF file	Formula: - C55 H93 In K N5 O7 Si2 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P -1 Cell volume: 3039.06 Cell parameters: 12.5559; 13.5443; 18.8336; 75.5576; 81.034; 80.79;

COD ID: 1550231
CIF file	Formula: - C102 H146 In2 K2 N6 O2 Si4 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 10280.8 Cell parameters: 23.6145; 17.0543; 25.7456; 90; 97.4553; 90;

COD ID: 1550232
CIF file	Formula: - C71 H87 In K N3 O Si2 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 6322.38 Cell parameters: 12.6009; 25.6091; 19.60255; 90; 91.8549; 90;

COD ID: 1550233
CIF file	Formula: - C72 H108 In K N6 O7 Si2 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 7363.24 Cell parameters: 14.16789; 26.894; 19.8817; 90; 103.597; 90;

COD ID: 1550234
CIF file	Formula: - C94 H148 In2 K2 N12 O2 Si6 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: P -1 Cell volume: 5180.4 Cell parameters: 17.0589; 18.1114; 18.1867; 69.847; 89.715; 79.713;

COD ID: 1550235
CIF file	Formula: - C120 H168 In2 K2 N12 O2 Si4 - Comments: Anker, Mathew; Lein, Matthias; Coles, Martyn P. Reduction of Organic Azides by Indyl-Anions. Isolation and Reactivity Studies of Indium-Nitrogen Multiple Bonds Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 11783.7 Cell parameters: 31.129; 12.5964; 30.835; 90; 102.941; 90;

COD ID: 1550238

Formula: - C20 H24 Cl2 N2 Ru -
Comments: Yang, Xiuxiu; Gianetti, Thomas L.; Wörle, Michael D.; van Leest, Nicolaas P.; de Bruin, Bas; Grützmacher, Hansjörg A low-valent dinuclear ruthenium diazadiene complex catalyzes the oxidation of dihydrogen and reversible hydrogenation of quinones Chemical Science (2019)
Space group: P -1
Cell volume: 980.91
Cell parameters: 8.2597; 10.958; 12.6335; 66.777; 75.242; 70.583;

COD ID: 1550239

Formula: - C100 H121 K N4 O10 Ru4 -
Comments: Yang, Xiuxiu; Gianetti, Thomas L.; Wörle, Michael D.; van Leest, Nicolaas P.; de Bruin, Bas; Grützmacher, Hansjörg A low-valent dinuclear ruthenium diazadiene complex catalyzes the oxidation of dihydrogen and reversible hydrogenation of quinones Chemical Science (2019)
Space group: P -1
Cell volume: 2194.55
Cell parameters: 9.3201; 15.1082; 17.7752; 110.273; 96.128; 106.322;

COD ID: 1550240

Formula: - C42 H40 N2 Ru2 -
Comments: Yang, Xiuxiu; Gianetti, Thomas L.; Wörle, Michael D.; van Leest, Nicolaas P.; de Bruin, Bas; Grützmacher, Hansjörg A low-valent dinuclear ruthenium diazadiene complex catalyzes the oxidation of dihydrogen and reversible hydrogenation of quinones Chemical Science (2019)
Space group: P -1
Cell volume: 3403.4
Cell parameters: 13.4659; 14.5842; 17.9402; 83.467; 80.563; 79.39;

COD ID: 1550241

Formula: - C76 H107.92 K2 N2 O16 Ru2 -
Comments: Yang, Xiuxiu; Gianetti, Thomas L.; Wörle, Michael D.; van Leest, Nicolaas P.; de Bruin, Bas; Grützmacher, Hansjörg A low-valent dinuclear ruthenium diazadiene complex catalyzes the oxidation of dihydrogen and reversible hydrogenation of quinones Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 7708
Cell parameters: 13.8109; 28.5059; 19.585; 90; 91.4431; 90;

COD ID: 1550242

Formula: - C42.94 H37 F3 N2 O4.5 Ru2 S -
Comments: Yang, Xiuxiu; Gianetti, Thomas L.; Wörle, Michael D.; van Leest, Nicolaas P.; de Bruin, Bas; Grützmacher, Hansjörg A low-valent dinuclear ruthenium diazadiene complex catalyzes the oxidation of dihydrogen and reversible hydrogenation of quinones Chemical Science (2019)
Space group: P 21 21 2
Cell volume: 7889
Cell parameters: 21.316; 29.316; 12.6238; 90; 90; 90;

COD ID: 1550243

Formula: - C9 H12 Hg2 I4 N4 S2 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: C 1 2/c 1
Cell volume: 4278.9
Cell parameters: 38.111; 7.4534; 16.3979; 90; 113.273; 90;

COD ID: 1550244

Formula: - C22 H36 Cl4 Hg2 N8 O2 S6 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: C 1 2/m 1
Cell volume: 1906.3
Cell parameters: 17.9245; 12.3888; 10.6773; 90; 126.485; 90;

COD ID: 1550245

Formula: - C15 H20 N4 O4 S2 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: C 1 2/c 1
Cell volume: 1744.3
Cell parameters: 7.2921; 7.8235; 30.636; 90; 93.61; 90;

COD ID: 1550246

Formula: - C18 H24 Br4 Hg2 N8 S4 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: C 1 2/m 1
Cell volume: 1918.9
Cell parameters: 17.7977; 12.295; 10.8212; 90; 125.868; 90;

COD ID: 1550247

Formula: - C10 H16 Hg2 I4 N4 S2 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: P b c a
Cell volume: 2340.94
Cell parameters: 10.1454; 15.0815; 15.2995; 90; 90; 90;

COD ID: 1550248

Formula: - C10 H16 Br2 Hg N4 S2 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: P 1 21/n 1
Cell volume: 1749.3
Cell parameters: 9.6186; 14.2021; 13.5419; 90; 108.982; 90;

COD ID: 1550249

Formula: - C15 H24 Hg2 I4 N6 S3 -
Comments: Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S1] and [S2]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science 11(1) (2019) 213-225
Space group: P 1 21/c 1
Cell volume: 3041.6
Cell parameters: 18.3607; 14.7466; 11.7959; 90; 107.761; 90;

COD ID: 1550252
CIF file	Formula: - C16 H37 N Se - Comments: Fargher, Hazel; Lau, Nathanael; Zakharov, Lev; Haley, Michael M.; Johnson, Darren; Pluth, Michael D. Expanding Reversible Chalcogenide Binding: Supramolecular Receptors for the Hydroselenide (HSe‒) Anion Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 3691.9 Cell parameters: 14.1628; 14.0547; 19.8443; 90; 110.832; 90;

COD ID: 1550253
CIF file	Formula: - C36 H31 F18 N4 O3 - Comments: Fargher, Hazel; Lau, Nathanael; Zakharov, Lev; Haley, Michael M.; Johnson, Darren; Pluth, Michael D. Expanding Reversible Chalcogenide Binding: Supramolecular Receptors for the Hydroselenide (HSe‒) Anion Chemical Science (2019) Space group: P -1 Cell volume: 4030.4 Cell parameters: 13.8015; 18.0488; 18.1383; 103.008; 102.996; 105.924;

COD ID: 1550254
CIF file	Formula: - C74 H111 N5 O6 Se - Comments: Fargher, Hazel; Lau, Nathanael; Zakharov, Lev; Haley, Michael M.; Johnson, Darren; Pluth, Michael D. Expanding Reversible Chalcogenide Binding: Supramolecular Receptors for the Hydroselenide (HSe‒) Anion Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 7566.4 Cell parameters: 9.5547; 30.3155; 26.1228; 90; 90.476; 90;

COD ID: 1550255
CIF file	Formula: - C14 H21 B N2 O2 - Comments: Radcliffe, James; Fasano, Valerio; Adams, Ralph W.; You, Peiran; Ingleson, Michael James Reductive α-borylation of α,β-unsaturated esters using NHC-BH3 activated by I2 as a metal-free route to α-boryl esters. Chemical Science (2019) Space group: I 1 2/a 1 Cell volume: 2857.09 Cell parameters: 22.1499; 7.8915; 17.5288; 90; 111.175; 90;

COD ID: 1550256
CIF file	Formula: - C10 H19 B N2 O2 - Comments: Radcliffe, James; Fasano, Valerio; Adams, Ralph W.; You, Peiran; Ingleson, Michael James Reductive α-borylation of α,β-unsaturated esters using NHC-BH3 activated by I2 as a metal-free route to α-boryl esters. Chemical Science (2019) Space group: P 1 21 1 Cell volume: 606.2 Cell parameters: 6.6119; 12.8257; 7.7086; 90; 111.978; 90;

COD ID: 1550257
CIF file	Formula: - C30 H41 B N2 O2 - Comments: Radcliffe, James; Fasano, Valerio; Adams, Ralph W.; You, Peiran; Ingleson, Michael James Reductive α-borylation of α,β-unsaturated esters using NHC-BH3 activated by I2 as a metal-free route to α-boryl esters. Chemical Science (2019) Space group: P 1 21 1 Cell volume: 1350.08 Cell parameters: 9.1072; 15.5083; 9.6094; 90; 95.872; 90;

COD ID: 1550258
CIF file	Formula: - C10 H17 B F2 N2 O2 - Comments: Radcliffe, James; Fasano, Valerio; Adams, Ralph W.; You, Peiran; Ingleson, Michael James Reductive α-borylation of α,β-unsaturated esters using NHC-BH3 activated by I2 as a metal-free route to α-boryl esters. Chemical Science (2019) Space group: P 1 21 1 Cell volume: 621.28 Cell parameters: 6.6658; 13.0852; 7.7113; 90; 112.529; 90;

COD ID: 1550259
CIF file	Formula: - C9 H15 B N2 O2 - Comments: Radcliffe, James; Fasano, Valerio; Adams, Ralph W.; You, Peiran; Ingleson, Michael James Reductive α-borylation of α,β-unsaturated esters using NHC-BH3 activated by I2 as a metal-free route to α-boryl esters. Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 1040.91 Cell parameters: 8.6843; 10.1231; 12.0573; 90; 100.885; 90;

COD ID: 1550260
CIF file	Formula: - C24 H37 B N2 O2 - Comments: Radcliffe, James; Fasano, Valerio; Adams, Ralph W.; You, Peiran; Ingleson, Michael James Reductive α-borylation of α,β-unsaturated esters using NHC-BH3 activated by I2 as a metal-free route to α-boryl esters. Chemical Science (2019) Space group: P 21 21 21 Cell volume: 2445.13 Cell parameters: 11.9618; 13.0959; 15.6088; 90; 90; 90;

COD ID: 1550261

Formula: - C92 H168 Na O43 Ti8 -
Comments: Saouma, Caroline T.; Tsou, Chih-Chin; Richard, Sarah; Ameloot, Rob; Vermoortele, Frederik; Smolders, Simon; Bueken, Bart; Valdez, Carolyn; DiPasquale, Antonio; Kaminsky, Werner; De Vos, Dirk; Mayer, James M. Sodium-Coupled Electron Transfer Reactivity of Metal-Organic Frameworks Containing Titanium Clusters: The Importance of Cations in Redox Chemistry Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 13022
Cell parameters: 24.83; 16.876; 31.391; 90; 98.121; 90;

COD ID: 1550262

Formula: - C124 H210 Co N12 O40 Ti8 -
Comments: Saouma, Caroline T.; Tsou, Chih-Chin; Richard, Sarah; Ameloot, Rob; Vermoortele, Frederik; Smolders, Simon; Bueken, Bart; Valdez, Carolyn; DiPasquale, Antonio; Kaminsky, Werner; De Vos, Dirk; Mayer, James M. Sodium-Coupled Electron Transfer Reactivity of Metal-Organic Frameworks Containing Titanium Clusters: The Importance of Cations in Redox Chemistry Chemical Science (2019)
Space group: P 4/n c c
Cell volume: 14725.5
Cell parameters: 19.6778; 19.6778; 38.0292; 90; 90; 90;

COD ID: 1550263
CIF file	Formula: - C123 H135 F3 N4 O10 - Comments: Milton, Margarita; Schuster, Nathaniel J.; Paley, Daniel W.; Hernández Sánchez, Raúl; Ng, Fay; Steigerwald, Michael L.; Nuckolls, Colin Defying strain in the synthesis of an electroactive bilayer helicene Chemical Science (2019) Space group: P -1 Cell volume: 4968.5 Cell parameters: 16.011; 17.232; 19.864; 68.468; 77.568; 82.152;

COD ID: 1550264
CIF file	Formula: - C113 H118 N4 O9 - Comments: Milton, Margarita; Schuster, Nathaniel J.; Paley, Daniel W.; Hernández Sánchez, Raúl; Ng, Fay; Steigerwald, Michael L.; Nuckolls, Colin Defying strain in the synthesis of an electroactive bilayer helicene Chemical Science (2019) Space group: P -1 Cell volume: 4456.7 Cell parameters: 15.2191; 16.2207; 19.6692; 75.736; 74.285; 76.47;

COD ID: 1550265
CIF file	Formula: - C38 H60 Mo13 N10 O34 - Comments: Luo, Benlong; Sang, Rui-LI; Lin, Lifang; Xu, Li Mo3IV-Polyoxomolybdates with Frustrated Lewis Pairs For High-Performance Hydrogenation Catalysis Catalysis Science & Technology (2019) Space group: C m c m Cell volume: 7774 Cell parameters: 24.715; 23.137; 13.595; 90; 90; 90;

COD ID: 1550266
CIF file	Formula: - C72 H36 Cu1.5 N6 O26 Zr6 - Comments: Yu, Chung Jui; Krzyaniak, Matthew D.; Fataftah, Majed S.; Wasielewski, Michael R.; Freedman, Danna A Concentrated Array of Copper Porphyrin Candidate Qubits Chemical Science (2019) Space group: I m -3 m Cell volume: 56853.4 Cell parameters: 38.452; 38.452; 38.452; 90; 90; 90;

COD ID: 1550267

Formula: - C11 H16 Br2 Cu2 N4 -
Comments: Wang, Rong-Yan; Zhang, Xiao; Yu, Jie-Hui; Xu, Ji-Qing Copper(i)-polymers and their photoluminescence thermochromism properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(2) (2019) 477-486
Space group: P n n 2
Cell volume: 1601.6
Cell parameters: 17.5605; 9.4899; 9.611; 90; 90; 90;

COD ID: 1550268

Formula: - C4 H5 Cu I N -
Comments: Wang, Rong-Yan; Zhang, Xiao; Yu, Jie-Hui; Xu, Ji-Qing Copper(i)-polymers and their photoluminescence thermochromism properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(2) (2019) 477-486
Space group: P b c n
Cell volume: 1172.04
Cell parameters: 4.2749; 16.1161; 17.0121; 90; 90; 90;

COD ID: 1550269

Formula: - C18 H14 Cu I N4 -
Comments: Wang, Rong-Yan; Zhang, Xiao; Yu, Jie-Hui; Xu, Ji-Qing Copper(i)-polymers and their photoluminescence thermochromism properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(2) (2019) 477-486
Space group: P 1 21/n 1
Cell volume: 1691.8
Cell parameters: 10.0197; 7.6791; 22.4578; 90; 101.735; 90;

COD ID: 1550270

Formula: - C11 H16 Br2 Cu2 N4 -
Comments: Wang, Rong-Yan; Zhang, Xiao; Yu, Jie-Hui; Xu, Ji-Qing Copper(i)-polymers and their photoluminescence thermochromism properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(2) (2019) 477-486
Space group: P n n 2
Cell volume: 1616.24
Cell parameters: 17.6696; 9.5533; 9.5747; 90; 90; 90;

COD ID: 1550271
CIF file	Formula: - C56 H48 Au O4 P S4 - Comments: McGuire, Jake; Miras, Haralampos; Richards, Emma; Sproules, Stephen Enabling Single Qubit Addressability in a Molecular Semiconductor Comprising Gold-Supported Organic Radicals Chemical Science (2019) Space group: P -1 Cell volume: 2466.5 Cell parameters: 11.913; 13.949; 15.859; 81.424; 72.882; 79.945;

COD ID: 1550272
CIF file	Formula: - C33 H28 Au Cl2 O4 S4 - Comments: McGuire, Jake; Miras, Haralampos; Richards, Emma; Sproules, Stephen Enabling Single Qubit Addressability in a Molecular Semiconductor Comprising Gold-Supported Organic Radicals Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1649.3 Cell parameters: 11.584; 15.448; 9.441; 90; 102.511; 90;

COD ID: 1550279

Formula: - C20 H32 Cl4 Co2 N4 S2 -
Comments: Puylaert, Pim; Dell'Acqua, Andrea; El Ouahabi, Fatima; Spannenberg, Anke; Roisnel, Thierry; Lefort, Laurent; Hinze, Sandra; Tin, Sergey; de Vries, Johannes G. Phosphine-Free Pincer Cobalt Catalyst Precursors for the Selective Hydrogenation of Olefins Catalysis Science & Technology (2019)
Space group: P -1
Cell volume: 1362.03
Cell parameters: 7.6862; 11.1085; 17.7851; 72.8236; 88.0499; 70.2746;

COD ID: 1550280

Formula: - C11 H18 Cl2 Co N2 S -
Comments: Puylaert, Pim; Dell'Acqua, Andrea; El Ouahabi, Fatima; Spannenberg, Anke; Roisnel, Thierry; Lefort, Laurent; Hinze, Sandra; Tin, Sergey; de Vries, Johannes G. Phosphine-Free Pincer Cobalt Catalyst Precursors for the Selective Hydrogenation of Olefins Catalysis Science & Technology (2019)
Space group: P -1
Cell volume: 713.18
Cell parameters: 7.0681; 9.014; 12.2372; 108.21; 98.899; 99.291;

COD ID: 1550281
CIF file	Formula: - C46 H39 B F24 Fe N O3 P2 - Comments: Chambers, Geoffrey M.; Johnson, Samantha I.; Raugei, Simone; Bullock, R. Morris Anion control of tautomeric equilibria: Fe‒H vs. N‒H influenced by NH⋯F hydrogen bonding Chemical Science (2019) Space group: P -1 Cell volume: 5297.1 Cell parameters: 12.4386; 19.8125; 23.4119; 67.1494; 86.3179; 85.5446;

COD ID: 1550282
CIF file	Formula: - C16 H29 F6 Fe N O9 P2 S2 - Comments: Chambers, Geoffrey M.; Johnson, Samantha I.; Raugei, Simone; Bullock, R. Morris Anion control of tautomeric equilibria: Fe‒H vs. N‒H influenced by NH⋯F hydrogen bonding Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 2682.8 Cell parameters: 16.081; 11.2301; 15.4862; 90; 106.408; 90;

COD ID: 1550283
CIF file	Formula: - C38 H28 B F20 Fe N O3 P2 - Comments: Chambers, Geoffrey M.; Johnson, Samantha I.; Raugei, Simone; Bullock, R. Morris Anion control of tautomeric equilibria: Fe‒H vs. N‒H influenced by NH⋯F hydrogen bonding Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 4058.3 Cell parameters: 10.343; 23.935; 16.484; 90; 96.014; 90;

COD ID: 1550284
CIF file	Formula: - C14 H28 B F4 Fe N O3 P2 - Comments: Chambers, Geoffrey M.; Johnson, Samantha I.; Raugei, Simone; Bullock, R. Morris Anion control of tautomeric equilibria: Fe‒H vs. N‒H influenced by NH⋯F hydrogen bonding Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 2071.2 Cell parameters: 14.7564; 10.0345; 15.8101; 90; 117.783; 90;

COD ID: 1550285
CIF file	Formula: - C14 H27 Fe N O3 P2 - Comments: Chambers, Geoffrey M.; Johnson, Samantha I.; Raugei, Simone; Bullock, R. Morris Anion control of tautomeric equilibria: Fe‒H vs. N‒H influenced by NH⋯F hydrogen bonding Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1881.2 Cell parameters: 12.6009; 10.8786; 14.531; 90; 109.196; 90;

COD ID: 1550286
CIF file	Formula: - C15 H28 F3 Fe N O6 P2 S - Comments: Chambers, Geoffrey M.; Johnson, Samantha I.; Raugei, Simone; Bullock, R. Morris Anion control of tautomeric equilibria: Fe‒H vs. N‒H influenced by NH⋯F hydrogen bonding Chemical Science (2019) Space group: P -1 Cell volume: 1151.2 Cell parameters: 9.893; 10.456; 12.269; 98.65; 111.652; 95.223;

COD ID: 1550287

Formula: - C24 H27 N O2 -
Comments: Situ, Bo; Gao, Meng; He, Xiaojing; Li, Shiwu; He, Bairong; Guo, Fengxia; Kang, Chunmin; Liu, Shan; Yang, Lei; Jiang, Meijuan; Hu, Yanwei; Tang, Ben Zhong; Zheng, Lei A two-photon AIEgen for simultaneous dual-color imaging of atherosclerotic plaques Materials Horizons 6(3) (2019) 546
Space group: P 1 21/n 1
Cell volume: 2075.5
Cell parameters: 12.0936; 12.9722; 13.334; 90; 97.167; 90;

COD ID: 1550289

Formula: - C53.5 H66 Cl3 N4 O1.5 Ru -
Comments: DUMAS, Adrien; Colombel-Rouen, Sophie; Curbet, Idriss; Forcher, Gwénaël; Tripoteau, Fabien; Caijo, Frédéric; Rouen, Mathieu; Queval, Pierre; Basle, Olivier; Mauduit, Marc Highly selective macrocyclic ring-closing metathesis of terminal olefins in non-chlorinated solvents at low dilution Catalysis Science & Technology (2019)
Space group: P -1
Cell volume: 5212.6
Cell parameters: 11.961; 16.591; 26.614; 93.877; 90.681; 98.321;

COD ID: 1550290

Formula: - C63 H82 Cl2 N4 Ru -
Comments: DUMAS, Adrien; Colombel-Rouen, Sophie; Curbet, Idriss; Forcher, Gwénaël; Tripoteau, Fabien; Caijo, Frédéric; Rouen, Mathieu; Queval, Pierre; Basle, Olivier; Mauduit, Marc Highly selective macrocyclic ring-closing metathesis of terminal olefins in non-chlorinated solvents at low dilution Catalysis Science & Technology (2019)
Space group: P 1 21/n 1
Cell volume: 5635.3
Cell parameters: 11.206; 15.0047; 33.7602; 90; 96.909; 90;

COD ID: 1550291

Formula: - C53 H62 Cl2 N4 Ru -
Comments: DUMAS, Adrien; Colombel-Rouen, Sophie; Curbet, Idriss; Forcher, Gwénaël; Tripoteau, Fabien; Caijo, Frédéric; Rouen, Mathieu; Queval, Pierre; Basle, Olivier; Mauduit, Marc Highly selective macrocyclic ring-closing metathesis of terminal olefins in non-chlorinated solvents at low dilution Catalysis Science & Technology (2019)
Space group: P -1
Cell volume: 2326.2
Cell parameters: 12.017; 12.562; 16.608; 80.103; 89.839; 70.644;

COD ID: 1550292

Formula: - C56 H68 Cl4 N4 Ru -
Comments: DUMAS, Adrien; Colombel-Rouen, Sophie; Curbet, Idriss; Forcher, Gwénaël; Tripoteau, Fabien; Caijo, Frédéric; Rouen, Mathieu; Queval, Pierre; Basle, Olivier; Mauduit, Marc Highly selective macrocyclic ring-closing metathesis of terminal olefins in non-chlorinated solvents at low dilution Catalysis Science & Technology (2019)
Space group: P 1 21/c 1
Cell volume: 5144.4
Cell parameters: 21.792; 10.9906; 22.5146; 90; 107.445; 90;

COD ID: 1550293

Formula: - C20 H17 Br N2 Ni O -
Comments: Ueda, Yohei; Tsujimoto, Nagataka; Yurino, Taiga; Tsurugi, Hayato; Mashima, Kazushi Nickel-catalyzed Cyanation of Aryl Halides and Triflates Using Acetonitrile via the C—CN Bond Cleavage Assisted by 1,4-Bis(trimethylsilyl)-2,3,5,6-tetramethyl-1,4-dihydropyrazine Chemical Science (2019)
Space group: C 1 c 1
Cell volume: 1778
Cell parameters: 11.964; 20.02; 7.423; 90; 90.11; 90;

COD ID: 1550296
CIF file	Formula: - C43 H37 B N2 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 1774.6 Cell parameters: 8.489; 12.387; 17.4; 98.386; 100.888; 91.61;

COD ID: 1550297
CIF file	Formula: - C45 H37 B N2 S - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 1727.7 Cell parameters: 9.741; 13.927; 15.334; 63.989; 89.736; 69.795;

COD ID: 1550298
CIF file	Formula: - C47.5 H40.5 B Cl N2 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: C 1 c 1 Cell volume: 7263 Cell parameters: 22.13; 17.76; 19.24; 90; 106.15; 90;

COD ID: 1550299
CIF file	Formula: - C43 H37 B N2 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 3204 Cell parameters: 9.296; 18.788; 19.886; 111.16; 90.63; 97.62;

COD ID: 1550300
CIF file	Formula: - C45 H37 B N2 S - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 1758 Cell parameters: 11.145; 12.992; 14.196; 64.16; 75.45; 73.97;

COD ID: 1550301
CIF file	Formula: - C24 H54 Ag6 S6 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 1943.4 Cell parameters: 10.4774; 12.5886; 16.437; 71.344; 87.354; 71.435;

COD ID: 1550302
CIF file	Formula: - C6.96 H5.78 B0.15 N0.3 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 3760 Cell parameters: 13.873; 16.28; 17.74; 86.66; 80.14; 72.27;

COD ID: 1550303
CIF file	Formula: - C41 H35 B N2 S - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 3141.8 Cell parameters: 13.384; 12.918; 22.321; 90; 125.5; 90;

COD ID: 1550304
CIF file	Formula: - C43 H38 B N2 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 1631.5 Cell parameters: 8.1887; 13.353; 15.493; 81.008; 83.598; 78.061;

COD ID: 1550305
CIF file	Formula: - C43 H37 B N2 - Comments: Zeng, Chao; Yuan, Kang; Wang, Nan; Peng, Tai; Wu, Gang; Wang, Suning The Opposite and Amplifying Effect of B-N Coordination on Photophysical Properties of Regioisomers with an Unsymmetrical Backbone Chemical Science (2019) Space group: P -1 Cell volume: 1712.7 Cell parameters: 9.196; 14.091; 14.197; 74.441; 87.034; 75.138;

COD ID: 1550306

Formula: - C47 H59 B N2 -
Comments: Mandal, Swadhin K.; Sau, Samaresh Ch; Bhattacharjee, Rameswar; Hota, Pradip kumar; Vardhanapu, Pavan Kumar; vijaykumar, gonela; Govindarajan, R.; Datta, Ayan Transforming Atmospheric CO2 into Alternative Fuels: a Metal-Free Approach under Ambient Conditions Chemical Science (2019)
Space group: P 1 21/n 1
Cell volume: 3940.66
Cell parameters: 11.2461; 23.0691; 15.3687; 90; 98.7643; 90;

COD ID: 1550307

Formula: - C43 H52 B N2 O5 -
Comments: Mandal, Swadhin K.; Sau, Samaresh Ch; Bhattacharjee, Rameswar; Hota, Pradip kumar; Vardhanapu, Pavan Kumar; vijaykumar, gonela; Govindarajan, R.; Datta, Ayan Transforming Atmospheric CO2 into Alternative Fuels: a Metal-Free Approach under Ambient Conditions Chemical Science (2019)
Space group: P 1 21/n 1
Cell volume: 3951.1
Cell parameters: 12.6081; 14.3388; 22.0714; 90; 98.028; 90;

COD ID: 1550308

Formula: - C40 H47.5 B0.5 N2 O4.5 -
Comments: Mandal, Swadhin K.; Sau, Samaresh Ch; Bhattacharjee, Rameswar; Hota, Pradip kumar; Vardhanapu, Pavan Kumar; vijaykumar, gonela; Govindarajan, R.; Datta, Ayan Transforming Atmospheric CO2 into Alternative Fuels: a Metal-Free Approach under Ambient Conditions Chemical Science (2019)
Space group: P 21 21 2
Cell volume: 3680
Cell parameters: 19.3779; 14.5134; 13.085; 90; 90; 90;

COD ID: 1550309

Formula: - C39 H47 Cl N2 O -
Comments: Mandal, Swadhin K.; Sau, Samaresh Ch; Bhattacharjee, Rameswar; Hota, Pradip kumar; Vardhanapu, Pavan Kumar; vijaykumar, gonela; Govindarajan, R.; Datta, Ayan Transforming Atmospheric CO2 into Alternative Fuels: a Metal-Free Approach under Ambient Conditions Chemical Science (2019)
Space group: P n a 21
Cell volume: 3508.9
Cell parameters: 18.4291; 13.1243; 14.5076; 90; 90; 90;

COD ID: 1550310

Formula: - C23 H56 F3 N2 O3 P4 Rh S -
Comments: Walsh, Aaron P.; Laureanti, Joseph A.; Katipamula, Sriram; Chambers, Geoffrey M.; Priyadarshani, Nilusha; Lense, Sheri; Bays, J. Timothy; Linehan, John C.; Shaw, Wendy J. Evaluating the impacts of amino acids in the second and outer coordination spheres of Rh-bis(diphosphine) complexes for CO2 hydrogenation. Faraday discussions 215 (2019) 123-140
Space group: P 1 21/n 1
Cell volume: 3326.5
Cell parameters: 10.1497; 11.3546; 29.0077; 90; 95.69; 90;

COD ID: 1550318

Formula: - C39 H49 Co N2 P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 1936.4
Cell parameters: 8.295; 10.3193; 23.1847; 84.114; 82.677; 80.838;

COD ID: 1550319

Formula: - C41 H53 Co N2 P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 2014.97
Cell parameters: 11.5086; 12.6623; 16.1055; 71.013; 69.473; 70.661;

COD ID: 1550320

Formula: - C45 H57 Co N2 P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 2116.1
Cell parameters: 11.0975; 12.9085; 16.7384; 68.191; 88.775; 72.802;

COD ID: 1550321

Formula: - C77 H111 Co Ga K N4 O6 P4 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P 21 21 21
Cell volume: 7963.6
Cell parameters: 13.84854; 21.0014; 27.3815; 90; 90; 90;

COD ID: 1550322

Formula: - C69 H89.27 Co Ga N4 O P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 3605.33
Cell parameters: 12.5761; 16.9742; 17.4872; 97.67; 101.165; 94.952;

COD ID: 1550323

Formula: - C68 H90 Co Ga N4 P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 3206.3
Cell parameters: 12.0909; 12.7157; 21.8419; 99.628; 94.661; 102.632;

COD ID: 1550324

Formula: - C54 H80 Co K N2 O8 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 10545.7
Cell parameters: 15.3646; 25.7695; 27.6375; 105.439; 90.5348; 90.8565;

COD ID: 1550325

Formula: - C67 H89 Co Ga K N4 O4 P4 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 3946.85
Cell parameters: 15.4512; 16.1163; 16.5636; 94.7947; 103.148; 98.1715;

COD ID: 1550326

Formula: - C68 H90 Co Ga N4 P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 3205.7
Cell parameters: 12.0763; 12.7169; 21.8615; 99.614; 94.655; 102.639;

COD ID: 1550327

Formula: - C75 H88 Cl Co F2 Ga N4 P5 -
Comments: Ziegler, Christoph G. P.; Maier, Thomas M.; Pelties, Stefan; Taube, Clemens; Hennersdorf, Felix; Ehlers, A.W.; Weigand, Jan J.; Wolf, Robert Construction of Alkyl-Substituted Pentaphosphido Ligands in the Coordination Sphere of Cobalt Chemical Science (2019)
Space group: P -1
Cell volume: 3534.62
Cell parameters: 11.8741; 12.4783; 24.9702; 89.008; 77.087; 78.673;

COD ID: 1550328

Formula: - C47 H38 F6 Ir N2 P3 -
Comments: Hao, Liang; Li, Zhi-Wei; Zhang, Dong-Yang; He, Liang; Liu, Wen-Ting; Jing, Yang; Tan, Caiping; Ji, Liang-Nian; Mao, Zong-Wan Monitor Mitochondrial Viscosity with Anticancer Phosphorescent Ir(III) Complexes via Two-Photon Lifetime Imaging Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 4217.91
Cell parameters: 16.9747; 12.0886; 21.1714; 90; 103.859; 90;

COD ID: 1550329

Formula: - C49 H38 F6 Ir N2 O2 P3 -
Comments: Hao, Liang; Li, Zhi-Wei; Zhang, Dong-Yang; He, Liang; Liu, Wen-Ting; Jing, Yang; Tan, Caiping; Ji, Liang-Nian; Mao, Zong-Wan Monitor Mitochondrial Viscosity with Anticancer Phosphorescent Ir(III) Complexes via Two-Photon Lifetime Imaging Chemical Science (2019)
Space group: P 1 21 1
Cell volume: 2141.61
Cell parameters: 10.539; 19.2351; 10.9341; 90; 104.941; 90;

COD ID: 1550330

Formula: - C50 H38 F6 Ir N2 O2 P3 -
Comments: Hao, Liang; Li, Zhi-Wei; Zhang, Dong-Yang; He, Liang; Liu, Wen-Ting; Jing, Yang; Tan, Caiping; Ji, Liang-Nian; Mao, Zong-Wan Monitor Mitochondrial Viscosity with Anticancer Phosphorescent Ir(III) Complexes via Two-Photon Lifetime Imaging Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 4426.8
Cell parameters: 17.4083; 13.0416; 20.5524; 90; 108.427; 90;

COD ID: 1550331
CIF file	Formula: - C16 H18 N O2 - Comments: Yao, Kun; Yuan, Qianjia; Qu, Xingxin; Liu, Yangang; Liu, Delong; Zhang, Wanbin Pd-Catalyzed asymmetric allylic substitution cascade using α-(pyridin-1-yl)-acetamides formed in situ as nucleophiles Chemical Science (2019) Space group: P 21 21 21 Cell volume: 1389.3 Cell parameters: 5.478; 9.837; 25.781; 90; 90; 90;

COD ID: 1550337

Formula: - C31 H38 Cl2 O5 P S -
Comments: Xia, Jian; Zhang, Yixin; Hu, Xiaoqiang; Ma, Xin; Cui, Lei; Zhang, Jianfu; Jian, Zhongbao Sterically very bulky aliphatic/aromatic phosphine-sulfonate palladium catalysts for ethylene polymerization and copolymerization with polar monomers Polymer Chemistry 10(4) (2019) 546
Space group: P 65
Cell volume: 4793.9
Cell parameters: 22.6855; 22.6855; 10.7563; 90; 90; 120;

COD ID: 1550338

Formula: - C34 H38 F2 N O3 P Pd S -
Comments: Xia, Jian; Zhang, Yixin; Hu, Xiaoqiang; Ma, Xin; Cui, Lei; Zhang, Jianfu; Jian, Zhongbao Sterically very bulky aliphatic/aromatic phosphine-sulfonate palladium catalysts for ethylene polymerization and copolymerization with polar monomers Polymer Chemistry 10(4) (2019) 546
Space group: P 21 21 21
Cell volume: 3171.8
Cell parameters: 9.1697; 9.5203; 36.333; 90; 90; 90;

COD ID: 1550339
CIF file	Formula: - C34 H28 F12 Fe N8 P2 - Comments: Carey, Monica C.; Adelman, Sara L.; McCusker, James K. Insights into the excited state dynamics of Fe(ii) polypyridyl complexes from variable-temperature ultrafast spectroscopy Chemical Science (2019) Space group: P 41 Cell volume: 7454.8 Cell parameters: 12.3462; 12.3462; 48.9067; 90; 90; 90;

COD ID: 1550340
CIF file	Formula: - C40 H45 F12 Fe N6 O P2 - Comments: Carey, Monica C.; Adelman, Sara L.; McCusker, James K. Insights into the excited state dynamics of Fe(ii) polypyridyl complexes from variable-temperature ultrafast spectroscopy Chemical Science (2019) Space group: P -1 Cell volume: 2137.36 Cell parameters: 8.6648; 14.3856; 17.4683; 83.227; 85.655; 82.022;

COD ID: 1550341

Formula: - C23 H15 Br2 N O S -
Comments: Shan, Yahan; Li, Shiwen; Wang, Rui; Zhu, Si Yi; Wu, Fei; Fu, Yang; Zhu, Linna Spontaneously hierarchical self-assembly of nanofibres into fluorescent spherical particles: a leap from organogels to macroscopic solid spheres. Soft matter 15(3) (2019) 470-476
Space group: P -1
Cell volume: 1004.12
Cell parameters: 6.9784; 7.3112; 21.0187; 81.743; 89.701; 71.272;

COD ID: 1550342

Formula: - C15.5 H17 Cu N3.5 O5.75 -
Comments: Wang, Sujuan; Wei, Zhang-Wen; Zhang, Jianyong; Jiang, Long; Liu, Dingxin; Jiang, Ji-Jun; Si, Rui; Su, Cheng-Yong Framework disorder and its effect on selective hysteretic sorption of a T-shaped azole-based metal‒organic framework IUCrJ 6(1) (2019)
Space group: P 1 21/c 1
Cell volume: 1760.57
Cell parameters: 10.8431; 11.8835; 14.4823; 90; 109.361; 90;

COD ID: 1550343

Formula: - C35 H47 I N2 O -
Comments: Zhang, Ruoyao; Niu, Guangle; Li, Xuechen; Guo, Lifang; Zhang, Huamiao; Yang, Rui; Chen, Yuncong; Yu, Xiaoqiang; Tang, Ben Zhong Reaction-free and MMP-independent fluorescent probes for long-term mitochondria visualization and tracking Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 3239.7
Cell parameters: 6.9216; 59.8833; 7.8371; 90; 94.192; 90;

COD ID: 1550344

Formula: - C27 H37 I N2 -
Comments: Zhang, Ruoyao; Niu, Guangle; Li, Xuechen; Guo, Lifang; Zhang, Huamiao; Yang, Rui; Chen, Yuncong; Yu, Xiaoqiang; Tang, Ben Zhong Reaction-free and MMP-independent fluorescent probes for long-term mitochondria visualization and tracking Chemical Science (2019)
Space group: P 1 21/n 1
Cell volume: 7757.7
Cell parameters: 10.5322; 16.7869; 43.8778; 90; 90.202; 90;

COD ID: 1550345
CIF file	Formula: - C23 H23 B2 Cl9 N4 O2 - Comments: Wang, Baolin; Kinjo, Rei Boron-based Stepwise Dioxygen Activation with 1,4,2,5-Diazadiborinine Chemical Science (2019) Space group: P n a 21 Cell volume: 3145.73 Cell parameters: 15.8691; 12.5093; 15.8466; 90; 90; 90;

COD ID: 1550346
CIF file	Formula: - C42 H44 B4 Cl2 N8 O2 - Comments: Wang, Baolin; Kinjo, Rei Boron-based Stepwise Dioxygen Activation with 1,4,2,5-Diazadiborinine Chemical Science (2019) Space group: P -1 Cell volume: 2049.82 Cell parameters: 11.1827; 13.5841; 13.7474; 83.0226; 81.9334; 86.2235;

COD ID: 1550347
CIF file	Formula: - C16 H22 B2 N2 O3 - Comments: Wang, Baolin; Kinjo, Rei Boron-based Stepwise Dioxygen Activation with 1,4,2,5-Diazadiborinine Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 1670.82 Cell parameters: 7.0474; 10.652; 22.2574; 90; 90.2535; 90;

COD ID: 1550348
CIF file	Formula: - C38 H56 B2 N6 O2 - Comments: Wang, Baolin; Kinjo, Rei Boron-based Stepwise Dioxygen Activation with 1,4,2,5-Diazadiborinine Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 3650.9 Cell parameters: 8.1816; 26.3954; 17.138; 90; 99.443; 90;

COD ID: 1550349

Formula: - C22 H16 N6 O2 -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: P 1 21/c 1
Cell volume: 880.95
Cell parameters: 5.0978; 9.7374; 17.7601; 90; 92.193; 90;

COD ID: 1550350

Formula: - C13 H12 Ag N3 O3 -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: P -1
Cell volume: 639.4
Cell parameters: 7.3603; 8.618; 11.0702; 102.912; 95.079; 108.486;

COD ID: 1550351

Formula: - C26 H28 N6 O4 S2 -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: P -1
Cell volume: 635.02
Cell parameters: 7.4404; 9.0236; 10.0764; 89.276; 72.988; 79.287;

COD ID: 1550352

Formula: - C22 H18 Ag Cl N6 O6 -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: P 1 21/n 1
Cell volume: 2240.3
Cell parameters: 11.3109; 14.7646; 13.9188; 90; 105.464; 90;

COD ID: 1550353

Formula: - C28 H30 N8 O4 -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: C 1 2/c 1
Cell volume: 2588.31
Cell parameters: 19.2704; 4.05485; 33.1511; 90; 92.289; 90;

COD ID: 1550354

Formula: - C23 H18 Ag F3 N6 O5 S -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: P 1 21/n 1
Cell volume: 2452.72
Cell parameters: 11.84847; 11.65924; 18.1068; 90; 101.316; 90;

COD ID: 1550355

Formula: - C22 H18 Ag F6 N6 O2 P -
Comments: Tatikonda, Rajendhraprasad; Bulatov, Evgeny; Özdemir, Zülal; Nonappa, ?; Haukka, Matti Infinite coordination polymer networks: metallogelation of aminopyridine conjugates and in situ silver nanoparticle formation. Soft matter 15(3) (2019) 442-451
Space group: P 1 21/n 1
Cell volume: 2401.04
Cell parameters: 11.5489; 11.6921; 18.1433; 90; 101.463; 90;

COD ID: 1550357

Formula: - C68 H66 Dy2 F42 N4 O12 -
Comments: Perfetti, Mauro; Gysler, Maren; Rechkemmer, Yvonne; Zhang, Peng; Tastan, Hatice; Fischer, Florian; Netz, Julia; Frey, Wolfgang; Zimmermann, Lucas; Schleid, Thomas; Hakl, Michael; Orlita, Milan; Ungur, Liviu; Chibotaru, Liviu; Brock-Nannestad, Theis; Piligkos, Stergios; van Slageren, Joris Determination of the electronic structure of a dinuclear dysprosium single molecule magnet without symmetry idealization Chemical Science (2019)
Space group: P -1
Cell volume: 2147.4
Cell parameters: 11.7327; 13.5801; 14.5983; 71.026; 88.785; 77.839;

COD ID: 1550358
CIF file	Formula: - C56 H56 Cl6 N8 O3 - Comments: Kołodziejski, Michał; Stefankiewicz, Artur R.; Lehn, Jean-Marie Dynamic polyimine macrobicyclic cryptands ‒ self-sorting with component selection Chemical Science (2019) Space group: P -1 Cell volume: 2751.4 Cell parameters: 11.0189; 13.6198; 19.9453; 107.462; 94.429; 102.769;

COD ID: 1550359
CIF file	Formula: - C56 H56 Cl6 N8 - Comments: Kołodziejski, Michał; Stefankiewicz, Artur R.; Lehn, Jean-Marie Dynamic polyimine macrobicyclic cryptands ‒ self-sorting with component selection Chemical Science (2019) Space group: P -1 Cell volume: 2774.2 Cell parameters: 13.0425; 13.288; 19.2843; 98.778; 100.254; 118.655;

COD ID: 1550360

Formula: - C77 H76 B Cl6 F4 O2 Os P3 -
Comments: Zhang, Huan; Zhao, Haibo; Zhuo, Kaiyue; Hua, Yuhui; Chen, Jiangxi; He, Xumin; Weng, Wengui; Xia, Haiping “Carbolong” polymers with near infrared triggered, spatially resolved and rapid self-healing properties Polymer Chemistry 10(3) (2019) 386
Space group: P 1 21/n 1
Cell volume: 7051.95
Cell parameters: 12.1981; 26.7517; 21.8243; 90; 98.026; 90;

COD ID: 1550361

Formula: - C37 H81 Cl N8 S3 -
Comments: Spooner, Michael J.; Li, Hongyu; Marques, Igor; Costa, Pedro M. R.; Wu, Xin; Howe, Ethan N. W.; Busschaert, Nathalie; Moore, Stephen J.; Light, Mark E.; Sheppard, David N.; Félix, Vítor; Gale, Philip A. Fluorinated synthetic anion carriers: experimental and computational insights into transmembrane chloride transport Chemical Science (2019)
Space group: P -1
Cell volume: 4674.5
Cell parameters: 13.6678; 15.9682; 22.901; 85.095; 74.096; 76.589;

COD ID: 1550366
CIF file	Formula: - C308 H156 Eu2 N12 Ni3 - Comments: Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 9745 Cell parameters: 24.606; 18.08; 22.351; 90; 101.478; 90;

COD ID: 1550367
CIF file	Formula: - C280 H132 Eu2 N12 Ni3 - Comments: Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 9587 Cell parameters: 24.307; 18.191; 22.087; 90; 100.995; 90;

COD ID: 1550368
CIF file	Formula: - C130.05 H53.66 Eu N4 Ni S0.78 - Comments: Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 7621.4 Cell parameters: 25.3346; 15.1339; 19.9751; 90; 95.659; 90;

COD ID: 1550369
CIF file	Formula: - C132 H56 Eu N4 Ni - Comments: Bao, Lipiao; Yu, Pengyuan; Pan, Changwang; Shen, Wangqiang; Lu, Xing Crystallographic identification of Eu@C2n (2n = 88, 86 and 84): completing a transformation map for existing metallofullerenes Chemical Science (2019) Space group: C 1 2/m 1 Cell volume: 7629 Cell parameters: 25.386; 15.123; 19.953; 90; 95.2; 90;

COD ID: 1550370
CIF file Original IUCr paper	Formula: - C4 H9 Co N O6 - Comments: Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ 6(1) (2019) 105-115 Space group: P n m a Cell volume: 785.48 Cell parameters: 8.2674; 11.66; 8.1483; 90; 90; 90;

COD ID: 1550371
CIF file Original IUCr paper	Formula: - C4 H9 Co N O6 - Comments: Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ 6(1) (2019) 105-115 Space group: P n m a Cell volume: 784.05 Cell parameters: 8.2556; 11.6519; 8.1508; 90; 90; 90;

COD ID: 1550372
CIF file Original IUCr paper	Formula: - C4 H9 Co N O6 - Comments: Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ 6(1) (2019) 105-115 Space group: P n m a Cell volume: 788.29 Cell parameters: 8.2702; 11.6766; 8.1631; 90; 90; 90;

COD ID: 1550373
CIF file Original IUCr paper	Formula: - C4 H9 Co N O6 - Comments: Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound IUCrJ 6(1) (2019) 105-115 Space group: P n m a Cell volume: 784.29 Cell parameters: 8.2548; 11.6547; 8.1521; 90; 90; 90;

COD ID: 1550375
CIF file	Formula: - C77 H51.5 Cl6 S5 - Comments: Lin, Hsing-An; Kato, Kenta; Segawa, Yasutomo; Scott, Lawrence T.; Itami, Kenichiro Synthesis and Structural Features of Thiophene-fused Analogues of Warped Nanographene and Quintuple Helicene Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 12825.5 Cell parameters: 21.7713; 21.459; 27.4874; 90; 92.893; 90;

COD ID: 1550376
CIF file	Formula: - C24 H22 O - Comments: Zhang, Yuchen; Wu, Wangteng; Fu, Chunling; Huang, Xin; Ma, Shengming Benzene Construction via Pd-catalyzed Cyclization of 2,7-Alkadiynylic Carbonates in the Presence of Alkynes Chemical Science (2019) Space group: P -1 Cell volume: 915.6 Cell parameters: 8.4646; 10.2366; 11.8274; 77.022; 69.293; 74.924;

COD ID: 1550377
CIF file	Formula: - C24 H22 O2 - Comments: Zhang, Yuchen; Wu, Wangteng; Fu, Chunling; Huang, Xin; Ma, Shengming Benzene Construction via Pd-catalyzed Cyclization of 2,7-Alkadiynylic Carbonates in the Presence of Alkynes Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 1882 Cell parameters: 6.8864; 33.272; 8.5011; 90; 104.932; 90;

COD ID: 1550378
CIF file	Formula: - C27 H23 N O2 - Comments: Zhang, Yuchen; Wu, Wangteng; Fu, Chunling; Huang, Xin; Ma, Shengming Benzene Construction via Pd-catalyzed Cyclization of 2,7-Alkadiynylic Carbonates in the Presence of Alkynes Chemical Science (2019) Space group: P b c a Cell volume: 4007.9 Cell parameters: 37.682; 6.9971; 15.2009; 90; 90; 90;

COD ID: 1550379
CIF file	Formula: - C21 H24 O4 - Comments: Gupta, Saswata; Lin, Yongjia; Xia, Yuanzhi; Wink, Donald; Lee, Daesung Alder-Ene Reactions Driven by High Steric Strain and Bond Angle Distortion to Form Benzocyclobutenes Chemical Science (2019) Space group: P 21 21 21 Cell volume: 1771.9 Cell parameters: 6.2996; 14.6723; 19.1704; 90; 90; 90;

COD ID: 1550380

Formula: - C42 H30 O14 Ti3 -
Comments: Feng, Xuanyu; Song, Yang; Chen, Justin S.; Li, Zhe; Chen, Emily Y.; Kaufmann, Michael; Wang, Cheng; Lin, Wenbin Cobalt-Bridged Secondary Building Units in a Titanium Metal-Organic Framework Catalyze Cascade Reduction of N-Heteroarenes Chemical Science (2019)
Space group: R -3 m
Cell volume: 7901.2
Cell parameters: 25.8366; 25.8366; 13.6675; 90; 90; 120;

COD ID: 1550381
CIF file	Formula: - C78.74 H94.11 Cl4 N9.37 O6 P2 - Comments: Peñuelas-Haro, Guillem; Ballester, Pablo Efficient Hydrogen Bonding Recognition in Water using Aryl-extended Calix[4]pyrrole Receptors Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 7839.1 Cell parameters: 13.8833; 29.9782; 18.874; 90; 93.677; 90;

COD ID: 1550382
CIF file	Formula: - C74 H87 Cl4 N7 O6 P2 - Comments: Peñuelas-Haro, Guillem; Ballester, Pablo Efficient Hydrogen Bonding Recognition in Water using Aryl-extended Calix[4]pyrrole Receptors Chemical Science (2019) Space group: I 41 m d Cell volume: 7105.4 Cell parameters: 19.6411; 19.6411; 18.4185; 90; 90; 90;

COD ID: 1550383

Formula: - Al2 Eu4 F2 O8 -
Comments: Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure IUCrJ 6(1) (2019) 128-135
Space group: P 1 21/c 1
Cell volume: 862.67
Cell parameters: 7.5885; 10.8399; 11.0776; 90; 108.788; 90;

COD ID: 1550384

Formula: - Al2 F2 O8 Sm4 -
Comments: Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure IUCrJ 6(1) (2019) 128-135
Space group: P 1 21/c 1
Cell volume: 870.84
Cell parameters: 7.6188; 10.8705; 11.1077; 90; 108.805; 90;

COD ID: 1550400

Formula: - C55 H66 Cl2 N4 Ru -
Comments: Dumas, Adrien; Colombel-Rouen, Sophie; Curbet, Idriss; Forcher, Gwénael; Tripoteau, Fabien; Caijo, Frédéric; Queval, Pierre; Rouen, Mathieu; Baslé, Olivier; Mauduit, Marc Highly selective macrocyclic ring-closing metathesis of terminal olefins in non-chlorinated solvents at low dilution Catalysis Science & Technology (2019)
Space group: P -1
Cell volume: 2387.6
Cell parameters: 10.9047; 11.6314; 19.7689; 95.343; 101.998; 100.664;

COD ID: 1550401
CIF file	Formula: - C77 H66 Cl2 N10 O12 - Comments: Chen, Huaiyu; Huang, Chao; Ding, Yazhou; Zhang, Qi-Long; Zhu, Bi-Xue; Ni, Xin-Long Organic core‒shell-shaped micro/nanoparticles from twisted macrocycles in Schiff base reaction Chemical Science 10(2) (2019) 490 Space group: P -1 Cell volume: 3457 Cell parameters: 13.861; 15.962; 17.258; 69.871; 75.157; 81.221;

COD ID: 1550402
CIF file	Formula: - C15 H12 O4 - Comments: Chen, Huaiyu; Huang, Chao; Ding, Yazhou; Zhang, Qi-Long; Zhu, Bi-Xue; Ni, Xin-Long Organic core‒shell-shaped micro/nanoparticles from twisted macrocycles in Schiff base reaction Chemical Science 10(2) (2019) 490 Space group: P 1 21/n 1 Cell volume: 1208.2 Cell parameters: 7.804; 11.72; 13.252; 90; 94.565; 90;

COD ID: 1550403
CIF file	Formula: - C32 H47 Al N2 - Comments: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 3066 Cell parameters: 10.5476; 13.0639; 22.5422; 90; 99.217; 90;

COD ID: 1550404
CIF file	Formula: - C38.5 H57 Al N2 - Comments: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 7199.8 Cell parameters: 19.4468; 18.4781; 20.5105; 90; 102.346; 90;

COD ID: 1550405
CIF file	Formula: - C39 H53 Al N2 O - Comments: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 3526.5 Cell parameters: 12.3296; 16.8397; 17.7035; 90; 106.384; 90;

COD ID: 1550406
CIF file	Formula: - C31 H45 Al N2 - Comments: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 2874.2 Cell parameters: 12.3658; 17.1209; 14.023; 90; 104.507; 90;

COD ID: 1550407
CIF file	Formula: - C38 H50 Al N2 - Comments: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science (2019) Space group: P 21 21 21 Cell volume: 3475.8 Cell parameters: 11.227; 14.6841; 21.0838; 90; 90; 90;

COD ID: 1550408
CIF file	Formula: - C62 H90 Al2 N4 - Comments: Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark Richard Reversible Alkene Binding and Allylic C‒H Activation with an Aluminium(I) Complex Chemical Science (2019) Space group: C 1 2/c 1 Cell volume: 5575.27 Cell parameters: 24.6053; 15.38681; 14.82658; 90; 96.6729; 90;

COD ID: 1550409
CIF file	Formula: - C48 H36 Cu F12 N8 O14.13 S4 - Comments: Liu, Yanju; Han, Yongzhen; Zhang, Zongyao; Zhang, Wei; Lai, Wenzhen; Wang, Yong; Cao, Rui Low overpotential water oxidation at neutral pH catalyzed by a copper(II) porphyrin Chemical Science (2019) Space group: P -1 Cell volume: 4059.7 Cell parameters: 16.1504; 16.2726; 17.8745; 99.297; 112.765; 102.854;

COD ID: 1550410

Formula: - C35 H21 Al2 F55 O6 Si -
Comments: Martens, Arthur; Kreuzer, Marvin; Ripp, Alexander Johannes Christoph; Schneider, Marius; Himmel, Daniel; Scherer, Harald; Krossing, Ingo Investigations on Non-Classical Silylium Ions Leading to a Cyclobutenyl Cation Chemical Science (2019)
Space group: P -1
Cell volume: 2757.92
Cell parameters: 10.4039; 12.682; 21.4037; 88.235; 80.175; 82.373;

COD ID: 1550411

Formula: - C30 H31 Al F28 N2 O3 Si -
Comments: Martens, Arthur; Kreuzer, Marvin; Ripp, Alexander Johannes Christoph; Schneider, Marius; Himmel, Daniel; Scherer, Harald; Krossing, Ingo Investigations on Non-Classical Silylium Ions Leading to a Cyclobutenyl Cation Chemical Science (2019)
Space group: P -1
Cell volume: 2077.06
Cell parameters: 9.4236; 10.9684; 20.6676; 78.207; 88.952; 83.352;

COD ID: 1550412

Formula: - C19 H10 Al F27 N2 O3 -
Comments: Martens, Arthur; Kreuzer, Marvin; Ripp, Alexander Johannes Christoph; Schneider, Marius; Himmel, Daniel; Scherer, Harald; Krossing, Ingo Investigations on Non-Classical Silylium Ions Leading to a Cyclobutenyl Cation Chemical Science (2019)
Space group: P 1 21/c 1
Cell volume: 2842.5
Cell parameters: 12.2182; 11.395; 21.1752; 90; 105.383; 90;

COD ID: 1550413
CIF file	Formula: - C24 H22 F N O4 - Comments: Royal, Titouan; Baudoin, Olivier Pd-catalyzed γ-arylation of γ,δ-unsaturated O-carbamates via an unusual haptotropic rearrangement Chemical Science (2019) Space group: P 1 21 1 Cell volume: 2033.85 Cell parameters: 15.3747; 7.2401; 18.684; 90; 102.066; 90;

COD ID: 1550414
CIF file	Formula: - C24 H22 F N O4 - Comments: Royal, Titouan; Baudoin, Olivier Pd-catalyzed γ-arylation of γ,δ-unsaturated O-carbamates via an unusual haptotropic rearrangement Chemical Science (2019) Space group: P 1 21 1 Cell volume: 2028.68 Cell parameters: 15.3844; 7.2248; 18.6689; 90; 102.133; 90;

COD ID: 1550415

Formula: - C39 H32 Br2 N4 O -
Comments: Sindt, Ammon J.; DeHaven, Baillie A.; McEachern, David F.; Dissanayake, Madushanka M.; Smith, Mark D.; Vannucci, Aaron K.; Shimizu, Linda S. UV-irradiation of self-assembled triphenylamines affords persistent and regenerable radicals Chemical Science (2019)
Space group: P c c n
Cell volume: 3325.6
Cell parameters: 18.5184; 19.9443; 9.0043; 90; 90; 90;

COD ID: 1550416
CIF file	Formula: - C79 H106 N18 O14 P - Comments: Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science (2019) Space group: P n a 21 Cell volume: 8098 Cell parameters: 20.4627; 15.7895; 25.0638; 90; 90; 90;

COD ID: 1550417

Formula: - C142 H157 N32 O20 P2 -
Comments: Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science (2019)
Space group: P -1
Cell volume: 3762
Cell parameters: 15.948; 16.487; 16.568; 98.9391; 95.3315; 117.154;

COD ID: 1550418

Formula: - C142 H201 N36 O33 P2 -
Comments: Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science (2019)
Space group: P 1 21/n 1
Cell volume: 8701.5
Cell parameters: 22.7938; 18.9289; 23.1163; 90; 119.257; 90;

COD ID: 1550419
CIF file	Formula: - C27 H20 Cl2 O3 - Comments: Yao, Lu; Ishihara, Kazuaki Enantioselecive [1,3] O-to-C rearrangement: Dearomatization of alkyl 2-allyloxy/benzyloxy-1/3-naphthoates catalyzed by a chiral π‒Cu(II) complex Chemical Science (2019) Space group: P 21 21 21 Cell volume: 2226.2 Cell parameters: 7.6102; 10.7051; 27.326; 90; 90; 90;

COD ID: 1550420
CIF file	Formula: - C50 H64 Cu F6 N4 O8 S2 - Comments: Yao, Lu; Ishihara, Kazuaki Enantioselecive [1,3] O-to-C rearrangement: Dearomatization of alkyl 2-allyloxy/benzyloxy-1/3-naphthoates catalyzed by a chiral π‒Cu(II) complex Chemical Science (2019) Space group: P 21 21 21 Cell volume: 5217.8 Cell parameters: 14.293; 16.823; 21.7; 90; 90; 90;

COD ID: 1550421
CIF file	Formula: - C50 H46 N6 O6 - Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 4024.22 Cell parameters: 16.393; 12.1248; 20.3969; 90; 96.964; 90;

COD ID: 1550422

Formula: - C66 H52 Cl12 N8 O6 -
Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019)
Space group: P -1
Cell volume: 1590.27
Cell parameters: 10.6274; 12.6722; 13.0666; 76.113; 81.646; 68.89;

COD ID: 1550423
CIF file	Formula: - C60 H46 N8 O7 - Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019) Space group: P 1 Cell volume: 1260.8 Cell parameters: 9.1177; 10.6349; 13.6347; 84.797; 86.884; 73.337;

COD ID: 1550424
CIF file	Formula: - C62 H50 Cl8 N8 O6 - Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019) Space group: P -1 Cell volume: 1386.03 Cell parameters: 9.5459; 10.8943; 14.704; 77.534; 84.269; 68.203;

COD ID: 1550425
CIF file	Formula: - C62 H46 Cl8 N8 O5 - Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019) Space group: P n a 21 Cell volume: 5391.8 Cell parameters: 34.5017; 10.56728; 14.7887; 90; 90; 90;

COD ID: 1550426

Formula: - C66 H50 Cl16 N8 O6 -
Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019)
Space group: P -1
Cell volume: 6869.1
Cell parameters: 10.5616; 23.6815; 27.6022; 94.092; 92.874; 92.603;

COD ID: 1550427
CIF file	Formula: - C134 H110 Cl24 N16 O17 - Comments: Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science (2019) Space group: P -1 Cell volume: 6540 Cell parameters: 10.653; 12.928; 51.06; 92.18; 90.93; 111.37;

COD ID: 1550428
CIF file	Formula: - C29 H21 B Cl F10 N - Comments: Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science (2019) Space group: P -1 Cell volume: 1371 Cell parameters: 10.2284; 11.0264; 12.5397; 88.589; 80.364; 79.511;

COD ID: 1550429
CIF file	Formula: - C29 H21 B Br F10 N - Comments: Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science (2019) Space group: P -1 Cell volume: 1366.81 Cell parameters: 10.2011; 11.0143; 12.5252; 88.743; 80.865; 79.649;

COD ID: 1550430
CIF file	Formula: - C36 H42 B F10 P - Comments: Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science (2019) Space group: P -1 Cell volume: 1674.26 Cell parameters: 9.9507; 11.7835; 16.007; 71.517; 86.117; 70.299;

COD ID: 1550431
CIF file	Formula: - C27.5 H43 Cl - Comments: Erker, Gerhard; Tao, Xin; Wölke, Christian; Daniliuc, Constantin Gabriel; Kehr, Gerald Halogenoborane mediated allene cyclooligomerization Chemical Science (2019) Space group: P -1 Cell volume: 2363.95 Cell parameters: 10.8108; 12.1099; 19.1989; 76.703; 75.176; 87.966;

COD ID: 1550432

Formula: - C65.56 H77.12 B2 Cl7.12 F8 N2 O8.38 P4 Pd0.98 -
Comments: Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions 215 (2019) 141-161
Space group: C 1 2/c 1
Cell volume: 7613.4
Cell parameters: 24.9341; 15.1575; 22.1525; 90; 114.583; 90;

COD ID: 1550433

Formula: - C35 H30 Cl3 F6 N O4.4 P3 Pd -
Comments: Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions 215 (2019) 141-161
Space group: P 1 21/n 1
Cell volume: 4046.96
Cell parameters: 12.3522; 26.1118; 13.6448; 90; 113.138; 90;

COD ID: 1550434

Formula: - C33 H38 Cl2 N2 O4 P2 Pd -
Comments: Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions 215 (2019) 141-161
Space group: P 1 21/n 1
Cell volume: 3434.83
Cell parameters: 12.9976; 18.6574; 14.6755; 90; 105.169; 90;

COD ID: 1550435

Formula: - C35 H41 Cl8 N Ni O4 P2 -
Comments: Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions 215 (2019) 141-161
Space group: P 1 21/c 1
Cell volume: 4239.29
Cell parameters: 11.7989; 15.5485; 23.5593; 90; 101.232; 90;

COD ID: 1550436

Formula: - C33 H38 Cl2 N2 Ni O4 P2 -
Comments: Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. Faraday discussions 215 (2019) 141-161
Space group: P 1 21/n 1
Cell volume: 3385.56
Cell parameters: 12.8814; 18.6698; 14.5746; 90; 105.006; 90;

COD ID: 1550437

Formula: - C26 H18 La N9 O9 -
Comments: Gajarushi, Ashwini S.; Wasim, Mohd; Nabi, Rizwan; Kancharlapalli, Srinivasu; Rao, V. Ramgopal; Rajaraman, Gopalan; Subramaniam, Chandramouli; Shanmugam, Maheswaran Lanthanide complexes as molecular dopants for realizing air-stable n-type graphene logic inverters with symmetric transconductance Materials Horizons 6(4) (2019) 743
Space group: P 1 21/n 1
Cell volume: 2702.54
Cell parameters: 9.1366; 14.1095; 20.9641; 90; 90.052; 90;

COD ID: 1550438

Formula: - C26 H18 Ce N9 O9 -
Comments: Gajarushi, Ashwini S.; Wasim, Mohd; Nabi, Rizwan; Kancharlapalli, Srinivasu; Rao, V. Ramgopal; Rajaraman, Gopalan; Subramaniam, Chandramouli; Shanmugam, Maheswaran Lanthanide complexes as molecular dopants for realizing air-stable n-type graphene logic inverters with symmetric transconductance Materials Horizons 6(4) (2019) 743
Space group: C 1 2/c 1
Cell volume: 2804.4
Cell parameters: 15.0921; 10.8118; 19.5232; 90; 118.32; 90;

COD ID: 1550439
CIF file	Formula: - C16 H26 - Comments: van de Streek, Jacco; Alig, Edith; Parsons, Simon; Vella-Zarb, Liana A jumping crystal predicted with molecular dynamics and analysed with TLS refinement against powder diffraction data IUCrJ 6(1) (2019) 136-144 Space group: P 1 21/n 1 Cell volume: 679.65 Cell parameters: 14.3334; 5.56223; 8.53021; 90; 92.0219; 90;

COD ID: 1550440
CIF file	Formula: - C7 H15 Cl N2 O - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 1471.47 Cell parameters: 7.2588; 8.9399; 22.7927; 90; 95.818; 90;

COD ID: 1550441
CIF file	Formula: - C7 H15 I N2 O - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P b c a Cell volume: 4345.11 Cell parameters: 13.4725; 9.8551; 32.7259; 90; 90; 90;

COD ID: 1550442
CIF file	Formula: - C7 H15 Cl N2 O - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 489.35 Cell parameters: 7.2902; 8.9099; 7.8789; 90; 107.024; 90;

COD ID: 1550443
CIF file	Formula: - C7 H15 Br N2 O - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 519.08 Cell parameters: 7.5269; 9.1017; 7.93; 90; 107.161; 90;

COD ID: 1550444
CIF file	Formula: - C7 H15 I N2 O - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 21 21 21 Cell volume: 1071.16 Cell parameters: 7.585; 10.8242; 13.0468; 90; 90; 90;

COD ID: 1550445
CIF file	Formula: - C14 H30 B Cl F4 N4 O2 - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 21 21 21 Cell volume: 2076.76 Cell parameters: 9.4006; 13.2619; 16.6581; 90; 90; 90;

COD ID: 1550446
CIF file	Formula: - C22 H27 Br N2 O4 S - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 21 21 21 Cell volume: 2334.4 Cell parameters: 6.106; 9.0317; 42.33; 90; 90; 90;

COD ID: 1550447
CIF file	Formula: - C22 H27 I N2 O4 S - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 21 21 21 Cell volume: 2417.17 Cell parameters: 6.2219; 9.0228; 43.0569; 90; 90; 90;

COD ID: 1550448
CIF file	Formula: - C22 H27 N3 O7 S - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 21 21 21 Cell volume: 2414.38 Cell parameters: 6.3765; 8.8174; 42.942; 90; 90; 90;

COD ID: 1550449
CIF file	Formula: - C22 H32 N2 O9.5 P S - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 Cell volume: 2595.2 Cell parameters: 8.7929; 12.6645; 23.7867; 82.3345; 81.4117; 89.9824;

COD ID: 1550450
CIF file	Formula: - C15 H24 N2 O5 - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 766.164 Cell parameters: 11.47377; 6.14747; 11.71348; 90; 111.978; 90;

COD ID: 1550451
CIF file	Formula: - C19 H23 Cl N6 O4 - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21/c 1 Cell volume: 2003 Cell parameters: 12.6065; 13.0726; 12.6694; 90; 106.397; 90;

COD ID: 1550452
CIF file	Formula: - C20 H23 Cl N6 O S - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P -1 Cell volume: 2105.9 Cell parameters: 12.1482; 13.1848; 13.8251; 90.263; 90.218; 108.005;

COD ID: 1550453

Formula: - C19 H23 B Cl F4 N5 O -
Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151
Space group: P 1 21/c 1
Cell volume: 2079.49
Cell parameters: 12.46473; 12.98315; 13.42014; 90; 106.765; 90;

COD ID: 1550454
CIF file	Formula: - C16 H21 N O4 S - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 816.998 Cell parameters: 5.72587; 20.83882; 6.92054; 90; 98.3547; 90;

COD ID: 1550455
CIF file	Formula: - C24 H38 N2 O8 - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 Cell volume: 624.781 Cell parameters: 5.8213; 7.27088; 15.90214; 94.7215; 96.6693; 109.525;

COD ID: 1550456
CIF file	Formula: - C24 H38 N2 O9 - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 1302.63 Cell parameters: 6.07189; 32.9414; 7.1383; 90; 114.168; 90;

COD ID: 1550457
CIF file	Formula: - C10 H16 N2 O4 - Comments: Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ 6(1) (2019) 145-151 Space group: P 1 21 1 Cell volume: 1206.7 Cell parameters: 6.0401; 29.3553; 7.3828; 90; 112.806; 90;

COD ID: 1550458

Formula: - C25 H24 Cl4 N2 P2 Pd -
Comments: Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe Dichlorido[1,1-(diphenylphosphino)hydrazide]palladium(II) dichloromethane monosolvate IUCrData 4(1) (2019) x181803
Space group: P 1 21/n 1
Cell volume: 2913.85
Cell parameters: 11.7085; 16.9319; 15.2399; 90; 105.324; 90;

COD ID: 1550459

Formula: - C12 H14 Cl N O3 -
Comments: Rodriguez-Vega, Gibran; Aguirre, Gerardo; Chávez, Daniel Ethyl 4-chloro-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylate IUCrData 4(1) (2019) x190016
Space group: P 1 21/c 1
Cell volume: 1150.3
Cell parameters: 5.7323; 9.2537; 21.6899; 90; 91.168; 90;

COD ID: 1550460

Formula: - C20 H21 N5 O -
Comments: Slassi, Siham; Stetsiuk, Oleh; Amine, Amina; Aarjane, Mohammed; El-Ghayoury, Abdelkrim; Zouihri, Hafid; Yamni, Khalid 2-[(E)-{[3-(1H-Imidazol-1-yl)propyl]imino}methyl]-4-[(E)-(4-methylphenyl)diazenyl]phenol IUCrData 4(1) (2019) x190036
Space group: P 1 2/n 1
Cell volume: 1832.69
Cell parameters: 12.241; 5.9386; 25.2112; 90; 90.317; 90;

COD ID: 1550461

Formula: - C17 H14 O2 -
Comments: Pineda, Leslie W.; Amey, Adam; Cabezas, Jorge A. 5,5-Diphenyl-cis-penta-2,4-dienoic acid IUCrData 4(1) (2019) x181799
Space group: P 1 21/n 1
Cell volume: 1335.81
Cell parameters: 9.0801; 15.4598; 10.092; 90; 109.453; 90;

COD ID: 1550462
CIF file HKL data	Formula: - C52 H50 Cl2 N4 O7 - Comments: Lee, Jae Myoung; Kim, Sung Baek; Sim, Wonbo; Lee, Jai Young 25,27-(3,6,9-Trioxaundecane-1,11-dioxy)-26,28-[3-(4-tricyanoethylene)phenyl]-3-aza-pentane-1,5-dioxy)calix[4]arene dichloromethane monosolvate IUCrData 4(1) (2019) x190026 Space group: P 1 21/n 1 Cell volume: 4431.7 Cell parameters: 13.702; 11.349; 28.538; 90; 92.999; 90;

COD ID: 1550463
CIF file	Formula: - Cu Mg O5 V - Comments: Gake, T.; Matsushita, S.; Arai, M.; Obata, K. Electronic structures and optical properties of CuMgVO4 and AgMgVO4: a first-principles study Journal of the Ceramic Society of Japan 127 (2019) 50-55 Space group: C m c m Cell volume: 317.13 Cell parameters: 5.7716; 8.7145; 6.3052; 90; 90; 90;

COD ID: 1550464
CIF file	Formula: - Ag Mg O5 V - Comments: Gake, T.; Matsushita, S.; Arai, M.; Obata, K. Electronic structures and optical properties of CuMgVO4 and AgMgVO4: a first-principles study Journal of the Ceramic Society of Japan 127 (2019) 50-55 Space group: P n m a Cell volume: 345.964 Cell parameters: 9.5314; 6.7696; 5.3618; 90; 90; 90;

COD ID: 1550465
CIF file	Formula: - C52 H15 Cl2 F20 Ga N4 O2 - Comments: Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 4798.8 Cell parameters: 13.125; 17.799; 21.46; 90; 106.821; 90;

COD ID: 1550466
CIF file	Formula: - C52 H32 Cl0 F20 Ga N4 O5 - Comments: Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 5076.8 Cell parameters: 14.3965; 25.5948; 13.8025; 90; 93.422; 90;

COD ID: 1550467
CIF file	Formula: - C8 H20 Cl3 Ga N4 - Comments: Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science (2019) Space group: P n a 21 Cell volume: 1361.2 Cell parameters: 14.5269; 7.3499; 12.7491; 90; 90; 90;

COD ID: 1550468
CIF file	Formula: - C44 H8 F20 Ga N4 O2 - Comments: Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science (2019) Space group: P 1 21/n 1 Cell volume: 2046.9 Cell parameters: 14.0662; 5.607; 26.055; 90; 95.056; 90;

COD ID: 1550469
CIF file	Formula: - C2 H6 F3 N O6 S2 - Comments: D'Amato, Erica M.; Börgel, Jonas; Ritter, Tobias Aromatic C‒H amination in hexafluoroisopropanol Chemical Science (2019) Space group: P n a 21 Cell volume: 913.8 Cell parameters: 8.9227; 18.531; 5.5268; 90; 90; 90;

COD ID: 1550470
CIF file	Formula: - C34 H58 Al2 Br2 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P -1 Cell volume: 1737.3 Cell parameters: 10.367; 12.452; 15.704; 69.094; 88.918; 67.783;

COD ID: 1550471
CIF file	Formula: - C34 H58 Al2 Br2 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: C 1 c 1 Cell volume: 3530.8 Cell parameters: 19.582; 8.479; 21.301; 90; 93.33; 90;

COD ID: 1550472
CIF file	Formula: - C27 H44 Al2 Br2 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 2960.9 Cell parameters: 8.824; 29.234; 12.125; 90; 108.8; 90;

COD ID: 1550473
CIF file	Formula: - C46 H68 Al2 N2 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P b c a Cell volume: 4191.8 Cell parameters: 17.2467; 13.0572; 18.6141; 90; 90; 90;

COD ID: 1550474
CIF file	Formula: - C17 H29 Al Br2 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 1873 Cell parameters: 9.4; 14.876; 13.886; 90; 105.24; 90;

COD ID: 1550475
CIF file	Formula: - C17 H29 Al2 Br3 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P -1 Cell volume: 1083.5 Cell parameters: 10.6448; 10.6844; 11.1041; 63.541; 81.455; 73.465;

COD ID: 1550476
CIF file	Formula: - C51 H87 Al3 O3 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 5069 Cell parameters: 14.173; 19.091; 19.858; 90; 109.37; 90;

COD ID: 1550477
CIF file	Formula: - C21 H38 Al2 Cl2 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P 1 21 1 Cell volume: 2452.47 Cell parameters: 9.8915; 21.5331; 11.5146; 90; 90.457; 90;

COD ID: 1550478
CIF file	Formula: - C34 H58 Al3 Br3 - Comments: Braunschweig, Holger; Kupfer, Thomas; Hofmann, Alexander; Tröster, Tobias Monomeric Cp3tAl(I): Synthesis, reactivity, and the concept of valence isomerism Chemical Science (2019) Space group: P 1 21/c 1 Cell volume: 3814.6 Cell parameters: 10.1424; 38.371; 10.1825; 90; 105.719; 90;

COD ID: 1550479
CIF file	Formula: - C19 H22 O5 - Comments: Craig, Robert A.; Roizen, Jennifer L.; Smith, Russell C.; Jones, Amanda C.; Virgil, Scott C.; Stoltz, Brian M. Correction: Enantioselective, convergent synthesis of the ineleganolide core by a tandem annulation cascade Chemical Science (2019) Space group: C 1 2 1 Cell volume: 1647.8 Cell parameters: 22.5468; 10.4722; 7.3277; 90; 107.751; 90;

COD ID: 1550480
CIF file	Formula: - C17 H17 Cl N2 O3 - Comments: Wu, Zijun; Wang, Jian A tandem dearomatization/rearomatization strategy: enantioselective N-heterocyclic carbene-catalyzed α-arylation Chemical Science (2019) Space group: P 1 21 1 Cell volume: 771.861 Cell parameters: 7.599; 10.249; 10.488; 90; 109.1; 90;

COD ID: 1550481

Formula: - C23 H26 Br Cl N6 -
Comments: Bourichi, Selma; Kandri Rodi, Youssef; Hökelek, Tuncer; Chakroune, Said; Ouzidan, Younes; Capet, Frédéric 6-Bromo-2-(4-chlorophenyl)-3-[(1-octyl-1H-1,2,3-triazol-4-yl)methyl]-3H-imidazo[4,5-b]pyridine IUCrData 4(1) (2019) x190053
Space group: P 1 21/n 1
Cell volume: 2369.6
Cell parameters: 16.252; 5.3787; 27.109; 90; 90.551; 90;

COD ID: 1550482