Crystallography Open Database

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Searching volume of publication is 141

COD ID: 1007032
CIF file Formula: - Ca H4 N O9 P3 -
Comments: Masse, R; Durif, A; Guitel, J C Structure cristalline du trimetaphosphates Ca N H~4~ P~3~ O~9~, Ca K P~3~ O~9~, Ca Cs P~3~ O~9~ et Ca N H~4~ P~3~ O9 (H~2~ O)~3~ Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 141 (1975) 113-125
Space group: P 1 21/n 1
Cell volume: 932.5
Cell parameters: 7.446; 12.461; 10.05; 90; 90.11; 90;  

COD ID: 1010776
CIF file Formula: - C Cl3 F -
Comments: Wouters, J; De Hemptinne, M Interatomic distances of F C Cl~3~ and F C Br~3~ Nature (London) 141 (1938) 412-413
Space group:
Cell volume:
Cell parameters: ; ; ; ; ; ;  

COD ID: 1010777
CIF file Formula: - Br3 F -
Comments: Wouters, J; De Hemptinne, M Interatomic distances of F C Cl~3~ and F C Br~3~ Nature (London) 141 (1938) 412-413
Space group:
Cell volume:
Cell parameters: ; ; ; ; ; ;  

COD ID: 1509003
CIF file Formula: - Ag0.1 Cu0.9 Y -
Comments: Fujiwara, H.; Kadomatsu, H.; Kurisu, M.; Tokunaga, T.; Kawanishi, Y. Structural phase transitions in Y Cu1-x Mx (M= Ni, Ag and Ga) Journal of the Less-Common Metals 141 (1988) 29-36
Space group: P m -3 m
Cell volume: 43.244
Cell parameters: 3.51; 3.51; 3.51; 90; 90; 90;  

COD ID: 1509227
CIF file Formula: - Ag Be O4 P -
Comments: Gallardo, C.; Hammond, R.P.; Barbier, J. Crystal structures and crystal chemistry of Ag X P O4 (X= Be, Zn) Journal of Solid State Chemistry 141 (1998) 177-185
Space group: P 1 21/n 1
Cell volume: 933.967
Cell parameters: 8.213; 7.884; 14.424; 90; 90.2; 90;  

COD ID: 1509499
CIF file Formula: - Ag O4 P Zn -
Comments: Barbier, J.; Hammond, R.P.; Gallardo, C. Crystal structures and crystal chemistry of Ag X P O4 (X= Be, Zn) Journal of Solid State Chemistry 141 (1998) 177-185
Space group: P 63
Cell volume: 709.613
Cell parameters: 10.218; 10.218; 7.848; 90; 90; 120;  

COD ID: 1510203
CIF file Formula: - Au0.44 Gd In1.56 -
Comments: Kotzyba, G.; Poettgen, R.; Latka, K.; Dronskowski, R.; Goerlich, E.A. Structure, chemical bonding, magnetic susceptibility, and Moessbauer spectroscopy of the antiferromagnets Gd Ag Ge, Gd Au Ge, Gd Au.44 In1.56, and Gd Au In Journal of Solid State Chemistry 141 (1998) 352-364
Space group: P 63/m m c
Cell volume: 147.037
Cell parameters: 4.789; 4.789; 7.403; 90; 90; 120;  

COD ID: 1510253
CIF file Formula: - Au Nb3 -
Comments: Ramakrishnan, S.; Saxena, M. C.; Chandra, G. Effect of Cr and Fe impurities on superconducting A-15 Nb~76~Au~24~ and Ti~75~Sb~25~ Physica B+C 141(2) (1986) 185-190
Space group: P m -3 n
Cell volume: 141.828
Cell parameters: 5.215; 5.215; 5.215; 90; 90; 90;  

COD ID: 1510431
CIF file Formula: - Au2 In Th -
Comments: Benakki, M.; Besnus, M.J.; Panissod, P.; Kappler, J.P.; Meyer, A.; Lehmann, P. Magnetic to non-magnetic transition in (U, Y) In Au2 and (U, Th) In Au2 Journal of the Less-Common Metals 141 (1988) 121-131
Space group: F m -3 m
Cell volume: 353.393
Cell parameters: 7.07; 7.07; 7.07; 90; 90; 90;  

COD ID: 1510474
CIF file Formula: - Au2 U -
Comments: Hulliger, F.; Dommann, A. On the structure types of U Au2 and U14 Au51 Journal of the Less-Common Metals 141 (1988) 261-273
Space group: P -3 m 1
Cell volume: 60.902
Cell parameters: 4.756; 4.756; 3.109; 90; 90; 120;  

COD ID: 1510521
CIF file Formula: - Au0.938 Cr0.062 Nb3 -
Comments: Saxena, M.C.; Chandra, G.; Ramakrishnan, S. Effect of Cr and Fe impurities on superconducting A-15 Nb76 Au24 and Ti75 Sb25 Physica B and C (Netherland) (79,1975-) 141 (1986) 185-190
Space group: P m -3 n
Cell volume: 141.739
Cell parameters: 5.2139; 5.2139; 5.2139; 90; 90; 90;  

COD ID: 1510531
CIF file Formula: - Au0.938 Fe0.062 Nb3 -
Comments: Chandra, G.; Ramakrishnan, S.; Saxena, M.C. Effect of Cr and Fe impurities on superconducting A-15 Nb76 Au24 and Ti75 Sb25 Physica B and C (Netherland) (79,1975-) 141 (1986) 185-190
Space group: P m -3 n
Cell volume: 141.779
Cell parameters: 5.2144; 5.2144; 5.2144; 90; 90; 90;  

COD ID: 1510575
CIF file Formula: - Au51 U14 -
Comments: Hulliger, F.; Dommann, A. On the structure types of U Au2 and U14 Au51 Journal of the Less-Common Metals 141 (1988) 261-273
Space group: P 6/m
Cell volume: 1266.81
Cell parameters: 12.6521; 12.6521; 9.1381; 90; 90; 120;  

COD ID: 1510778
CIF file Formula: - B2 Nb -
Comments: Loennberg, B. Thermal expansion studies on the group IV-VII transition metal diborides Journal of the Less-Common Metals 141 (1988) 145-156
Space group: P 6/m m m
Cell volume: 27.39
Cell parameters: 3.11; 3.11; 3.27; 90; 90; 120;  

COD ID: 1511215
CIF file Formula: - B Li0.93 O5 V2.07 -
Comments: Onoda, M. Crystal structure and electronic state of the disordered S=1 system (Li(x) V(1-x)3) B O5 with x = 0.3 Journal of Solid State Chemistry 141 (1998) 418-423
Space group: P b a m
Cell volume: 335.91
Cell parameters: 9.195; 12.209; 2.9922; 90; 90; 90;  

COD ID: 1516577
CIF file Formula: - Bi4 Co0.3 O11 V1.7 -
Comments: Muller, C.; Anne, M.; Bacmann, M.; Bonnet, M. Structural Studies of the Fast Oxygen Ion Conductor BICOVOX.15 by Single-Crystal Neutron Diffraction at Room Temperature Journal of Solid State Chemistry 141 (1998) 241-247
Space group: I 4/m m m
Cell volume: 238.9
Cell parameters: 3.929; 3.929; 15.476; 90; 90; 90;  

COD ID: 1517722
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n :2
Cell volume: 167.626
Cell parameters: 6.3898; 6.3898; 4.1055; 90; 90; 90;  

COD ID: 1517723
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n :2
Cell volume: 167.939
Cell parameters: 6.3957; 6.3957; 4.1056; 90; 90; 90;  

COD ID: 1517724
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n :2
Cell volume: 168.853
Cell parameters: 6.4038; 6.4038; 4.1175; 90; 90; 90;  

COD ID: 1517725
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n m m :2
Cell volume: 168.966
Cell parameters: 6.4043; 6.4043; 4.1196; 90; 90; 90;  

COD ID: 1517726
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n m m :2
Cell volume: 169.052
Cell parameters: 6.4043; 6.4043; 4.1217; 90; 90; 90;  

COD ID: 1517727
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n m m :2
Cell volume: 169.157
Cell parameters: 6.4038; 6.4038; 4.1249; 90; 90; 90;  

COD ID: 1517728
CIF file Formula: - Nb O5 P -
Comments: Amos, T.G.; Yokochi, A.; Sleight, A.W. Phase transition and negative thermal expansion in tetragonal Nb O P O4 Journal of Solid State Chemistry 141 (1998) 303-307
Space group: P 4/n m m :2
Cell volume: 169.272
Cell parameters: 6.4035; 6.4035; 4.1281; 90; 90; 90;  

COD ID: 1522703
CIF file Formula: - Au Gd In -
Comments: Poettgen, R.; Latka, K.; Kotzyba, G.; Goerlich, E.A.; Dronskowski, R. Structure, chemical bonding, magnetic susceptibility, and Moessbauer spectroscopy of the antiferromagnets Gd Ag Ge, Gd Au Ge, Gd Au.44 In1.56, and Gd Au In Journal of Solid State Chemistry 141 (1998) 352-364
Space group: P -6 2 m
Cell volume: 204.151
Cell parameters: 7.698; 7.698; 3.978; 90; 90; 120;  

COD ID: 1524620
CIF file Formula: - Cu0.9 Ga0.1 Y -
Comments: Kadomatsu, H.; Kurisu, M.; Kawanishi, Y.; Tokunaga, T.; Fujiwara, H. Structural phase transitions in Y Cu1-x Mx (M= Ni, Ag, Ga) Journal of the Less-Common Metals 141 (1988) 29-36
Space group: P m -3 m
Cell volume: 42.582
Cell parameters: 3.492; 3.492; 3.492; 90; 90; 90;  

COD ID: 1524621
CIF file Formula: - Cu0.95 Ni0.05 Y -
Comments: Kadomatsu, H.; Kawanishi, Y.; Kurisu, M.; Tokunaga, T.; Fujiwara, H. Structural phase transitions in Y Cu1-x Mx (M= Ni, Ag, Ga) Journal of the Less-Common Metals 141 (1988) 29-36
Space group: P m -3 m
Cell volume: 41.674
Cell parameters: 3.467; 3.467; 3.467; 90; 90; 90;  

COD ID: 1537384
CIF file Formula: - H16 Na4 O14 Xe -
Comments: Hamilton, W.C.; Ibers, J.A.; MacKenzie, D.R. Geometry of the Perxenate Ion Science 141 (1963) 532-534
Space group: P b c n
Cell volume: 1291.26
Cell parameters: 11.87; 10.47; 10.39; 90; 90; 90;  

COD ID: 1537609
CIF file Formula: - Pr Sb -
Comments: Abdusalyamova, M.N.; Tchuiko, A.G.; Faslyeva, N.D.; Rahmatov, O.I. The phase diagram of the Pr - Sb system Journal of the Less-Common Metals 141 (1988) L23-L26
Space group: F m -3 m
Cell volume: 259.694
Cell parameters: 6.38; 6.38; 6.38; 90; 90; 90;  

COD ID: 1537610
CIF file Formula: - Pr4 Sb3 -
Comments: Abdusalyamova, M.N.; Rahmatov, O.I.; Tchuiko, A.G.; Faslyeva, N.D. The phase diagram of the Pr-Sb system Journal of the Less-Common Metals 141 (1988) L23-L26
Space group: I -4 3 d
Cell volume: 817.4
Cell parameters: 9.35; 9.35; 9.35; 90; 90; 90;  

COD ID: 1538810
CIF file Formula: - Sc Si2 -
Comments: Koleshko, V.M.; Belitsky, V.F.; Khodin, A.A. Thin films of rare earth metal silicides Thin Solid Films 141 (1986) 277-285
Space group: P 6/m m m
Cell volume: 44.896
Cell parameters: 3.66; 3.66; 3.87; 90; 90; 120;  

COD ID: 1538812
CIF file Formula: - Ho Si2 -
Comments: Koleshko, V.M.; Belitsky, V.F.; Khodin, A.A. Thin films of rare earth metal silicides Thin Solid Films 141 (1986) 277-285
Space group: P 6/m m m
Cell volume: 51.793
Cell parameters: 3.816; 3.816; 4.107; 90; 90; 120;  

COD ID: 1539913
CIF file Formula: - Cu2 S -
Comments: Buerger, M.J.; Wuensch, B.J. Distribution of atoms in high chalcocite, Cu2 S Science 141 (1963) 276-277
Space group: P 63/m m c
Cell volume: 90.161
Cell parameters: 3.89; 3.89; 6.88; 90; 90; 120;  

COD ID: 1540165
CIF file Formula: - Ga Li -
Comments: Jang, G.E.; Hentschel, M.P.; Curelaru, I.M. Growth and characterization of large single crystals of the intermetallic compound Li - Ga (Zintl) Journal of Crystal Growth 141 (1994) 399-403
Space group: F d -3 m :1
Cell volume: 234.771
Cell parameters: 6.169; 6.169; 6.169; 90; 90; 90;  

COD ID: 1540298
CIF file Formula: - Si2 Yb -
Comments: Koleshko, V.M.; Belitsky, V.F.; Khodin, A.A. Thin films of rare earth metal silicides Thin Solid Films 141 (1986) 277-285
Space group: P 6/m m m
Cell volume: 50.468
Cell parameters: 3.771; 3.771; 4.098; 90; 90; 120;  

COD ID: 1540717
CIF file Formula: - C14 H11 N O3 -
Comments: Mallick, Suman; Chandra, Falguni; Koner, Apurba L. A ratiometric fluorescent probe for detection of biogenic primary amines with nanomolar sensitivity. The Analyst 141(3) (2016) 827-831
Space group: P -1
Cell volume: 568.75
Cell parameters: 6.916; 8.3188; 10.4144; 76.992; 76.986; 86.369;  

COD ID: 1541251
CIF file Formula: - Mn Se -
Comments: Morocoima, M.; Woolley, J.C.; Quintero, M. T(z) diagram of the Mn3z Ga2(1 - z) Se3 system Physica Status Solidi, Sectio A: Applied Research 141 (1994) 53-58
Space group: F m -3 m
Cell volume: 165.288
Cell parameters: 5.488; 5.488; 5.488; 90; 90; 90;  

COD ID: 1542603
CIF file Formula: - C13 H9 N5 O2 -
Comments: Kaloo, Masood Ayoub; Sunder Raman, Ramya; Sankar, Jeyaraman Novel structurally tuned DAMN receptor for "in situ" diagnosis of bicarbonate in environmental waters. The Analyst 141(8) (2016) 2367-2370
Space group: P 1 21/c 1
Cell volume: 1559.6
Cell parameters: 3.8512; 19.078; 21.23; 90; 91.015; 90;  

COD ID: 1543134
CIF file Formula: - C63 H46 Cl12 F6 Ir N4 P -
Comments: Medina-Rodríguez, Santiago; Denisov, Sergey A.; Cudré, Yanouk; Male, Louise; Marín-Suárez, Marta; Fernández-Gutiérrez, Alberto; Fernández-Sánchez, Jorge F; Tron, Arnaud; Jonusauskas, Gediminas; McClenaghan, Nathan D.; Baranoff, Etienne High performance optical oxygen sensors based on iridium complexes exhibiting interchromophore energy shuttling. The Analyst 141(10) (2016) 3090-3097
Space group: P 1 21/c 1
Cell volume: 6278.1
Cell parameters: 19.7764; 17.2133; 20.4799; 90; 115.774; 90;  

COD ID: 1543135
CIF file Formula: - C77.25 H54.5 Cl2.5 F6 Ir N4 P -
Comments: Medina-Rodríguez, Santiago; Denisov, Sergey A.; Cudré, Yanouk; Male, Louise; Marín-Suárez, Marta; Fernández-Gutiérrez, Alberto; Fernández-Sánchez, Jorge F; Tron, Arnaud; Jonusauskas, Gediminas; McClenaghan, Nathan D.; Baranoff, Etienne High performance optical oxygen sensors based on iridium complexes exhibiting interchromophore energy shuttling. The Analyst 141(10) (2016) 3090-3097
Space group: P -1
Cell volume: 6266.3
Cell parameters: 13.1487; 23.0231; 23.3516; 67.2098; 75.538; 78.319;  

COD ID: 1553242
CIF file Formula: - C18 H27 Cl N2 O -
Comments: Jiménez-Sánchez, Arturo; Santillan, Rosa A photochromic-acidochromic HCl fluorescent probe. An unexpected chloride-directed recognition. The Analyst 141(13) (2016) 4108-4120
Space group: P 1 21/a 1
Cell volume: 1797.47
Cell parameters: 14.388; 6.189; 20.392; 90; 98.16; 90;  

COD ID: 4127220
CIF file Formula: - C24 H36 Ag Bi I8 N4 S4 -
Comments: Jana, Manoj K.; Janke, Svenja M.; Dirkes, David J.; Dovletgeldi, Seyitliyev; Liu, Chi; Qin, Xixi; Gundogdu, Kenan; You, Wei; Blum, Volker; Mitzi, David B. Direct-Bandgap 2D Silver-Bismuth Iodide Double Perovskite: The Structure-Directing Influence of an Oligothiophene Spacer Cation. Journal of the American Chemical Society 141(19) (2019) 7955-7964
Space group: C 1 2/c 1
Cell volume: 2114.1
Cell parameters: 28.951; 6.0992; 11.9821; 90; 92.266; 90;  

COD ID: 4127221
CIF file Formula: - C24 H36 Ag Bi I8 N4 S4 -
Comments: Jana, Manoj K.; Janke, Svenja M.; Dirkes, David J.; Dovletgeldi, Seyitliyev; Liu, Chi; Qin, Xixi; Gundogdu, Kenan; You, Wei; Blum, Volker; Mitzi, David B. Direct-Bandgap 2D Silver-Bismuth Iodide Double Perovskite: The Structure-Directing Influence of an Oligothiophene Spacer Cation. Journal of the American Chemical Society 141(19) (2019) 7955-7964
Space group: C 1 2/c 1
Cell volume: 2172.66
Cell parameters: 29.3654; 6.1473; 12.0494; 90; 92.7321; 90;  

COD ID: 4127222
CIF file Formula: - C25 H40 O8 -
Comments: Turlik, Aneta; Chen, Yifeng; Scruse, Anthony C.; Newhouse, Timothy R. Convergent Total Synthesis of Principinol D, a Rearranged Kaurane Diterpenoid. Journal of the American Chemical Society 141(20) (2019) 8088-8092
Space group: P 21 21 21
Cell volume: 2447.5
Cell parameters: 9.1723; 13.1708; 20.2598; 90; 90; 90;  

COD ID: 4127223
CIF file Formula: - C34 H52 N P -
Comments: Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Kim, Youngsuk; Stephan, Douglas W. Reversible Intramolecular Cycloaddition of Phosphaalkene to an Arene Ring. Journal of the American Chemical Society 141(20) (2019) 8083-8087
Space group: P 1 2/n 1
Cell volume: 2944.1
Cell parameters: 16.497; 8.9713; 20.61; 90; 105.159; 90;  

COD ID: 4127224
CIF file Formula: - C28 H46 N P -
Comments: Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Kim, Youngsuk; Stephan, Douglas W. Reversible Intramolecular Cycloaddition of Phosphaalkene to an Arene Ring. Journal of the American Chemical Society 141(20) (2019) 8083-8087
Space group: P 1 21/n 1
Cell volume: 2570
Cell parameters: 11.104; 15.85; 14.68; 90; 95.94; 90;  

COD ID: 4127225
CIF file Formula: - C36.5 H59 N P S -
Comments: Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Kim, Youngsuk; Stephan, Douglas W. Reversible Intramolecular Cycloaddition of Phosphaalkene to an Arene Ring. Journal of the American Chemical Society 141(20) (2019) 8083-8087
Space group: P 1 21/n 1
Cell volume: 3221.9
Cell parameters: 10.144; 16.2799; 20.1295; 90; 104.252; 90;  

COD ID: 4127226
CIF file Formula: - C39 H57 F4 N O3 P S -
Comments: Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Kim, Youngsuk; Stephan, Douglas W. Reversible Intramolecular Cycloaddition of Phosphaalkene to an Arene Ring. Journal of the American Chemical Society 141(20) (2019) 8083-8087
Space group: P -1
Cell volume: 1834
Cell parameters: 11.096; 11.353; 16.047; 76.64; 69.873; 79.271;  

COD ID: 4127227
CIF file Formula: - C52 H73 Co N3 O -
Comments: Wang, Dongyang; Leng, Xuebing; Ye, Shengfa; Deng, Liang Substrate Redox Non-innocence Inducing Stepwise Oxidative Addition Reaction: Nitrosoarene C-N Bond Cleavage on Low-Coordinate Cobalt(0) Species. Journal of the American Chemical Society 141(19) (2019) 7731-7735
Space group: P b c a
Cell volume: 9404.9
Cell parameters: 18.4913; 20.3554; 24.9867; 90; 90; 90;  

COD ID: 4127228
CIF file Formula: - C63 H94 Co N4 O2 -
Comments: Wang, Dongyang; Leng, Xuebing; Ye, Shengfa; Deng, Liang Substrate Redox Non-innocence Inducing Stepwise Oxidative Addition Reaction: Nitrosoarene C-N Bond Cleavage on Low-Coordinate Cobalt(0) Species. Journal of the American Chemical Society 141(19) (2019) 7731-7735
Space group: P 1 21/c 1
Cell volume: 6452.3
Cell parameters: 28.843; 11.3664; 20.0835; 90; 101.489; 90;  

COD ID: 4127229
CIF file Formula: - C81 H70 B F4 Fe2 N5.5 O0.5 S4 -
Comments: Wang, Lianke; Gennari, Marcello; Cantú Reinhard, Fabián G; Gutiérrez, Javier; Morozan, Adina; Philouze, Christian; Demeshko, Serhiy; Artero, Vincent; Meyer, Franc; de Visser, Sam P.; Duboc, Carole A Non-Heme Diiron Complex for (Electro)catalytic Reduction of Dioxygen: Tuning the Selectivity through Electron Delivery. Journal of the American Chemical Society 141(20) (2019) 8244-8253
Space group: P 1 21/c 1
Cell volume: 6874
Cell parameters: 15.999; 17.341; 25.848; 90; 106.54; 90;  

COD ID: 4127230
CIF file Formula: - C94 H150 B2 K2 N8 O14 -
Comments: Loh, Ying Kai; Porteous, Kieran; Fuentes, M Ángeles; Do, Dinh Cao Huan; Hicks, Jamie; Aldridge, Simon An Acid-Free Anionic Oxoborane Isoelectronic with Carbonyl: Facile Access and Transfer of a Terminal B═O Double Bond. Journal of the American Chemical Society 141(20) (2019) 8073-8077
Space group: P 1
Cell volume: 4930.84
Cell parameters: 13.8502; 16.6927; 23.0193; 90.251; 90.387; 112.097;  

COD ID: 4127231
CIF file Formula: - C68 H96 B K N4 O6 S -
Comments: Loh, Ying Kai; Porteous, Kieran; Fuentes, M Ángeles; Do, Dinh Cao Huan; Hicks, Jamie; Aldridge, Simon An Acid-Free Anionic Oxoborane Isoelectronic with Carbonyl: Facile Access and Transfer of a Terminal B═O Double Bond. Journal of the American Chemical Society 141(20) (2019) 8073-8077
Space group: P -1
Cell volume: 3345.71
Cell parameters: 13.0099; 15.9376; 16.4118; 80.367; 86.833; 86.675;  

COD ID: 4127232
CIF file Formula: - C125 H165 B4 K4 N8 S4 -
Comments: Loh, Ying Kai; Porteous, Kieran; Fuentes, M Ángeles; Do, Dinh Cao Huan; Hicks, Jamie; Aldridge, Simon An Acid-Free Anionic Oxoborane Isoelectronic with Carbonyl: Facile Access and Transfer of a Terminal B═O Double Bond. Journal of the American Chemical Society 141(20) (2019) 8073-8077
Space group: P -1
Cell volume: 6224.4
Cell parameters: 15.5333; 16.3399; 27.911; 85.492; 89.509; 61.864;  

COD ID: 4127233
CIF file Formula: - C32 H41 B F3 N3 O3 S -
Comments: Loh, Ying Kai; Porteous, Kieran; Fuentes, M Ángeles; Do, Dinh Cao Huan; Hicks, Jamie; Aldridge, Simon An Acid-Free Anionic Oxoborane Isoelectronic with Carbonyl: Facile Access and Transfer of a Terminal B═O Double Bond. Journal of the American Chemical Society 141(20) (2019) 8073-8077
Space group: P 1 21/c 1
Cell volume: 3218.88
Cell parameters: 11.8476; 13.6268; 19.9995; 90; 94.496; 90;  

COD ID: 4127234
CIF file Formula: - C59 H86 B K N6 O7 -
Comments: Loh, Ying Kai; Porteous, Kieran; Fuentes, M Ángeles; Do, Dinh Cao Huan; Hicks, Jamie; Aldridge, Simon An Acid-Free Anionic Oxoborane Isoelectronic with Carbonyl: Facile Access and Transfer of a Terminal B═O Double Bond. Journal of the American Chemical Society 141(20) (2019) 8073-8077
Space group: P 1 21/c 1
Cell volume: 5928.08
Cell parameters: 12.2444; 15.9465; 30.3954; 90; 92.74; 90;  

COD ID: 4127235
CIF file Formula: - C8 H32 Br10 N4 Pb3 -
Comments: Wang, Sasa; Liu, Xitao; Li, Lina; Ji, Chengmin; Sun, Zhihua; Wu, Zhenyue; Hong, Maochun; Luo, Junhua An Unprecedented Biaxial Trilayered Hybrid Perovskite Ferroelectric with Directionally Tunable Photovoltaic Effects. Journal of the American Chemical Society 141(19) (2019) 7693-7697
Space group: I 4/m m m
Cell volume: 1690.8
Cell parameters: 6.008; 6.008; 46.843; 90; 90; 90;  

COD ID: 4127236
CIF file Formula: - C8 H32 Br10 N4 Pb3 -
Comments: Wang, Sasa; Liu, Xitao; Li, Lina; Ji, Chengmin; Sun, Zhihua; Wu, Zhenyue; Hong, Maochun; Luo, Junhua An Unprecedented Biaxial Trilayered Hybrid Perovskite Ferroelectric with Directionally Tunable Photovoltaic Effects. Journal of the American Chemical Society 141(19) (2019) 7693-7697
Space group: C 2 e b
Cell volume: 3286.9
Cell parameters: 8.4247; 46.305; 8.4256; 90; 90; 90;  

COD ID: 4127237
CIF file Formula: - C78 H48 -
Comments: Xu, Kun; Urgel, José I; Eimre, Kristjan; Di Giovannantonio, Marco; Keerthi, Ashok; Komber, Hartmut; Wang, Shiyong; Narita, Akimitsu; Berger, Reinhard; Ruffieux, Pascal; Pignedoli, Carlo A.; Liu, Junzhi; Müllen, Klaus; Fasel, Roman; Feng, Xinliang On-Surface Synthesis of a Nonplanar Porous Nanographene. Journal of the American Chemical Society 141(19) (2019) 7726-7730
Space group: P b c n
Cell volume: 6579.9
Cell parameters: 19.8397; 16.8728; 19.6562; 90; 90; 90;  

COD ID: 4127238
CIF file Formula: - C39 H41 F6 Mo N3 O7 S2 -
Comments: Herz, Katharina; Podewitz, Maren; Stöhr, Laura; Wang, Dongren; Frey, Wolfgang; Liedl, Klaus R.; Sen, Suman; Buchmeiser, Michael R. Mechanism of Olefin Metathesis with Neutral and Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes. Journal of the American Chemical Society 141(20) (2019) 8264-8276
Space group: P n a 21
Cell volume: 4036.9
Cell parameters: 19.107; 12.1469; 17.3938; 90; 90; 90;  

COD ID: 4127239
CIF file Formula: - C44 H51 Cl2 F6 Mo N3 O6 S2 -
Comments: Herz, Katharina; Podewitz, Maren; Stöhr, Laura; Wang, Dongren; Frey, Wolfgang; Liedl, Klaus R.; Sen, Suman; Buchmeiser, Michael R. Mechanism of Olefin Metathesis with Neutral and Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes. Journal of the American Chemical Society 141(20) (2019) 8264-8276
Space group: P n a 21
Cell volume: 4833.2
Cell parameters: 22.397; 18.0764; 11.9381; 90; 90; 90;  

COD ID: 4127240
CIF file Formula: - C46 H47 Cl2 F8 Mo N3 O5 S -
Comments: Herz, Katharina; Podewitz, Maren; Stöhr, Laura; Wang, Dongren; Frey, Wolfgang; Liedl, Klaus R.; Sen, Suman; Buchmeiser, Michael R. Mechanism of Olefin Metathesis with Neutral and Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes. Journal of the American Chemical Society 141(20) (2019) 8264-8276
Space group: P -1
Cell volume: 2662.2
Cell parameters: 12.6134; 13.4666; 16.8383; 85.916; 73.747; 75.819;  

COD ID: 4127241
CIF file Formula: - C17 H15 N3 O2 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: P b c m
Cell volume: 1497
Cell parameters: 15.1332; 15.1; 6.5509; 90; 90; 90;  

COD ID: 4127242
CIF file Formula: - C16 H15 N3 O4 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: C 1 2/c 1
Cell volume: 2973.3
Cell parameters: 19.898; 20.674; 7.2318; 90; 91.89; 90;  

COD ID: 4127243
CIF file Formula: - C18 H21 N3 O2 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: P 1 21/c 1
Cell volume: 1633.9
Cell parameters: 7.3582; 9.6426; 23.096; 90; 94.383; 90;  

COD ID: 4127244
CIF file Formula: - C18 H20 N4 O4 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: P 1 21/c 1
Cell volume: 1740.3
Cell parameters: 16.43; 6.9255; 15.304; 90; 92.064; 90;  

COD ID: 4127245
CIF file Formula: - C16 H15 N3 O4 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: P 1 21/c 1
Cell volume: 1523.51
Cell parameters: 15.4094; 6.7356; 15.5716; 90; 109.499; 90;  

COD ID: 4127246
CIF file Formula: - C17 H18 N2 O3 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: C 1 c 1
Cell volume: 1509.7
Cell parameters: 17.0954; 12.4698; 7.1665; 90; 98.801; 90;  

COD ID: 4127247
CIF file Formula: - C16 H16 N2 O2 -
Comments: Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. Journal of the American Chemical Society 141(20) (2019) 8364-8371
Space group: A e a 2
Cell volume: 2822.7
Cell parameters: 21.686; 17.836; 7.2977; 90; 90; 90;  

COD ID: 4127249
CIF file Formula: - C317.33 H285.48 B34.92 Cs0.36 F2.7 Fe4 N37.58 O8.8 S0.9 -
Comments: Zhang, Dawei; Ronson, Tanya K.; Greenfield, Jake L.; Brotin, Thierry; Berthault, Patrick; Léonce, Estelle; Zhu, Jun-Long; Xu, Lin; Nitschke, Jonathan R. Enantiopure [Cs<sup>+</sup>/Xe⊂Cryptophane]⊂Fe<sup>II</sup><sub>4</sub>L<sub>4</sub> Hierarchical Superstructures. Journal of the American Chemical Society 141(20) (2019) 8339-8345
Space group: P 1 21/n 1
Cell volume: 91344
Cell parameters: 31.1172; 59.4899; 49.3791; 90; 92.154; 90;  

COD ID: 4127250
CIF file Formula: - C40.67 H22.33 B12 F20 N4 -
Comments: Liu, Yizhen; Su, Bo; Dong, Weishi; Li, Zhen Hua; Wang, Huadong Structural Characterization of a Boron(III) η<sup>2</sup>-σ-Silane-Complex. Journal of the American Chemical Society 141(20) (2019) 8358-8363
Space group: P c a 21
Cell volume: 9533
Cell parameters: 19.568; 13.466; 36.178; 90; 90; 90;  

COD ID: 4127251
CIF file Formula: - C45 H45 B12 Br F20 N2 Si -
Comments: Liu, Yizhen; Su, Bo; Dong, Weishi; Li, Zhen Hua; Wang, Huadong Structural Characterization of a Boron(III) η<sup>2</sup>-σ-Silane-Complex. Journal of the American Chemical Society 141(20) (2019) 8358-8363
Space group: P 1 21/n 1
Cell volume: 5269.3
Cell parameters: 11.1361; 19.7611; 23.9982; 90; 93.821; 90;  

COD ID: 4127252
CIF file Formula: - C9 H25 B11 N2 -
Comments: Liu, Yizhen; Su, Bo; Dong, Weishi; Li, Zhen Hua; Wang, Huadong Structural Characterization of a Boron(III) η<sup>2</sup>-σ-Silane-Complex. Journal of the American Chemical Society 141(20) (2019) 8358-8363
Space group: P n m a
Cell volume: 1715.5
Cell parameters: 12.895; 13.313; 9.993; 90; 90; 90;  

COD ID: 4127253
CIF file Formula: - C42 H33.5 Br0.5 Co0.5 N -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: C 1 2/c 1
Cell volume: 6380.6
Cell parameters: 15.9671; 22.041; 18.9148; 90; 106.561; 90;  

COD ID: 4127254
CIF file Formula: - C84 H67 Co N2 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: P -1
Cell volume: 3176
Cell parameters: 12.594; 14.092; 20.413; 75.348; 84.047; 64.97;  

COD ID: 4127255
CIF file Formula: - C79 H70 Co N3 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: P -1
Cell volume: 2992.5
Cell parameters: 11.9404; 16.2194; 16.2288; 87.845; 87.553; 72.424;  

COD ID: 4127256
CIF file Formula: - C74 H68 Co N3 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: P -1
Cell volume: 3013.8
Cell parameters: 12.0205; 16.024; 16.411; 87.612; 72.643; 88.139;  

COD ID: 4127257
CIF file Formula: - C166 H144 Co2 N6 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: P -1
Cell volume: 6165.2
Cell parameters: 16.068; 16.5966; 24.9849; 74.791; 73.522; 85.35;  

COD ID: 4127258
CIF file Formula: - C80 H79 Co N6 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: P 1 21/c 1
Cell volume: 6954.5
Cell parameters: 12.7287; 16.217; 33.8667; 90; 95.843; 90;  

COD ID: 4127259
CIF file Formula: - C88 H97 Co N6 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: P 1 21/c 1
Cell volume: 7190.8
Cell parameters: 13.4875; 16.1414; 33.4198; 90; 98.765; 90;  

COD ID: 4127260
CIF file Formula: - C86 H79 Co N6 -
Comments: Baek, Yunjung; Betley, Theodore A. Catalytic C-H Amination Mediated by Dipyrrin Cobalt Imidos. Journal of the American Chemical Society 141(19) (2019) 7797-7806
Space group: C 1 2/c 1
Cell volume: 15869
Cell parameters: 47.858; 18.405; 18.553; 90; 103.82; 90;  

COD ID: 4127262
CIF file Formula: - C96 H126 B Br Fe O6 P3 -
Comments: Nesbit, Mark A.; Oyala, Paul H.; Peters, Jonas C. Characterization of the Earliest Intermediate of Fe-N<sub>2</sub> Protonation: CW and Pulse EPR Detection of an Fe-NNH Species and Its Evolution to Fe-NNH<sub>2</sub><sup/>. Journal of the American Chemical Society 141(20) (2019) 8116-8127
Space group: P -1
Cell volume: 4386
Cell parameters: 13.3439; 13.9184; 25.1806; 93.843; 90.086; 109.902;  

COD ID: 4127263
CIF file Formula: - C101 H138 B Fe N2 O6 P3 -
Comments: Nesbit, Mark A.; Oyala, Paul H.; Peters, Jonas C. Characterization of the Earliest Intermediate of Fe-N<sub>2</sub> Protonation: CW and Pulse EPR Detection of an Fe-NNH Species and Its Evolution to Fe-NNH<sub>2</sub><sup/>. Journal of the American Chemical Society 141(20) (2019) 8116-8127
Space group: P -1
Cell volume: 4695.3
Cell parameters: 11.8779; 14.7827; 27.0968; 86.055; 81.569; 89.245;  

COD ID: 4127264
CIF file Formula: - C20 H48 Br N2 P4 Re -
Comments: Shanahan, James P.; Szymczak, Nathaniel K. Hydrogen Bonding to a Dinitrogen Complex at Room Temperature: Impacts on N<sub>2</sub> Activation. Journal of the American Chemical Society 141(21) (2019) 8550-8556
Space group: P -1
Cell volume: 669.13
Cell parameters: 7.9408; 8.7181; 10.1314; 94.734; 99.553; 102.843;  

COD ID: 4127265
CIF file Formula: - C14 H18 N2 O8 S -
Comments: Zeng, Jing; Wang, Ruobin; Zhang, Shuxin; Fang, Jing; Liu, Shanshan; Sun, Guangfei; Xu, Bingbing; Xiao, Ying; Fu, Dengxian; Zhang, Wenqi; Hu, Yixin; Wan, Qian Hydrogen-Bonding-Assisted Exogenous Nucleophilic Reagent Effect for β-Selective Glycosylation of Rare 3-Amino Sugars. Journal of the American Chemical Society 141(21) (2019) 8509-8515
Space group: P 21 21 21
Cell volume: 1688.58
Cell parameters: 7.6915; 13.4945; 16.2687; 90; 90; 90;  

COD ID: 4127266
CIF file Formula: - C H0 I3 N2.503 Pb0.388 Sn0.412 -
Comments: Ke, Weijun; Spanopoulos, Ioannis; Tu, Qing; Hadar, Ido; Li, Xiaotong; Shekhawat, Gajendra S.; Dravid, Vinayak P.; Kanatzidis, Mercouri G. Ethylenediammonium-Based "Hollow" Pb/Sn Perovskites with Ideal Band Gap Yield Solar Cells with Higher Efficiency and Stability. Journal of the American Chemical Society 141(21) (2019) 8627-8637
Space group: P m -3 m
Cell volume: 251.419
Cell parameters: 6.3115; 6.3115; 6.3115; 90; 90; 90;  

COD ID: 4127267
CIF file Formula: - C H0 I3 N0.96 Pb0.524 Sn0.433 -
Comments: Ke, Weijun; Spanopoulos, Ioannis; Tu, Qing; Hadar, Ido; Li, Xiaotong; Shekhawat, Gajendra S.; Dravid, Vinayak P.; Kanatzidis, Mercouri G. Ethylenediammonium-Based "Hollow" Pb/Sn Perovskites with Ideal Band Gap Yield Solar Cells with Higher Efficiency and Stability. Journal of the American Chemical Society 141(21) (2019) 8627-8637
Space group: P m -3 m
Cell volume: 250.8
Cell parameters: 6.3063; 6.3063; 6.3063; 90; 90; 90;  

COD ID: 4127268
CIF file Formula: - C13 H21 N O3 S -
Comments: Hugelshofer, Cedric L.; Palani, Vignesh; Sarpong, Richmond Calyciphylline B-Type Alkaloids: Total Syntheses of (-)-Daphlongamine H and (-)-Isodaphlongamine H. Journal of the American Chemical Society 141(21) (2019) 8431-8435
Space group: P 21 21 21
Cell volume: 1405.28
Cell parameters: 6.1765; 9.2268; 24.6586; 90; 90; 90;  

COD ID: 4127269
CIF file Formula: - C288 H378 Co18 N8 O103 -
Comments: Hu, Xiangquan; Chai, Jie; Zhang, Chen; Lang, Jinxin; Kelley, Steven P.; Feng, Sisi; Liu, Bin; Atwood, David A.; Atwood, Jerry L. Biomimetic Self-Assembly of Co<sup>II</sup>-Seamed Hexameric Metal-Organic Nanocapsules. Journal of the American Chemical Society 141(23) (2019) 9151-9154
Space group: C 1 2/m 1
Cell volume: 19324
Cell parameters: 27.458; 36.623; 21.558; 90; 116.955; 90;  

COD ID: 4127270
CIF file Formula: - C48 H100 N36 Ni8 O48.5 -
Comments: Miyake, Ryosuke; Ando, Akira; Ueno, Manami; Muraoka, Takahiro Formation of Giant and Small Cyclic Complexes from a Flexible Tripeptide Ligand Controlled by Metal Coordination and Hydrogen Bonds. Journal of the American Chemical Society 141(22) (2019) 8675-8679
Space group: C 1 c 1
Cell volume: 9965
Cell parameters: 10.769; 42.392; 21.858; 90; 92.984; 90;  

COD ID: 4127271
CIF file Formula: - C216 H180 Ag32 Cd12 Se36 -
Comments: Bootharaju, Megalamane S.; Chang, Hogeun; Deng, Guocheng; Malola, Sami; Baek, Woonhyuk; Häkkinen, Hannu; Zheng, Nanfeng; Hyeon, Taeghwan Cd<sub>12</sub>Ag<sub>32</sub>(SePh)<sub>36</sub>: Non-Noble Metal Doped Silver Nanoclusters. Journal of the American Chemical Society 141(21) (2019) 8422-8425
Space group: P -1
Cell volume: 12923.8
Cell parameters: 19.2821; 19.3677; 34.7903; 88.3916; 86.2435; 85.6543;  

COD ID: 4127272
CIF file Formula: - C39 H51 Ag N2 -
Comments: Hamze, Rasha; Shi, Shuyang; Kapper, Savannah C.; Muthiah Ravinson, Daniel Sylvinson; Estergreen, Laura; Jung, Moon-Chul; Tadle, Abegail C.; Haiges, Ralf; Djurovich, Peter I.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy; Bradforth, Stephen E.; Thompson, Mark E. "Quick-Silver" from a Systematic Study of Highly Luminescent, Two-Coordinate, d<sup>10</sup> Coinage Metal Complexes. Journal of the American Chemical Society 141(21) (2019) 8616-8626
Space group: P 1 21 1
Cell volume: 3487.1
Cell parameters: 9.786; 18.799; 18.955; 90; 90.261; 90;  

COD ID: 4127273
CIF file Formula: - C27 H43 Ag Cl N -
Comments: Hamze, Rasha; Shi, Shuyang; Kapper, Savannah C.; Muthiah Ravinson, Daniel Sylvinson; Estergreen, Laura; Jung, Moon-Chul; Tadle, Abegail C.; Haiges, Ralf; Djurovich, Peter I.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy; Bradforth, Stephen E.; Thompson, Mark E. "Quick-Silver" from a Systematic Study of Highly Luminescent, Two-Coordinate, d<sup>10</sup> Coinage Metal Complexes. Journal of the American Chemical Society 141(21) (2019) 8616-8626
Space group: P 1 21 1
Cell volume: 1327
Cell parameters: 9.17; 15.012; 9.662; 90; 93.909; 90;  

COD ID: 4127274
CIF file Formula: - C39 H51 Au N2 -
Comments: Hamze, Rasha; Shi, Shuyang; Kapper, Savannah C.; Muthiah Ravinson, Daniel Sylvinson; Estergreen, Laura; Jung, Moon-Chul; Tadle, Abegail C.; Haiges, Ralf; Djurovich, Peter I.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy; Bradforth, Stephen E.; Thompson, Mark E. "Quick-Silver" from a Systematic Study of Highly Luminescent, Two-Coordinate, d<sup>10</sup> Coinage Metal Complexes. Journal of the American Chemical Society 141(21) (2019) 8616-8626
Space group: P 1 21/c 1
Cell volume: 3441.2
Cell parameters: 9.808; 18.5499; 18.9205; 90; 91.464; 90;  

COD ID: 4127275
CIF file Formula: - C42 H50 Au N3 O -
Comments: Hamze, Rasha; Shi, Shuyang; Kapper, Savannah C.; Muthiah Ravinson, Daniel Sylvinson; Estergreen, Laura; Jung, Moon-Chul; Tadle, Abegail C.; Haiges, Ralf; Djurovich, Peter I.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy; Bradforth, Stephen E.; Thompson, Mark E. "Quick-Silver" from a Systematic Study of Highly Luminescent, Two-Coordinate, d<sup>10</sup> Coinage Metal Complexes. Journal of the American Chemical Society 141(21) (2019) 8616-8626
Space group: C 1 2/c 1
Cell volume: 3813
Cell parameters: 13.575; 23.606; 12.982; 90; 113.56; 90;  

COD ID: 4127276
CIF file Formula: - C42 H50 Ag N3 O -
Comments: Hamze, Rasha; Shi, Shuyang; Kapper, Savannah C.; Muthiah Ravinson, Daniel Sylvinson; Estergreen, Laura; Jung, Moon-Chul; Tadle, Abegail C.; Haiges, Ralf; Djurovich, Peter I.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy; Bradforth, Stephen E.; Thompson, Mark E. "Quick-Silver" from a Systematic Study of Highly Luminescent, Two-Coordinate, d<sup>10</sup> Coinage Metal Complexes. Journal of the American Chemical Society 141(21) (2019) 8616-8626
Space group: C 1 2/c 1
Cell volume: 3825
Cell parameters: 13.63; 23.89; 12.85; 90; 113.92; 90;  

COD ID: 4127277
CIF file Formula: - C15 H17 F2 N O -
Comments: Flodén, Nils J; Trowbridge, Aaron; Willcox, Darren; Walton, Scarlett M.; Kim, Yongjoon; Gaunt, Matthew J. Streamlined Synthesis of C(sp<sup>3</sup>)-Rich N-Heterospirocycles Enabled by Visible-Light-Mediated Photocatalysis. Journal of the American Chemical Society 141(21) (2019) 8426-8430
Space group: P -1
Cell volume: 661.16
Cell parameters: 5.7759; 10.3846; 11.5759; 76.493; 89.622; 78.571;  

COD ID: 4127278
CIF file Formula: - C19 H26 N2 O2 -
Comments: Flodén, Nils J; Trowbridge, Aaron; Willcox, Darren; Walton, Scarlett M.; Kim, Yongjoon; Gaunt, Matthew J. Streamlined Synthesis of C(sp<sup>3</sup>)-Rich N-Heterospirocycles Enabled by Visible-Light-Mediated Photocatalysis. Journal of the American Chemical Society 141(21) (2019) 8426-8430
Space group: P 1 2/c 1
Cell volume: 1767.9
Cell parameters: 16.556; 5.9897; 17.839; 90; 92.033; 90;  

COD ID: 4127279
CIF file Formula: - C29 H34 N2 O3 S -
Comments: Devannah, Vijayarajan; Sharma, Rajgopal; Watson, Donald A. Nickel-Catalyzed Asymmetric C-Alkylation of Nitroalkanes: Synthesis of Enantioenriched β-Nitroamides. Journal of the American Chemical Society 141(21) (2019) 8436-8440
Space group: P 21 21 21
Cell volume: 2704.74
Cell parameters: 11.443; 14.658; 16.1254; 90; 90; 90;  

COD ID: 4127280
CIF file Formula: - C21 H24 N2 O5 -
Comments: Devannah, Vijayarajan; Sharma, Rajgopal; Watson, Donald A. Nickel-Catalyzed Asymmetric C-Alkylation of Nitroalkanes: Synthesis of Enantioenriched β-Nitroamides. Journal of the American Chemical Society 141(21) (2019) 8436-8440
Space group: P 21 21 21
Cell volume: 1995.63
Cell parameters: 9.7516; 13.2713; 15.4202; 90; 90; 90;  

COD ID: 4127281
CIF file Formula: - C15 H20 N2 O3 -
Comments: Devannah, Vijayarajan; Sharma, Rajgopal; Watson, Donald A. Nickel-Catalyzed Asymmetric C-Alkylation of Nitroalkanes: Synthesis of Enantioenriched β-Nitroamides. Journal of the American Chemical Society 141(21) (2019) 8436-8440
Space group: P 21 21 21
Cell volume: 1472.48
Cell parameters: 9.4957; 12.3869; 12.5187; 90; 90; 90;  

COD ID: 4127296
CIF file Formula: - C18 H10 O40 Zr6 -
Comments: Wang, Sujing; Xhaferaj, Nertil; Wahiduzzaman, Mohammad; Oyekan, Kolade; Li, Xiao; Wei, Kevin; Zheng, Bin; Tissot, Antoine; Marrot, Jérôme; Shepard, William; Martineau-Corcos, Charlotte; Filinchuk, Yaroslav; Tan, Kui; Maurin, Guillaume; Serre, Christian Engineering Structural Dynamics of Zirconium Metal-Organic Frameworks Based on Natural C4 Linkers. Journal of the American Chemical Society 141(43) (2019) 17207-17216
Space group: I m m m
Cell volume: 2367.6
Cell parameters: 10; 11.94; 19.829; 90; 90; 90;  

COD ID: 4127338
CIF file Formula: - C20 H24 O5 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: P 65
Cell volume: 3086.17
Cell parameters: 13.2016; 13.2016; 20.4473; 90; 90; 120;  

COD ID: 4127339
CIF file Formula: - C25 H48 O4 Si2 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: P 1 21/c 1
Cell volume: 5861.8
Cell parameters: 13.1614; 13.9623; 32.099; 90; 96.405; 90;  

COD ID: 4127340
CIF file Formula: - C17 H20 O2 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: P -1
Cell volume: 1383.24
Cell parameters: 6.0694; 12.5162; 19.1277; 73.301; 83.663; 87.804;  

COD ID: 4127341
CIF file Formula: - C30 H54 O5 Si2 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: P 1 21/c 1
Cell volume: 3276.47
Cell parameters: 7.4362; 42.8598; 10.2836; 90; 91.457; 90;  

COD ID: 4127342
CIF file Formula: - C10 H14 O4 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: C 1 2/c 1
Cell volume: 2010.28
Cell parameters: 21.1666; 7.7501; 12.954; 90; 108.914; 90;  

COD ID: 4127343
CIF file Formula: - C18 H22 O5 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: P 1 21/c 1
Cell volume: 3236.48
Cell parameters: 14.9673; 10.4532; 20.7264; 90; 93.571; 90;  

COD ID: 4127344
CIF file Formula: - C14 H22 O4 -
Comments: Zhang, Jianpeng; Li, Zijian; Zhuo, Junming; Cui, Yue; Han, Ting; Li, Chao Tandem Decarboxylative Cyclization/Alkenylation Strategy for Total Syntheses of (+)-Longirabdiol, (-)-Longirabdolactone, and (-)-Effusin. Journal of the American Chemical Society 141(20) (2019) 8372-8380
Space group: P 1 21/c 1
Cell volume: 1389.13
Cell parameters: 6.5809; 19.9485; 10.8622; 90; 103.053; 90;  

COD ID: 4127345
CIF file Formula: - C10.62 H7 Hf0.75 O5 V0.1 -
Comments: Wang, Xingjie; Zhang, Xuan; Li, Peng; Otake, Ken-Ichi; Cui, Yuexing; Lyu, Jiafei; Krzyaniak, Matthew D.; Zhang, Yuanyuan; Li, Zhanyong; Liu, Jian; Buru, Cassandra T.; Islamoglu, Timur; Wasielewski, Michael R.; Li, Zhong; Farha, Omar K. Vanadium Catalyst on Isostructural Transition Metal, Lanthanide, and Actinide Based Metal-Organic Frameworks for Alcohol Oxidation. Journal of the American Chemical Society 141(20) (2019) 8306-8314
Space group: P m -3 m
Cell volume: 22497.4
Cell parameters: 28.23; 28.23; 28.23; 90; 90; 90;  

COD ID: 4127346
CIF file Formula: - C40 H28 Hf3 O16 -
Comments: Wang, Xingjie; Zhang, Xuan; Li, Peng; Otake, Ken-Ichi; Cui, Yuexing; Lyu, Jiafei; Krzyaniak, Matthew D.; Zhang, Yuanyuan; Li, Zhanyong; Liu, Jian; Buru, Cassandra T.; Islamoglu, Timur; Wasielewski, Michael R.; Li, Zhong; Farha, Omar K. Vanadium Catalyst on Isostructural Transition Metal, Lanthanide, and Actinide Based Metal-Organic Frameworks for Alcohol Oxidation. Journal of the American Chemical Society 141(20) (2019) 8306-8314
Space group: P m -3 m
Cell volume: 22004.7
Cell parameters: 28.0224; 28.0224; 28.0224; 90; 90; 90;  

COD ID: 4127347
CIF file Formula: - C10.62 H7 O5.2 V0.1 Zr0.75 -
Comments: Wang, Xingjie; Zhang, Xuan; Li, Peng; Otake, Ken-Ichi; Cui, Yuexing; Lyu, Jiafei; Krzyaniak, Matthew D.; Zhang, Yuanyuan; Li, Zhanyong; Liu, Jian; Buru, Cassandra T.; Islamoglu, Timur; Wasielewski, Michael R.; Li, Zhong; Farha, Omar K. Vanadium Catalyst on Isostructural Transition Metal, Lanthanide, and Actinide Based Metal-Organic Frameworks for Alcohol Oxidation. Journal of the American Chemical Society 141(20) (2019) 8306-8314
Space group: P m -3 m
Cell volume: 22579.8
Cell parameters: 28.2644; 28.2644; 28.2644; 90; 90; 90;  

COD ID: 4127348
CIF file Formula: - C144 H188 N76 Ni14 O12 -
Comments: Zhang, Xiang; Dong, Xia; Lu, Weigang; Luo, Dong; Zhu, Xiao-Wei; Li, Xue; Zhou, Xiao-Ping; Li, Dan Fine-Tuning Apertures of Metal-Organic Cages: Encapsulation of Carbon Dioxide in Solution and Solid State. Journal of the American Chemical Society 141(29) (2019) 11621-11627
Space group: P 4 n c
Cell volume: 9567.5
Cell parameters: 17.0704; 17.0704; 32.8329; 90; 90; 90;  

COD ID: 4127349
CIF file Formula: - C144 H192 N76 Ni14 O12 -
Comments: Zhang, Xiang; Dong, Xia; Lu, Weigang; Luo, Dong; Zhu, Xiao-Wei; Li, Xue; Zhou, Xiao-Ping; Li, Dan Fine-Tuning Apertures of Metal-Organic Cages: Encapsulation of Carbon Dioxide in Solution and Solid State. Journal of the American Chemical Society 141(29) (2019) 11621-11627
Space group: P 4 2 2
Cell volume: 11267.3
Cell parameters: 25.8521; 25.8521; 16.8589; 90; 90; 90;  

COD ID: 4127350
CIF file Formula: - C144 H192 Cu6 N76 Ni8 O12 -
Comments: Zhang, Xiang; Dong, Xia; Lu, Weigang; Luo, Dong; Zhu, Xiao-Wei; Li, Xue; Zhou, Xiao-Ping; Li, Dan Fine-Tuning Apertures of Metal-Organic Cages: Encapsulation of Carbon Dioxide in Solution and Solid State. Journal of the American Chemical Society 141(29) (2019) 11621-11627
Space group: P 4 n c
Cell volume: 9560.76
Cell parameters: 17.00574; 17.00574; 33.0599; 90; 90; 90;  

COD ID: 4127351
CIF file Formula: - C18 H27 N11 Ni O6 -
Comments: Zhang, Xiang; Dong, Xia; Lu, Weigang; Luo, Dong; Zhu, Xiao-Wei; Li, Xue; Zhou, Xiao-Ping; Li, Dan Fine-Tuning Apertures of Metal-Organic Cages: Encapsulation of Carbon Dioxide in Solution and Solid State. Journal of the American Chemical Society 141(29) (2019) 11621-11627
Space group: P 1 21/n 1
Cell volume: 2594.39
Cell parameters: 13.2775; 12.4308; 15.8978; 90; 98.606; 90;  

COD ID: 4127352
CIF file Formula: - C24.25 H38.75 K0.75 Mn0.75 N3.75 O3.25 P1.5 -
Comments: Freitag, Frederik; Irrgang, Torsten; Kempe, Rhett Mechanistic Studies of Hydride Transfer to Imines from a Highly Active and Chemoselective Manganate Catalyst. Journal of the American Chemical Society 141(29) (2019) 11677-11685
Space group: P 1 21/n 1
Cell volume: 11782
Cell parameters: 12.84; 45.11; 20.49; 90; 96.9; 90;  

COD ID: 4127353
CIF file Formula: - C295 H187.5 Ag12 Cl2 F60 N72.5 O48 S20 -
Comments: Carpenter, John P.; McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Anion Pairs Template a Trigonal Prism with Disilver Vertices. Journal of the American Chemical Society 141(29) (2019) 11409-11413
Space group: P -1
Cell volume: 19063
Cell parameters: 24.5951; 25.8919; 33.0285; 82.294; 80.788; 67.08;  

COD ID: 4127354
CIF file Formula: - C275.5 H186.75 Ag12 F69 N62.25 O3 P11 S -
Comments: Carpenter, John P.; McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Anion Pairs Template a Trigonal Prism with Disilver Vertices. Journal of the American Chemical Society 141(29) (2019) 11409-11413
Space group: P -1
Cell volume: 20308.9
Cell parameters: 23.3103; 27.5339; 34.0879; 87.797; 79.35; 70.874;  

COD ID: 4127355
CIF file Formula: - C325 H242 Ag12 F60 N83 O49.5 S22 -
Comments: Carpenter, John P.; McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Anion Pairs Template a Trigonal Prism with Disilver Vertices. Journal of the American Chemical Society 141(29) (2019) 11409-11413
Space group: C 1 2/c 1
Cell volume: 39321.2
Cell parameters: 43.3421; 32.8367; 27.6735; 90; 93.269; 90;  

COD ID: 4127356
CIF file Formula: - C314 H216 Ag12 F60 N82 O48 S22 -
Comments: Carpenter, John P.; McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Anion Pairs Template a Trigonal Prism with Disilver Vertices. Journal of the American Chemical Society 141(29) (2019) 11409-11413
Space group: C 1 2/c 1
Cell volume: 38953.5
Cell parameters: 42.8029; 32.731; 27.8538; 90; 93.412; 90;  

COD ID: 4127357
CIF file Formula: - C337 H260 Ag12 F60 N88 O48 S22 -
Comments: Carpenter, John P.; McTernan, Charlie T.; Ronson, Tanya K.; Nitschke, Jonathan R. Anion Pairs Template a Trigonal Prism with Disilver Vertices. Journal of the American Chemical Society 141(29) (2019) 11409-11413
Space group: C 1 2/c 1
Cell volume: 38618.8
Cell parameters: 43.6194; 32.4028; 27.3509; 90; 92.564; 90;  

COD ID: 4127358
CIF file Formula: - Cs I3 Pb -
Comments: Straus, Daniel B.; Guo, Shu; Cava, Robert J. Kinetically Stable Single Crystals of Perovskite-Phase CsPbI<sub>3</sub>. Journal of the American Chemical Society 141(29) (2019) 11435-11439
Space group: P n m a
Cell volume: 890.2
Cell parameters: 10.45; 4.7965; 17.7602; 90; 90; 90;  

COD ID: 4127359
CIF file Formula: - Cs I3 Pb -
Comments: Straus, Daniel B.; Guo, Shu; Cava, Robert J. Kinetically Stable Single Crystals of Perovskite-Phase CsPbI<sub>3</sub>. Journal of the American Chemical Society 141(29) (2019) 11435-11439
Space group: P n m a
Cell volume: 949.21
Cell parameters: 8.8637; 12.4838; 8.5783; 90; 90; 90;  

COD ID: 4127360
CIF file Formula: - C80 H60 O38 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11179.4
Cell parameters: 23.8076; 23.8076; 19.7236; 90; 90; 90;  

COD ID: 4127361
CIF file Formula: - C80 H60 O38 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11205.8
Cell parameters: 23.8372; 23.8372; 19.7212; 90; 90; 90;  

COD ID: 4127362
CIF file Formula: - C102 H76 O38 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11202.4
Cell parameters: 23.8841; 23.8841; 19.6378; 90; 90; 90;  

COD ID: 4127363
CIF file Formula: - C64 H48 O34 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 9528.2
Cell parameters: 25.5223; 25.5223; 14.6275; 90; 90; 90;  

COD ID: 4127364
CIF file Formula: - C64 H48 O34 U6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 9603.4
Cell parameters: 25.114; 25.114; 15.2262; 90; 90; 90;  

COD ID: 4127365
CIF file Formula: - C80 H60 O37 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11399.7
Cell parameters: 24.0205; 24.0205; 19.7574; 90; 90; 90;  

COD ID: 4127366
CIF file Formula: - C102 H90 N6 O38 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: F m -3 m
Cell volume: 21668.2
Cell parameters: 27.8788; 27.8788; 27.8788; 90; 90; 90;  

COD ID: 4127367
CIF file Formula: - C64 H48 O34 U6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 9555.3
Cell parameters: 25.142; 25.142; 15.1163; 90; 90; 90;  

COD ID: 4127368
CIF file Formula: - C70 H40 O38 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11222.6
Cell parameters: 23.8341; 23.8341; 19.7558; 90; 90; 90;  

COD ID: 4127369
CIF file Formula: - C64 H48 O38 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11133.9
Cell parameters: 23.9422; 23.9422; 19.4231; 90; 90; 90;  

COD ID: 4127370
CIF file Formula: - C84 H60 F6 O34 U6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 10803.7
Cell parameters: 23.6374; 23.6374; 19.3363; 90; 90; 90;  

COD ID: 4127371
CIF file Formula: - C80 H60 N2 O40 Th6 -
Comments: Ejegbavwo, Otega A.; Martin, Corey R.; Olorunfemi, Oyindamola A.; Leith, Gabrielle A.; Ly, Richard T.; Rice, Allison M.; Dolgopolova, Ekaterina A.; Smith, Mark D.; Karakalos, Stavros G.; Birkner, Nancy; Powell, Brian A.; Pandey, Shubham; Koch, Robert J.; Misture, Scott T.; Loye, Hans-Conrad Zur; Phillpot, Simon R.; Brinkman, Kyle S.; Shustova, Natalia B. Thermodynamics and Electronic Properties of Heterometallic Multinuclear Actinide-Containing Metal-Organic Frameworks with "Structural Memory". Journal of the American Chemical Society 141(29) (2019) 11628-11640
Space group: P 42/m m c
Cell volume: 11146.8
Cell parameters: 23.7918; 23.7918; 19.6923; 90; 90; 90;  

COD ID: 4127372
CIF file Formula: - C62 H68 B F24 P2 Rh -
Comments: McKay, Alasdair I.; Bukvic, Alexander J.; Tegner, Bengt E.; Burnage, Arron L.; Martı Nez-Martı Nez, Antonio J; Rees, Nicholas H.; Macgregor, Stuart A.; Weller, Andrew S. Room Temperature Acceptorless Alkane Dehydrogenation from Molecular σ-Alkane Complexes. Journal of the American Chemical Society 141(29) (2019) 11700-11712
Space group: P -1
Cell volume: 3267.7
Cell parameters: 12.7477; 13.0092; 19.8574; 92.3462; 90.9972; 96.6033;  

COD ID: 4127373
CIF file Formula: - C62 H70 B F24 P2 Rh -
Comments: McKay, Alasdair I.; Bukvic, Alexander J.; Tegner, Bengt E.; Burnage, Arron L.; Martı Nez-Martı Nez, Antonio J; Rees, Nicholas H.; Macgregor, Stuart A.; Weller, Andrew S. Room Temperature Acceptorless Alkane Dehydrogenation from Molecular σ-Alkane Complexes. Journal of the American Chemical Society 141(29) (2019) 11700-11712
Space group: P 1 21/n 1
Cell volume: 12958.3
Cell parameters: 19.1238; 34.6204; 19.5735; 90; 90.624; 90;  

COD ID: 4127374
CIF file Formula: - C62 H68 B F24 P2 Rh -
Comments: McKay, Alasdair I.; Bukvic, Alexander J.; Tegner, Bengt E.; Burnage, Arron L.; Martı Nez-Martı Nez, Antonio J; Rees, Nicholas H.; Macgregor, Stuart A.; Weller, Andrew S. Room Temperature Acceptorless Alkane Dehydrogenation from Molecular σ-Alkane Complexes. Journal of the American Chemical Society 141(29) (2019) 11700-11712
Space group: P -1
Cell volume: 3253.5
Cell parameters: 12.7582; 12.9595; 19.8097; 92.028; 90.685; 96.23;  

COD ID: 4127375
CIF file Formula: - C64 H68 B F24 P2 Rh -
Comments: McKay, Alasdair I.; Bukvic, Alexander J.; Tegner, Bengt E.; Burnage, Arron L.; Martı Nez-Martı Nez, Antonio J; Rees, Nicholas H.; Macgregor, Stuart A.; Weller, Andrew S. Room Temperature Acceptorless Alkane Dehydrogenation from Molecular σ-Alkane Complexes. Journal of the American Chemical Society 141(29) (2019) 11700-11712
Space group: C 1 2/c 1
Cell volume: 6753.51
Cell parameters: 19.2893; 17.2828; 20.2622; 90; 91.149; 90;  

COD ID: 4127376
CIF file Formula: - C64 H72 B F24 P2 Rh -
Comments: McKay, Alasdair I.; Bukvic, Alexander J.; Tegner, Bengt E.; Burnage, Arron L.; Martı Nez-Martı Nez, Antonio J; Rees, Nicholas H.; Macgregor, Stuart A.; Weller, Andrew S. Room Temperature Acceptorless Alkane Dehydrogenation from Molecular σ-Alkane Complexes. Journal of the American Chemical Society 141(29) (2019) 11700-11712
Space group: C 1 2/c 1
Cell volume: 6686.3
Cell parameters: 19.1736; 17.6512; 19.7601; 90; 91.086; 90;  

COD ID: 4127377
CIF file Formula: - C17 H15 F3 -
Comments: Trost, Barry M.; Gholami, Hadi; Zell, Daniel Palladium-Catalyzed Asymmetric Allylic Fluoroalkylation/Trifluoromethylation. Journal of the American Chemical Society 141(29) (2019) 11446-11451
Space group: P 1 21 1
Cell volume: 688
Cell parameters: 8.0473; 5.7982; 15.2584; 90; 104.905; 90;  

COD ID: 4127378
CIF file Formula: - C11 H13 N5 Ni O S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P 1 21 1
Cell volume: 809.5
Cell parameters: 6.699; 9.902; 12.655; 90; 105.339; 90;  

COD ID: 4127379
CIF file Formula: - C18 H16 N6 Pt S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P 1 21/a 1
Cell volume: 1124.9
Cell parameters: 9.291; 11.504; 10.88; 90; 104.696; 90;  

COD ID: 4127380
CIF file Formula: - C40 H76 N6 Ni S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P 1 21/n 1
Cell volume: 2229.2
Cell parameters: 7.7723; 20.4416; 14.1183; 90; 96.37; 90;  

COD ID: 4127381
CIF file Formula: - C11 H13 N5 Ni O S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: C 1 c 1
Cell volume: 1585.1
Cell parameters: 6.576; 24.36; 9.895; 90; 90.107; 90;  

COD ID: 4127382
CIF file Formula: - C24 H41 N5 Ni S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P -1
Cell volume: 1412.8
Cell parameters: 9.8084; 10.0948; 15.219; 72.721; 79.401; 89.378;  

COD ID: 4127383
CIF file Formula: - C18 H16 N6 Pd S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P 1 21/a 1
Cell volume: 1114.78
Cell parameters: 9.116; 11.69; 10.82; 90; 104.803; 90;  

COD ID: 4127384
CIF file Formula: - C24 H40 N5 Ni S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P 1 21/c 1
Cell volume: 2854.6
Cell parameters: 9.2903; 18.511; 16.684; 90; 95.773; 90;  

COD ID: 4127385
CIF file Formula: - C24 H41 N5 Pt S4 -
Comments: Hayashi, Mikihiro; Takahashi, Yuki; Yoshida, Yukihiro; Sugimoto, Kunihisa; Kitagawa, Hiroshi Role of <i>d</i>-Elements in a Proton-Electron Coupling of <i>d</i>-π Hybridized Electron Systems. Journal of the American Chemical Society 141(29) (2019) 11686-11693
Space group: P -1
Cell volume: 1439.6
Cell parameters: 9.9538; 10.2166; 15.106; 72.181; 80.224; 89.566;  

COD ID: 4127386
CIF file Formula: - C86 H90 Cu2 F8 O P6 -
Comments: Andrella, Nicholas O.; Xu, Nancy; Gabidullin, Bulat M.; Ehm, Christian; Baker, R. Tom Selective Copper Complex-Catalyzed Hydrodefluorination of Fluoroalkenes and Allyl Fluorides: A Tale of Two Mechanisms. Journal of the American Chemical Society 141(29) (2019) 11506-11521
Space group: P 1 21/n 1
Cell volume: 4031.5
Cell parameters: 10.012; 18.468; 21.823; 90; 92.408; 90;  

COD ID: 4127387
CIF file Formula: - C28 H41 N O4 S -
Comments: Guo, Lian-Dong; Hou, Jieping; Tu, Wentong; Zhang, Yan; Zhang, Yue; Chen, Louxi; Xu, Jing Total Synthesis of Dapholdhamine B and Dapholdhamine B Lactone. Journal of the American Chemical Society 141(29) (2019) 11713-11720
Space group: P 1 21 1
Cell volume: 1261.9
Cell parameters: 9.098; 10.652; 13.365; 90; 103.019; 90;  

COD ID: 4127388
CIF file Formula: - C21 H34 N O2 -
Comments: Guo, Lian-Dong; Hou, Jieping; Tu, Wentong; Zhang, Yan; Zhang, Yue; Chen, Louxi; Xu, Jing Total Synthesis of Dapholdhamine B and Dapholdhamine B Lactone. Journal of the American Chemical Society 141(29) (2019) 11713-11720
Space group: P 21 21 21
Cell volume: 1793.3
Cell parameters: 8.2356; 14.7564; 14.756; 90; 90; 90;  

COD ID: 4127389
CIF file Formula: - C36 H41 N O7 S -
Comments: Guo, Lian-Dong; Hou, Jieping; Tu, Wentong; Zhang, Yan; Zhang, Yue; Chen, Louxi; Xu, Jing Total Synthesis of Dapholdhamine B and Dapholdhamine B Lactone. Journal of the American Chemical Society 141(29) (2019) 11713-11720
Space group: P 62
Cell volume: 19109.8
Cell parameters: 38.5549; 38.5549; 14.8445; 90; 90; 120;  

COD ID: 4127390
CIF file Formula: - C20 H18 O2 -
Comments: Wu, Hua; Wang, Qian; Zhu, Jieping Catalytic Enantioselective Pinacol and Meinwald Rearrangements for the Construction of Quaternary Stereocenters. Journal of the American Chemical Society 141(29) (2019) 11372-11377
Space group: P 21 21 21
Cell volume: 1510.6
Cell parameters: 8.32811; 10.96364; 16.54433; 90; 90; 90;  

COD ID: 4127391
CIF file Formula: - C84 H81.9 Cd2 N8 O14 -
Comments: Claassens, Isabella E.; Barbour, Leonard J.; Haynes, Delia A. A Multistimulus Responsive Porous Coordination Polymer: Temperature-Mediated Control of Solid-State [2+2] Cycloaddition. Journal of the American Chemical Society 141(29) (2019) 11425-11429
Space group: P -1
Cell volume: 3831.4
Cell parameters: 19.4978; 15.492; 15.3385; 116.236; 108.509; 93.369;  

COD ID: 4127392
CIF file Formula: - C76 H66 Cd2 N6 O12 -
Comments: Claassens, Isabella E.; Barbour, Leonard J.; Haynes, Delia A. A Multistimulus Responsive Porous Coordination Polymer: Temperature-Mediated Control of Solid-State [2+2] Cycloaddition. Journal of the American Chemical Society 141(29) (2019) 11425-11429
Space group: P -1
Cell volume: 3805.7
Cell parameters: 19.811; 15.4443; 15.0786; 115.954; 108.416; 94.546;  

COD ID: 4127393
CIF file Formula: - C76 H66 Cd2 N6 O12 -
Comments: Claassens, Isabella E.; Barbour, Leonard J.; Haynes, Delia A. A Multistimulus Responsive Porous Coordination Polymer: Temperature-Mediated Control of Solid-State [2+2] Cycloaddition. Journal of the American Chemical Society 141(29) (2019) 11425-11429
Space group: P -1
Cell volume: 3942.3
Cell parameters: 20.0731; 15.4449; 15.1647; 114.71; 107.275; 95.625;  

COD ID: 4127394
CIF file Formula: - C22 H23 N O4 S -
Comments: Bendelsmith, Andrew J.; Kim, Seohyun Chris; Wasa, Masayuki; Roche, Stéphane P; Jacobsen, Eric N. Enantioselective Synthesis of α-Allyl Amino Esters via Hydrogen-Bond-Donor Catalysis. Journal of the American Chemical Society 141(29) (2019) 11414-11419
Space group: P 21 21 21
Cell volume: 1962.08
Cell parameters: 5.1729; 10.545; 35.9696; 90; 90; 90;  

COD ID: 4127395
CIF file Formula: - C30 H33 Co I N2 O3 P -
Comments: Ghorai, Samir; Chirke, Sahadev Shrihari; Xu, Wen-Bin; Chen, Jia-Feng; Li, Changkun Cobalt-Catalyzed Regio- and Enantioselective Allylic Amination. Journal of the American Chemical Society 141(29) (2019) 11430-11434
Space group: P 21 21 21
Cell volume: 6571
Cell parameters: 9.4527; 25.1917; 27.5943; 90; 90; 90;  

COD ID: 4127396
CIF file Formula: - C36 H44 B2 Co F8 N5 O2 P -
Comments: Ghorai, Samir; Chirke, Sahadev Shrihari; Xu, Wen-Bin; Chen, Jia-Feng; Li, Changkun Cobalt-Catalyzed Regio- and Enantioselective Allylic Amination. Journal of the American Chemical Society 141(29) (2019) 11430-11434
Space group: P 1 21 1
Cell volume: 2014.13
Cell parameters: 12.3076; 11.2515; 14.7336; 90; 99.185; 90;  

COD ID: 4127397
CIF file Formula: - C35 H41 B2 Co F8 N4 O3 P -
Comments: Ghorai, Samir; Chirke, Sahadev Shrihari; Xu, Wen-Bin; Chen, Jia-Feng; Li, Changkun Cobalt-Catalyzed Regio- and Enantioselective Allylic Amination. Journal of the American Chemical Society 141(29) (2019) 11430-11434
Space group: P 1
Cell volume: 966.3
Cell parameters: 9.7764; 10.02; 10.928; 112.897; 98.386; 93.96;  

COD ID: 4127398
CIF file Formula: - C14 H20 N2 O -
Comments: Ghorai, Samir; Chirke, Sahadev Shrihari; Xu, Wen-Bin; Chen, Jia-Feng; Li, Changkun Cobalt-Catalyzed Regio- and Enantioselective Allylic Amination. Journal of the American Chemical Society 141(29) (2019) 11430-11434
Space group: P 21 21 21
Cell volume: 1401.1
Cell parameters: 8.3713; 9.4586; 17.695; 90; 90; 90;  

COD ID: 4127399
CIF file Formula: - C21 H15 N2 O5 Zn -
Comments: Rouhani, Farzaneh; Rafizadeh-Masuleh, Fatemeh; Morsali, Ali Highly Electroconductive Metal-Organic Framework: Tunable by Metal Ion Sorption Quantity. Journal of the American Chemical Society 141(28) (2019) 11173-11182
Space group: I b c a
Cell volume: 9041.2
Cell parameters: 17.635; 22.345; 22.944; 90; 90; 90;  

COD ID: 4127400
CIF file Formula: - C49 H69 Mo N O4 -
Comments: von Kugelgen, Stephen; Piskun, Ilya; Griffin, James H.; Eckdahl, Christopher T.; Jarenwattananon, Nanette N.; Fischer, Felix R. Templated Synthesis of End-Functionalized Graphene Nanoribbons through Living Ring-Opening Alkyne Metathesis Polymerization. Journal of the American Chemical Society 141(28) (2019) 11050-11058
Space group: P 1 21/c 1
Cell volume: 4647.7
Cell parameters: 15.9057; 15.2617; 19.1797; 90; 93.394; 90;  

COD ID: 4127401
CIF file Formula: - C28 H16 -
Comments: von Kugelgen, Stephen; Piskun, Ilya; Griffin, James H.; Eckdahl, Christopher T.; Jarenwattananon, Nanette N.; Fischer, Felix R. Templated Synthesis of End-Functionalized Graphene Nanoribbons through Living Ring-Opening Alkyne Metathesis Polymerization. Journal of the American Chemical Society 141(28) (2019) 11050-11058
Space group: P -1
Cell volume: 1770.6
Cell parameters: 5.5153; 15.9898; 20.1319; 87.836; 86.477; 89.047;  

COD ID: 4127402
CIF file Formula: - C23 H27 F3 O10 S -
Comments: Varenikov, Andrii; Gandelman, Mark Organotitanium Nucleophiles in Asymmetric Cross-Coupling Reaction: Stereoconvergent Synthesis of Chiral α-CF<sub>3</sub> Thioethers. Journal of the American Chemical Society 141(28) (2019) 10994-10999
Space group: P 1 21 1
Cell volume: 1384.2
Cell parameters: 13.492; 6.731; 16.668; 90; 113.874; 90;  

COD ID: 4127403
CIF file Formula: - C24 H21 F3 S -
Comments: Varenikov, Andrii; Gandelman, Mark Organotitanium Nucleophiles in Asymmetric Cross-Coupling Reaction: Stereoconvergent Synthesis of Chiral α-CF<sub>3</sub> Thioethers. Journal of the American Chemical Society 141(28) (2019) 10994-10999
Space group: P 1 21 1
Cell volume: 1006.61
Cell parameters: 10.2316; 6.1453; 16.0261; 90; 92.615; 90;  

COD ID: 4127404
CIF file Formula: - C88 H18 Gd3 N3 -
Comments: Semivrazhskaya, Olesya; Romero-Rivera, Adrian; Aroua, Safwan; Troyanov, Sergey I.; Garcia-Borràs, Marc; Stevenson, Steven; Osuna, Sílvia; Yamakoshi, Yoko Structures of Gd<sub>3</sub>N@C<sub>80</sub> Prato Bis-Adducts: Crystal Structure, Thermal Isomerization, and Computational Study. Journal of the American Chemical Society 141(28) (2019) 10988-10993
Space group: C 1 2/c 1
Cell volume: 4575.9
Cell parameters: 15.419; 15.516; 20.404; 90; 110.38; 90;  

COD ID: 4127405
CIF file Formula: - C77 H110 Al Cl2 K N4 O7 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P 1 21/n 1
Cell volume: 7513.2
Cell parameters: 14.6746; 12.851; 39.91; 90; 93.387; 90;  

COD ID: 4127406
CIF file Formula: - C86 H119 Al K N4 O7 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P 1 21/n 1
Cell volume: 8161.59
Cell parameters: 16.515; 19.7342; 25.2426; 90; 97.22; 90;  

COD ID: 4127407
CIF file Formula: - C146 H180 Al2 K2 N4 O2 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P -1
Cell volume: 3183.82
Cell parameters: 12.0844; 15.1299; 18.6922; 68.703; 89.157; 89.394;  

COD ID: 4127408
CIF file Formula: - C96 H127 Al K N4 O7 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P 1 21/n 1
Cell volume: 8916
Cell parameters: 12.7012; 15.1963; 46.196; 90; 90.502; 90;  

COD ID: 4127409
CIF file Formula: - C77 H110 Al K N4 O7 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P 1 21/c 1
Cell volume: 7437.28
Cell parameters: 18.8947; 13.245; 29.8151; 90; 94.621; 90;  

COD ID: 4127410
CIF file Formula: - C10 H18 Cl2 Sn2 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P b c a
Cell volume: 3098.2
Cell parameters: 6.626; 19.1358; 24.4346; 90; 90; 90;  

COD ID: 4127411
CIF file Formula: - C83 H116 Al K N4 O7 -
Comments: Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society 141(28) (2019) 11000-11003
Space group: P 1 21/c 1
Cell volume: 7818.42
Cell parameters: 20.5108; 12.9151; 29.5577; 90; 93.09; 90;  

COD ID: 4127412
CIF file Formula: - C39.87 H53.87 Cl2.62 N O4 -
Comments: Wen, Saishuai; Boyce, Jonathan H.; Kandappa, Sunil K.; Sivaguru, Jayaraman; Porco, Jr, John A Regiodivergent Photocyclization of Dearomatized Acylphloroglucinols: Asymmetric Syntheses of (-)-Nemorosone and (-)-6-<i>epi</i>-Garcimultiflorone A. Journal of the American Chemical Society 141(28) (2019) 11315-11321
Space group: P 1 21 1
Cell volume: 1936.02
Cell parameters: 10.3691; 17.1035; 11.0229; 90; 97.966; 90;  

COD ID: 4127413
CIF file Formula: - C41 H57 N O4 -
Comments: Wen, Saishuai; Boyce, Jonathan H.; Kandappa, Sunil K.; Sivaguru, Jayaraman; Porco, Jr, John A Regiodivergent Photocyclization of Dearomatized Acylphloroglucinols: Asymmetric Syntheses of (-)-Nemorosone and (-)-6-<i>epi</i>-Garcimultiflorone A. Journal of the American Chemical Society 141(28) (2019) 11315-11321
Space group: C 1 2 1
Cell volume: 7306.8
Cell parameters: 33.1205; 11.3921; 25.2617; 90; 129.951; 90;  

COD ID: 4127414
CIF file Formula: - C60.82 H58.82 B Cl1.13 Co N7.82 O -
Comments: Kumar, Praveen; Lindeman, Sergey V.; Fiedler, Adam T. Cobalt Superoxo and Alkylperoxo Complexes Derived from Reaction of Ring-Cleaving Dioxygenase Models with O<sub>2</sub>. Journal of the American Chemical Society 141(28) (2019) 10984-10987
Space group: P 1 21/n 1
Cell volume: 5447.22
Cell parameters: 10.04169; 31.9979; 17.15695; 90; 98.8434; 90;  

COD ID: 4127415
CIF file Formula: - C61.18 H55.18 B Cl2.2 Co N7.54 O -
Comments: Kumar, Praveen; Lindeman, Sergey V.; Fiedler, Adam T. Cobalt Superoxo and Alkylperoxo Complexes Derived from Reaction of Ring-Cleaving Dioxygenase Models with O<sub>2</sub>. Journal of the American Chemical Society 141(28) (2019) 10984-10987
Space group: P 1 21/c 1
Cell volume: 5593.99
Cell parameters: 14.9078; 9.95186; 37.7389; 90; 92.4141; 90;  

COD ID: 4127416
CIF file Formula: - C35 H53 B Co N10 O -
Comments: Kumar, Praveen; Lindeman, Sergey V.; Fiedler, Adam T. Cobalt Superoxo and Alkylperoxo Complexes Derived from Reaction of Ring-Cleaving Dioxygenase Models with O<sub>2</sub>. Journal of the American Chemical Society 141(28) (2019) 10984-10987
Space group: P 1 21/n 1
Cell volume: 3835.29
Cell parameters: 7.63615; 18.95826; 26.67111; 90; 96.6314; 90;  

COD ID: 4127417
CIF file Formula: - C33 H49 B Co N9 O3 -
Comments: Kumar, Praveen; Lindeman, Sergey V.; Fiedler, Adam T. Cobalt Superoxo and Alkylperoxo Complexes Derived from Reaction of Ring-Cleaving Dioxygenase Models with O<sub>2</sub>. Journal of the American Chemical Society 141(28) (2019) 10984-10987
Space group: P -1
Cell volume: 1788.39
Cell parameters: 9.6841; 9.7745; 20.6176; 87.688; 87.32; 66.582;  

COD ID: 4127418
CIF file Formula: - C31 H45 B Co N7 O2 -
Comments: Kumar, Praveen; Lindeman, Sergey V.; Fiedler, Adam T. Cobalt Superoxo and Alkylperoxo Complexes Derived from Reaction of Ring-Cleaving Dioxygenase Models with O<sub>2</sub>. Journal of the American Chemical Society 141(28) (2019) 10984-10987
Space group: P -1
Cell volume: 1602.78
Cell parameters: 7.7385; 10.0689; 22.2625; 84.589; 87.358; 68.153;  

COD ID: 4127419
CIF file Formula: - As32 Ga22 Sr15 -
Comments: Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society 141(28) (2019) 11245-11252
Space group: C 1 2/c 1
Cell volume: 10383.3
Cell parameters: 22.966; 22.9639; 19.8929; 90; 98.229; 90;  

COD ID: 4127420
CIF file Formula: - As32 Eu15 Ga22 -
Comments: Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society 141(28) (2019) 11245-11252
Space group: C 1 2/c 1
Cell volume: 10205.8
Cell parameters: 22.8204; 22.8257; 19.7972; 90; 98.237; 90;  

COD ID: 4127421
CIF file Formula: - As32 Eu15 In22 -
Comments: Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society 141(28) (2019) 11245-11252
Space group: C 1 2/c 1
Cell volume: 11510.7
Cell parameters: 23.703; 23.702; 22.337; 90; 113.473; 90;  

COD ID: 4127422
CIF file Formula: - As8 Ga6 Sr3 -
Comments: Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society 141(28) (2019) 11245-11252
Space group: C 1 2/c 1
Cell volume: 13251.8
Cell parameters: 22.8363; 22.8335; 26.8169; 90; 108.613; 90;  

COD ID: 4127423
CIF file Formula: - As8 Eu3 Ga6 -
Comments: Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society 141(28) (2019) 11245-11252
Space group: C 1 2/c 1
Cell volume: 13111
Cell parameters: 22.74; 22.747; 25.505; 90; 96.393; 90;  

COD ID: 4127424
CIF file Formula: - As32 In22 Sr15 -
Comments: Weippert, Valentin; Haffner, Arthur; Stamatopoulos, Alexis; Johrendt, Dirk Supertetrahedral Layers Based on GaAs or InAs. Journal of the American Chemical Society 141(28) (2019) 11245-11252
Space group: C 1 2/c 1
Cell volume: 11667
Cell parameters: 23.838; 23.818; 20.763; 90; 98.244; 90;  

COD ID: 4127425
CIF file Formula: - C35 H63 F5 Mn N11 O4 -
Comments: Barman, Suman K.; Jones, Jason R.; Sun, Chen; Hill, Ethan A.; Ziller, Joseph W.; Borovik, A. S. Regulating the Basicity of Metal-Oxido Complexes with a Single Hydrogen Bond and Its Effect on C-H Bond Cleavage. Journal of the American Chemical Society 141(28) (2019) 11142-11150
Space group: P -1
Cell volume: 2166.6
Cell parameters: 9.648; 13.538; 17.653; 73.166; 82.859; 79.983;  

COD ID: 4127426
CIF file Formula: - C57 H103 K4 Mn2 N17 O15 -
Comments: Barman, Suman K.; Jones, Jason R.; Sun, Chen; Hill, Ethan A.; Ziller, Joseph W.; Borovik, A. S. Regulating the Basicity of Metal-Oxido Complexes with a Single Hydrogen Bond and Its Effect on C-H Bond Cleavage. Journal of the American Chemical Society 141(28) (2019) 11142-11150
Space group: P -1
Cell volume: 4244.3
Cell parameters: 14.9408; 14.9961; 20.1209; 99.7945; 105.665; 94.1267;  

COD ID: 4127427
CIF file Formula: - C18 H12 Br Cl2 N O -
Comments: Cai, Lingchao; Zhang, Kui; Chen, Shuming; Lepage, Romain J.; Houk, K. N.; Krenske, Elizabeth H.; Kwon, Ohyun Catalytic Asymmetric Staudinger-aza-Wittig Reaction for the Synthesis of Heterocyclic Amines. Journal of the American Chemical Society 141(24) (2019) 9537-9542
Space group: P 21 21 2
Cell volume: 1634.18
Cell parameters: 19.2243; 8.7543; 9.7102; 90; 90; 90;  

COD ID: 4127428
CIF file Formula: - C33 H52 B Cu F4 N6 O0.5 -
Comments: Filonenko, Georgy A.; Sun, Dapeng; Weber, Manuela; Müller, Christian; Pidko, Evgeny A. Multicolor Organometallic Mechanophores for Polymer Imaging Driven by Exciplex Level Interactions. Journal of the American Chemical Society 141(24) (2019) 9687-9692
Space group: P -1
Cell volume: 7100.5
Cell parameters: 10.4878; 26.6111; 27.2827; 69.0039; 87.263; 89.4717;  

COD ID: 4127429
CIF file Formula: - C59 H78 B Cu N6 O -
Comments: Filonenko, Georgy A.; Sun, Dapeng; Weber, Manuela; Müller, Christian; Pidko, Evgeny A. Multicolor Organometallic Mechanophores for Polymer Imaging Driven by Exciplex Level Interactions. Journal of the American Chemical Society 141(24) (2019) 9687-9692
Space group: P 1 21/c 1
Cell volume: 5305.4
Cell parameters: 13.5651; 10.4389; 37.6598; 90; 95.8111; 90;  

COD ID: 4127430
CIF file Formula: - C55 H68 B Cu N6 -
Comments: Filonenko, Georgy A.; Sun, Dapeng; Weber, Manuela; Müller, Christian; Pidko, Evgeny A. Multicolor Organometallic Mechanophores for Polymer Imaging Driven by Exciplex Level Interactions. Journal of the American Chemical Society 141(24) (2019) 9687-9692
Space group: P -1
Cell volume: 2424.95
Cell parameters: 11.2381; 13.6876; 16.2529; 78.7901; 81.5124; 87.161;  

COD ID: 4127431
CIF file Formula: - C31 H48 B Cu F4 N6 -
Comments: Filonenko, Georgy A.; Sun, Dapeng; Weber, Manuela; Müller, Christian; Pidko, Evgeny A. Multicolor Organometallic Mechanophores for Polymer Imaging Driven by Exciplex Level Interactions. Journal of the American Chemical Society 141(24) (2019) 9687-9692
Space group: P 1 21/n 1
Cell volume: 6617.06
Cell parameters: 10.7234; 45.5153; 14.3298; 90; 108.898; 90;  

COD ID: 4127432
CIF file Formula: - B20 Eu9 Mg O41 S2 -
Comments: Chi, Yang; Xu, Jing; Xue, Huai-Guo; Zhang, Yueping; Chen, Xiaolong; Whangbo, Myung-Hwan; Guo, Sheng-Ping; Deng, Shuiquan Triple-Kagomé-Layer Slabs of Mixed-Valence Rare-Earth Ions Exhibiting Quantum Spin Liquid Behaviors: Synthesis and Characterization of Eu<sub>9</sub>MgS<sub>2</sub>B<sub>20</sub>O<sub>41</sub>. Journal of the American Chemical Society 141(24) (2019) 9533-9536
Space group: P 63/m
Cell volume: 1476.2
Cell parameters: 8.2708; 8.2708; 24.919; 90; 90; 120;  

COD ID: 4127433
CIF file Formula: - C82.24 H134.13 Ag15 Cl F17 N10.64 O19.64 S8 -
Comments: Alhilaly, Mohammad J.; Huang, Ren-Wu; Naphade, Rounak; Alamer, Badriah; Hedhili, Mohamed Nejib; Emwas, Abdul-Hamid; Maity, Partha; Yin, Jun; Shkurenko, Aleksander; Mohammed, Omar F.; Eddaoudi, Mohamed; Bakr, Osman M. Assembly of Atomically Precise Silver Nanoclusters into Nanocluster-Based Frameworks. Journal of the American Chemical Society 141(24) (2019) 9585-9592
Space group: P -1
Cell volume: 6304
Cell parameters: 15.009; 19.593; 22.379; 96.761; 101.558; 98.432;  

COD ID: 4127434
CIF file Formula: - C71 H109 Ag14 Cl F15 N7 O13 S8 -
Comments: Alhilaly, Mohammad J.; Huang, Ren-Wu; Naphade, Rounak; Alamer, Badriah; Hedhili, Mohamed Nejib; Emwas, Abdul-Hamid; Maity, Partha; Yin, Jun; Shkurenko, Aleksander; Mohammed, Omar F.; Eddaoudi, Mohamed; Bakr, Osman M. Assembly of Atomically Precise Silver Nanoclusters into Nanocluster-Based Frameworks. Journal of the American Chemical Society 141(24) (2019) 9585-9592
Space group: P -1
Cell volume: 6062.6
Cell parameters: 14.871; 15.265; 31.209; 76.925; 88.638; 61.957;  

COD ID: 4127435
CIF file Formula: - C62.5 H112.5 Ag16 Cl F21 N5.5 O20.5 S8 -
Comments: Alhilaly, Mohammad J.; Huang, Ren-Wu; Naphade, Rounak; Alamer, Badriah; Hedhili, Mohamed Nejib; Emwas, Abdul-Hamid; Maity, Partha; Yin, Jun; Shkurenko, Aleksander; Mohammed, Omar F.; Eddaoudi, Mohamed; Bakr, Osman M. Assembly of Atomically Precise Silver Nanoclusters into Nanocluster-Based Frameworks. Journal of the American Chemical Society 141(24) (2019) 9585-9592
Space group: C 1 2/c 1
Cell volume: 21741.4
Cell parameters: 19.697; 22.605; 49.495; 90; 99.406; 90;  

COD ID: 4127436
CIF file Formula: - C20.15 H27.88 Cl1.42 N O5 S -
Comments: Ma, Rulin; Young, Jonathon; Promontorio, Rossella; Dannheim, Friederike M.; Pattillo, Christopher C.; White, M. Christina Synthesis of anti-1,3 Amino Alcohol Motifs via Pd(II)/SOX Catalysis with the Capacity for Stereodivergence. Journal of the American Chemical Society 141(24) (2019) 9468-9473
Space group: P -1
Cell volume: 1062.5
Cell parameters: 5.9675; 11.0636; 16.9266; 80.064; 89.981; 75.078;  

COD ID: 4127437
CIF file Formula: - C16 H21 N O4 S -
Comments: Ma, Rulin; Young, Jonathon; Promontorio, Rossella; Dannheim, Friederike M.; Pattillo, Christopher C.; White, M. Christina Synthesis of anti-1,3 Amino Alcohol Motifs via Pd(II)/SOX Catalysis with the Capacity for Stereodivergence. Journal of the American Chemical Society 141(24) (2019) 9468-9473
Space group: P -1
Cell volume: 954.99
Cell parameters: 5.9677; 11.8753; 15.0703; 106.578; 100.198; 104.47;  

COD ID: 4127438
CIF file Formula: - C27 H21 N O -
Comments: Wang, Qiang; Cai, Zhong-Jian; Liu, Chen-Xu; Gu, Qing; You, Shu-Li Rhodium-Catalyzed Atroposelective C-H Arylation: Efficient Synthesis of Axially Chiral Heterobiaryls. Journal of the American Chemical Society 141(24) (2019) 9504-9510
Space group: P 21 21 21
Cell volume: 2008.99
Cell parameters: 9.4161; 14.164; 15.0633; 90; 90; 90;  

COD ID: 4127439
CIF file Formula: - C63 H80 N6 O -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P -1
Cell volume: 2740.8
Cell parameters: 9.8196; 16.119; 18.203; 105.095; 92.986; 98.258;  

COD ID: 4127440
CIF file Formula: - C20 H28 N -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: C 1 2/c 1
Cell volume: 3433.7
Cell parameters: 20.8294; 9.35; 19.8493; 90; 117.348; 90;  

COD ID: 4127441
CIF file Formula: - C29 H35 N3 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: C 1 c 1
Cell volume: 4956.1
Cell parameters: 8.8369; 34.229; 16.6943; 90; 101.045; 90;  

COD ID: 4127442
CIF file Formula: - C47 H65 N3 O -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: C 1 2 1
Cell volume: 4180
Cell parameters: 27.636; 9.669; 15.648; 90; 91.294; 90;  

COD ID: 4127443
CIF file Formula: - C36 H41 N3 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P 1 21/c 1
Cell volume: 3060.6
Cell parameters: 22.9103; 16.2048; 8.2525; 90; 92.611; 90;  

COD ID: 4127444
CIF file Formula: - C50 H55 F6 N3 O0.5 Sb -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P 1 21/c 1
Cell volume: 4463
Cell parameters: 18.13; 18.914; 13.58; 90; 106.596; 90;  

COD ID: 4127445
CIF file Formula: - C55 H63 N3 O3 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P -1
Cell volume: 2291.7
Cell parameters: 9.1359; 15.748; 16.691; 103.818; 96.832; 96.26;  

COD ID: 4127446
CIF file Formula: - C27 H31 F6 N3 Sb -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P 1 21/n 1
Cell volume: 2700.6
Cell parameters: 9.8395; 18.5942; 15.5356; 90; 108.171; 90;  

COD ID: 4127447
CIF file Formula: - C52 H59 N3 O -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P 1 21/n 1
Cell volume: 4286
Cell parameters: 19.391; 10.649; 21.807; 90; 107.848; 90;  

COD ID: 4127448
CIF file Formula: - C69 H90 F12 N6 O3.5 Sb2 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P -1
Cell volume: 3608.3
Cell parameters: 11.7476; 16.1366; 20.0336; 86.506; 74.026; 81.296;  

COD ID: 4127449
CIF file Formula: - C45 H40 F9 N3 Sb -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P 1 21/n 1
Cell volume: 4070.8
Cell parameters: 14.307; 16.3038; 17.6125; 90; 97.746; 90;  

COD ID: 4127450
CIF file Formula: - C41 H51 N3 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P b c a
Cell volume: 7005.7
Cell parameters: 18.9227; 15.8869; 23.304; 90; 90; 90;  

COD ID: 4127451
CIF file Formula: - C49 H60 N2 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: C 1 2/c 1
Cell volume: 8103.1
Cell parameters: 12.2157; 23.396; 28.355; 90; 90.759; 90;  

COD ID: 4127452
CIF file Formula: - C45 H67 F12 N3 O4 Sb2 -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: C 1 2/c 1
Cell volume: 5143
Cell parameters: 17.1588; 13.8404; 22.8193; 90; 108.372; 90;  

COD ID: 4127453
CIF file Formula: - C58 H70 N6 O -
Comments: Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. Organic Redox Systems Based on Pyridinium-Carbene Hybrids. Journal of the American Chemical Society 141(24) (2019) 9701-9711
Space group: P 1 21/n 1
Cell volume: 4983.2
Cell parameters: 15.9721; 18.65; 17.0396; 90; 100.96; 90;  

COD ID: 4127454
CIF file Formula: - C42 H33 I N3 O2 Rh -
Comments: Tian, Miaomiao; Bai, Dachang; Zheng, Guangfan; Chang, Junbiao; Li, Xingwei Rh(III)-Catalyzed Asymmetric Synthesis of Axially Chiral Biindolyls by Merging C-H Activation and Nucleophilic Cyclization. Journal of the American Chemical Society 141(24) (2019) 9527-9532
Space group: P 21 21 21
Cell volume: 4224.5
Cell parameters: 10.0127; 13.6575; 30.8925; 90; 90; 90;  

COD ID: 4127455
CIF file Formula: - C40 H30 N4 O2 S -
Comments: Tian, Miaomiao; Bai, Dachang; Zheng, Guangfan; Chang, Junbiao; Li, Xingwei Rh(III)-Catalyzed Asymmetric Synthesis of Axially Chiral Biindolyls by Merging C-H Activation and Nucleophilic Cyclization. Journal of the American Chemical Society 141(24) (2019) 9527-9532
Space group: P 1 21 1
Cell volume: 1577.41
Cell parameters: 9.417; 10.9955; 15.6189; 90; 102.744; 90;  

COD ID: 4127456
CIF file Formula: - C58.5 H30.5 Cl7.5 -
Comments: Pun, Sai Ho; Wang, Yujing; Chu, Ming; Chan, Chi Kit; Li, Yuke; Liu, Zhifeng; Miao, Qian Synthesis, Structures, and Properties of Heptabenzo[7]circulene and Octabenzo[8]circulene. Journal of the American Chemical Society 141(24) (2019) 9680-9686
Space group: P -1
Cell volume: 2230.1
Cell parameters: 9.8876; 13.0506; 18.7229; 69.6938; 89.6815; 80.3472;  

COD ID: 4127457
CIF file Formula: - C82 H64 S4 -
Comments: Pun, Sai Ho; Wang, Yujing; Chu, Ming; Chan, Chi Kit; Li, Yuke; Liu, Zhifeng; Miao, Qian Synthesis, Structures, and Properties of Heptabenzo[7]circulene and Octabenzo[8]circulene. Journal of the American Chemical Society 141(24) (2019) 9680-9686
Space group: C 1 2/c 1
Cell volume: 12332.2
Cell parameters: 20.4908; 20.5122; 29.522; 90; 96.355; 90;  

COD ID: 4127458
CIF file Formula: - C26 H33 N O4 S -
Comments: Nie, Wei; Gong, Jing; Chen, Zhihao; Liu, Jiazhen; Tian, Di; Song, Hao; Liu, Xiao-Yu; Qin, Yong Enantioselective Total Synthesis of (-)-Arcutinine. Journal of the American Chemical Society 141(24) (2019) 9712-9718
Space group: P 21 21 21
Cell volume: 2268.27
Cell parameters: 10.496; 13.6381; 15.8459; 90; 90; 90;  

COD ID: 4127459
CIF file Formula: - C28 H35 N O6 S -
Comments: Nie, Wei; Gong, Jing; Chen, Zhihao; Liu, Jiazhen; Tian, Di; Song, Hao; Liu, Xiao-Yu; Qin, Yong Enantioselective Total Synthesis of (-)-Arcutinine. Journal of the American Chemical Society 141(24) (2019) 9712-9718
Space group: P 1 21/c 1
Cell volume: 2565.7
Cell parameters: 8.0004; 19.6229; 16.3447; 90; 90.793; 90;  

COD ID: 4127460
CIF file Formula: - C28 H35 N O6 S -
Comments: Nie, Wei; Gong, Jing; Chen, Zhihao; Liu, Jiazhen; Tian, Di; Song, Hao; Liu, Xiao-Yu; Qin, Yong Enantioselective Total Synthesis of (-)-Arcutinine. Journal of the American Chemical Society 141(24) (2019) 9712-9718
Space group: P 1 21/n 1
Cell volume: 2557.4
Cell parameters: 13.3161; 13.3539; 15.3167; 90; 110.123; 90;  

COD ID: 4127461
CIF file Formula: - C28 H35 N O6 S -
Comments: Nie, Wei; Gong, Jing; Chen, Zhihao; Liu, Jiazhen; Tian, Di; Song, Hao; Liu, Xiao-Yu; Qin, Yong Enantioselective Total Synthesis of (-)-Arcutinine. Journal of the American Chemical Society 141(24) (2019) 9712-9718
Space group: P 1 21/n 1
Cell volume: 2567
Cell parameters: 13.3401; 13.3739; 15.3218; 90; 110.106; 90;  

COD ID: 4127462
CIF file Formula: - C17 H24 N2 -
Comments: Zhang, Bo-Sheng; Li, Yuke; Zhang, Zhe; An, Yang; Wen, Yu-Hua; Gou, Xue-Ya; Quan, Si-Qi; Wang, Xin-Gang; Liang, Yong-Min Synthesis of C4-Aminated Indoles via a Catellani and Retro-Diels-Alder Strategy. Journal of the American Chemical Society 141(24) (2019) 9731-9738
Space group: P 1 21/c 1
Cell volume: 1519.21
Cell parameters: 7.1517; 9.9719; 21.5377; 90; 98.474; 90;  

COD ID: 4127463
CIF file Formula: - C16 H22 N2 O -
Comments: Zhang, Bo-Sheng; Li, Yuke; Zhang, Zhe; An, Yang; Wen, Yu-Hua; Gou, Xue-Ya; Quan, Si-Qi; Wang, Xin-Gang; Liang, Yong-Min Synthesis of C4-Aminated Indoles via a Catellani and Retro-Diels-Alder Strategy. Journal of the American Chemical Society 141(24) (2019) 9731-9738
Space group: P -1
Cell volume: 1459.56
Cell parameters: 9.9395; 11.314; 13.5788; 85.587; 88.88; 73.47;  

COD ID: 4127464
CIF file Formula: - C30 H36 Co F6 N2 O2 -
Comments: Ye, Ke-Yin; McCallum, Terry; Lin, Song Bimetallic Radical Redox-Relay Catalysis for the Isomerization of Epoxides to Allylic Alcohols. Journal of the American Chemical Society 141(24) (2019) 9548-9554
Space group: C 2 2 21
Cell volume: 2867.96
Cell parameters: 10.2386; 23.8719; 11.734; 90; 90; 90;  

COD ID: 4127465
CIF file Formula: - C83.75 H76 F6 Fe4 N15 O5.5 P -
Comments: Reed, Christopher J.; Agapie, Theodor A Terminal Fe<sup>III</sup>-Oxo in a Tetranuclear Cluster: Effects of Distal Metal Centers on Structure and Reactivity. Journal of the American Chemical Society 141(24) (2019) 9479-9484
Space group: P -1
Cell volume: 4201.8
Cell parameters: 11.9919; 13.763; 25.905; 89.286; 87.757; 79.589;  

COD ID: 4127466
CIF file Formula: - C91 H99 F3 Fe4 N15 O11 S -
Comments: Reed, Christopher J.; Agapie, Theodor A Terminal Fe<sup>III</sup>-Oxo in a Tetranuclear Cluster: Effects of Distal Metal Centers on Structure and Reactivity. Journal of the American Chemical Society 141(24) (2019) 9479-9484
Space group: P n a 21
Cell volume: 8597
Cell parameters: 19.122; 18.204; 24.698; 90; 90; 90;  

COD ID: 4127467
CIF file Formula: - C90 H88 Fe4 N15 O5 -
Comments: Reed, Christopher J.; Agapie, Theodor A Terminal Fe<sup>III</sup>-Oxo in a Tetranuclear Cluster: Effects of Distal Metal Centers on Structure and Reactivity. Journal of the American Chemical Society 141(24) (2019) 9479-9484
Space group: P -1
Cell volume: 3993.7
Cell parameters: 14.1115; 15.0509; 21.1556; 70.794; 86.911; 70.57;  

COD ID: 4127468
CIF file Formula: - C90 H87 Fe4 N15 O5 -
Comments: Reed, Christopher J.; Agapie, Theodor A Terminal Fe<sup>III</sup>-Oxo in a Tetranuclear Cluster: Effects of Distal Metal Centers on Structure and Reactivity. Journal of the American Chemical Society 141(24) (2019) 9479-9484
Space group: P -1
Cell volume: 3921.5
Cell parameters: 12.3162; 15.5743; 21.6599; 102.37; 94.445; 102.897;  

COD ID: 4127469
CIF file Formula: - C80 H76 F6 Fe4 N15 O11 S2 -
Comments: Reed, Christopher J.; Agapie, Theodor A Terminal Fe<sup>III</sup>-Oxo in a Tetranuclear Cluster: Effects of Distal Metal Centers on Structure and Reactivity. Journal of the American Chemical Society 141(24) (2019) 9479-9484
Space group: P -1
Cell volume: 4106.7
Cell parameters: 12.15; 14.975; 23.386; 95.271; 90.124; 104.174;  

COD ID: 4127470
CIF file Formula: - C16 H18 O3 -
Comments: Mato, Raquel; Manzano, Rubén; Reyes, Efraim; Carrillo, Luisa; Uria, Uxue; Vicario, Jose L. Catalytic Enantioselective Transannular Morita-Baylis-Hillman Reaction. Journal of the American Chemical Society 141(24) (2019) 9495-9499
Space group: P 1 21 1
Cell volume: 671.799
Cell parameters: 9.33848; 7.41455; 9.7064; 90; 91.6489; 90;  

COD ID: 4127471
CIF file Formula: - C11 H16 O2 -
Comments: Mato, Raquel; Manzano, Rubén; Reyes, Efraim; Carrillo, Luisa; Uria, Uxue; Vicario, Jose L. Catalytic Enantioselective Transannular Morita-Baylis-Hillman Reaction. Journal of the American Chemical Society 141(24) (2019) 9495-9499
Space group: P 1 21 1
Cell volume: 491.456
Cell parameters: 5.36038; 7.31242; 12.53807; 90; 90.2082; 90;  

COD ID: 4127472
CIF file Formula: - C11 H16 O2 -
Comments: Mato, Raquel; Manzano, Rubén; Reyes, Efraim; Carrillo, Luisa; Uria, Uxue; Vicario, Jose L. Catalytic Enantioselective Transannular Morita-Baylis-Hillman Reaction. Journal of the American Chemical Society 141(24) (2019) 9495-9499
Space group: P 21 21 21
Cell volume: 974.885
Cell parameters: 7.12324; 8.00568; 17.09534; 90; 90; 90;  

COD ID: 4127473
CIF file Formula: - C73 H162 K2 O26 Si6 U2 -
Comments: Falcone, Marta; Scopelliti, Rosario; Mazzanti, Marinella CO<sub>2</sub> and CO/H<sub>2</sub> Conversion to Methoxide by a Uranium(IV) Hydride. Journal of the American Chemical Society 141(24) (2019) 9570-9577
Space group: P 1 21/n 1
Cell volume: 5546.47
Cell parameters: 14.26268; 17.70163; 21.97679; 90; 91.5652; 90;  

COD ID: 4127474
CIF file Formula: - C75 H163 K2 O31 Si6 U2 -
Comments: Falcone, Marta; Scopelliti, Rosario; Mazzanti, Marinella CO<sub>2</sub> and CO/H<sub>2</sub> Conversion to Methoxide by a Uranium(IV) Hydride. Journal of the American Chemical Society 141(24) (2019) 9570-9577
Space group: P 21 21 21
Cell volume: 11573.4
Cell parameters: 13.5015; 18.6524; 45.9564; 90; 90; 90;  

COD ID: 4127475
CIF file Formula: - C76 H170 K2 N2 O25 Si6 U2 -
Comments: Falcone, Marta; Scopelliti, Rosario; Mazzanti, Marinella CO<sub>2</sub> and CO/H<sub>2</sub> Conversion to Methoxide by a Uranium(IV) Hydride. Journal of the American Chemical Society 141(24) (2019) 9570-9577
Space group: P 1 21/c 1
Cell volume: 11108.6
Cell parameters: 23.8521; 13.9941; 33.379; 90; 94.406; 90;  

COD ID: 4127476
CIF file Formula: - C79 H172 K2 O25 Si6 U2 -
Comments: Falcone, Marta; Scopelliti, Rosario; Mazzanti, Marinella CO<sub>2</sub> and CO/H<sub>2</sub> Conversion to Methoxide by a Uranium(IV) Hydride. Journal of the American Chemical Society 141(24) (2019) 9570-9577
Space group: P -1
Cell volume: 5783.3
Cell parameters: 14.203; 17.5377; 25.3851; 78.8955; 88.5451; 68.93;  

COD ID: 4127477
CIF file Formula: - C73 H166 K2 O26 Si6 U2 -
Comments: Falcone, Marta; Scopelliti, Rosario; Mazzanti, Marinella CO<sub>2</sub> and CO/H<sub>2</sub> Conversion to Methoxide by a Uranium(IV) Hydride. Journal of the American Chemical Society 141(24) (2019) 9570-9577
Space group: P 1 21 1
Cell volume: 5578.99
Cell parameters: 13.9751; 18.1064; 22.0854; 90; 93.337; 90;  

COD ID: 4127478
CIF file Formula: - C50 H27 N4 O13 Ti3.5 -
Comments: Lan, Guangxu; Ni, Kaiyuan; Veroneau, Samuel S.; Feng, Xuanyu; Nash, Geoffrey T.; Luo, Taokun; Xu, Ziwan; Lin, Wenbin Titanium-Based Nanoscale Metal-Organic Framework for Type I Photodynamic Therapy. Journal of the American Chemical Society 141(10) (2019) 4204-4208
Space group: P 1 21/c 1
Cell volume: 9110
Cell parameters: 16.496; 16.181; 34.167; 90; 92.685; 90;  

COD ID: 4127479
CIF file Formula: - C4 H12.5 B10 F3.5 N O -
Comments: Lyu, Hairong; Zhang, Jie; Yang, Jingting; Quan, Yangjian; Xie, Zuowei Catalytic Regioselective Cage B(8)-H Arylation of o-Carboranes via "Cage-Walking" Strategy. Journal of the American Chemical Society 141(10) (2019) 4219-4224
Space group: C 1 2/c 1
Cell volume: 2661.4
Cell parameters: 7.5724; 11.7573; 29.8975; 90; 91.0303; 90;  

COD ID: 4127480
CIF file Formula: - C21 H29 B10 F3 N4 O4 Pd S -
Comments: Lyu, Hairong; Zhang, Jie; Yang, Jingting; Quan, Yangjian; Xie, Zuowei Catalytic Regioselective Cage B(8)-H Arylation of o-Carboranes via "Cage-Walking" Strategy. Journal of the American Chemical Society 141(10) (2019) 4219-4224
Space group: P -1
Cell volume: 1464.2
Cell parameters: 7.259; 13.814; 15.014; 81.928; 80.42; 83.744;  

COD ID: 4127481
CIF file Formula: - C22 H24 B10 Cl3 N O -
Comments: Lyu, Hairong; Zhang, Jie; Yang, Jingting; Quan, Yangjian; Xie, Zuowei Catalytic Regioselective Cage B(8)-H Arylation of o-Carboranes via "Cage-Walking" Strategy. Journal of the American Chemical Society 141(10) (2019) 4219-4224
Space group: P -1
Cell volume: 5823.9
Cell parameters: 18.0714; 18.635; 21.9499; 111.875; 92.237; 118.324;  

COD ID: 4127482
CIF file Formula: - C10 H18 B10 Cl N O -
Comments: Lyu, Hairong; Zhang, Jie; Yang, Jingting; Quan, Yangjian; Xie, Zuowei Catalytic Regioselective Cage B(8)-H Arylation of o-Carboranes via "Cage-Walking" Strategy. Journal of the American Chemical Society 141(10) (2019) 4219-4224
Space group: P -1
Cell volume: 1639.64
Cell parameters: 10.2815; 12.6911; 13.9103; 92.039; 109.668; 104.582;  

COD ID: 4127483
CIF file Formula: - C12 H23 B10 N O -
Comments: Lyu, Hairong; Zhang, Jie; Yang, Jingting; Quan, Yangjian; Xie, Zuowei Catalytic Regioselective Cage B(8)-H Arylation of o-Carboranes via "Cage-Walking" Strategy. Journal of the American Chemical Society 141(10) (2019) 4219-4224
Space group: P -1
Cell volume: 3037.9
Cell parameters: 13.1958; 13.599; 17.6921; 106.695; 90.9955; 92.0205;  

COD ID: 4127484
CIF file Formula: - C18 H28 Cl N2 P2 V -
Comments: Kawakita, Kento; Beaumier, Evan P.; Kakiuchi, Yuya; Tsurugi, Hayato; Tonks, Ian A.; Mashima, Kazushi Bis(imido)vanadium(V)-Catalyzed [2+2+1] Coupling of Alkynes and Azobenzenes Giving Multisubstituted Pyrroles. Journal of the American Chemical Society 141(10) (2019) 4194-4198
Space group: C 1 2 1
Cell volume: 2209
Cell parameters: 17.735; 12.563; 13.175; 90; 131.204; 90;  

COD ID: 4127485
CIF file Formula: - C22 H24 Br N O2 -
Comments: Cao, Min; Yesilcimen, Ahmet; Wasa, Masayuki Enantioselective Conia-Ene-Type Cyclizations of Alkynyl Ketones through Cooperative Action of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub>, N-Alkylamine and a Zn-Based Catalyst. Journal of the American Chemical Society 141(10) (2019) 4199-4203
Space group: P 1 21 1
Cell volume: 1942.2
Cell parameters: 5.1733; 21.213; 17.838; 90; 97.186; 90;  

COD ID: 4127486
CIF file Formula: - C38 H52.73 Au B Cl2 F4 N4 O7.37 -
Comments: Kim, Suhong; Toste, F. Dean Mechanism of Photoredox-Initiated C-C and C-N Bond Formation by Arylation of IPrAu(I)-CF<sub>3</sub> and IPrAu(I)-Succinimide. Journal of the American Chemical Society 141(10) (2019) 4308-4315
Space group: P -1
Cell volume: 2236.3
Cell parameters: 12.42; 12.666; 14.5678; 77.775; 89.028; 86.844;  

COD ID: 4127487
CIF file Formula: - C35 H48 Au B Cl2 F7 N3 O5 -
Comments: Kim, Suhong; Toste, F. Dean Mechanism of Photoredox-Initiated C-C and C-N Bond Formation by Arylation of IPrAu(I)-CF<sub>3</sub> and IPrAu(I)-Succinimide. Journal of the American Chemical Society 141(10) (2019) 4308-4315
Space group: P 21 21 21
Cell volume: 4113.16
Cell parameters: 10.0952; 13.0588; 31.2002; 90; 90; 90;  

COD ID: 4127488
CIF file Formula: - C4 H9 Cl3 F Mn N -
Comments: Ai, Yong; Chen, Xiao-Gang; Shi, Ping-Ping; Tang, Yuan-Yuan; Li, Peng-Fei; Liao, Wei-Qiang; Xiong, Ren-Gen Fluorine Substitution Induced High T<sub>c</sub> of Enantiomeric Perovskite Ferroelectrics: ( R) - and ( S) -3-(Fluoropyrrolidinium)MnCl<sub>3</sub>. Journal of the American Chemical Society 141(10) (2019) 4474-4479
Space group: P 1 21 1
Cell volume: 438.44
Cell parameters: 7.622; 6.488; 9.5948; 90; 112.474; 90;  

COD ID: 4127489
CIF file Formula: - C4 H9 Cl3 F Mn N -
Comments: Ai, Yong; Chen, Xiao-Gang; Shi, Ping-Ping; Tang, Yuan-Yuan; Li, Peng-Fei; Liao, Wei-Qiang; Xiong, Ren-Gen Fluorine Substitution Induced High T<sub>c</sub> of Enantiomeric Perovskite Ferroelectrics: ( R) - and ( S) -3-(Fluoropyrrolidinium)MnCl<sub>3</sub>. Journal of the American Chemical Society 141(10) (2019) 4474-4479
Space group: P 1 21 1
Cell volume: 438.99
Cell parameters: 7.6244; 6.493; 9.591; 90; 112.397; 90;  

COD ID: 4127490
CIF file Formula: - C4 H9 Cl3 F Mn N -
Comments: Ai, Yong; Chen, Xiao-Gang; Shi, Ping-Ping; Tang, Yuan-Yuan; Li, Peng-Fei; Liao, Wei-Qiang; Xiong, Ren-Gen Fluorine Substitution Induced High T<sub>c</sub> of Enantiomeric Perovskite Ferroelectrics: ( R) - and ( S) -3-(Fluoropyrrolidinium)MnCl<sub>3</sub>. Journal of the American Chemical Society 141(10) (2019) 4474-4479
Space group: C 2 2 21
Cell volume: 886.11
Cell parameters: 7.6808; 17.7492; 6.4998; 90; 90; 90;  

COD ID: 4127491
CIF file Formula: - C4 H9 Cl3 F Mn N -
Comments: Ai, Yong; Chen, Xiao-Gang; Shi, Ping-Ping; Tang, Yuan-Yuan; Li, Peng-Fei; Liao, Wei-Qiang; Xiong, Ren-Gen Fluorine Substitution Induced High T<sub>c</sub> of Enantiomeric Perovskite Ferroelectrics: ( R) - and ( S) -3-(Fluoropyrrolidinium)MnCl<sub>3</sub>. Journal of the American Chemical Society 141(10) (2019) 4474-4479
Space group: C 2 2 21
Cell volume: 884.55
Cell parameters: 7.6727; 17.7337; 6.5009; 90; 90; 90;  

COD ID: 4127492
CIF file Formula: - C31 H34 Cl Cr P -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P 1 21/n 1
Cell volume: 2758.43
Cell parameters: 9.138; 18.3287; 16.6855; 90; 99.23; 90;  

COD ID: 4127493
CIF file Formula: - C31 H46 Cl Cr P -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P 1 21/n 1
Cell volume: 2887.91
Cell parameters: 10.8191; 16.785; 16.1306; 90; 99.642; 90;  

COD ID: 4127494
CIF file Formula: - C25 H38 Cl Cr P -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P -1
Cell volume: 2504.45
Cell parameters: 8.4943; 17.3964; 17.6923; 74.282; 84.815; 86.464;  

COD ID: 4127495
CIF file Formula: - C93 H102 Cr3 N8 P3 -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P 21 21 21
Cell volume: 10746.2
Cell parameters: 17.3686; 23.3588; 26.4874; 90; 90; 90;  

COD ID: 4127496
CIF file Formula: - C62 H92 Cr2 N6 P2 -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P 21 21 21
Cell volume: 6539.8
Cell parameters: 15.2595; 16.1681; 26.5072; 90; 90; 90;  

COD ID: 4127497
CIF file Formula: - C49 H82 Cr K N6 O6 P -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: I 1 2/a 1
Cell volume: 10456
Cell parameters: 20.6373; 17.5541; 28.8861; 90; 92.318; 90;  

COD ID: 4127498
CIF file Formula: - C49 H82 Cr N6 O6 P Rb -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P -1
Cell volume: 2661.94
Cell parameters: 13.175; 14.4943; 15.6898; 115.098; 97.038; 94.806;  

COD ID: 4127499
CIF file Formula: - C49 H82 Cr Cs N6 O6 P -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P 1 21/c 1
Cell volume: 11377
Cell parameters: 25.3634; 18.6014; 24.164; 90; 93.673; 90;  

COD ID: 4127500
CIF file Formula: - C37 H64 Cr N2 P Si2 -
Comments: Yin, Jianhao; Li, Jiapeng; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng Dinitrogen Functionalization Affording Chromium Hydrazido Complex. Journal of the American Chemical Society 141(10) (2019) 4241-4247
Space group: P 1
Cell volume: 1919.7
Cell parameters: 10.8222; 11.3035; 16.5127; 90.867; 101.725; 103.42;  

COD ID: 4127501
CIF file Formula: - C10 H12 O4 -
Comments: Fan, Jie; Liao, Ge; Kindinger, Florian; Ludwig-Radtke, Lena; Yin, Wen-Bing; Li, Shu-Ming Peniphenone and Penilactone Formation in Penicillium crustosum via 1,4-Michael Additions of ortho-Quinone Methide from Hydroxyclavatol to γ-Butyrolactones from Crustosic Acid. Journal of the American Chemical Society 141(10) (2019) 4225-4229
Space group: P -1
Cell volume: 456.97
Cell parameters: 7.7553; 8.2119; 8.3575; 77.75; 69.61; 66.847;  

COD ID: 4127502
CIF file Formula: - C90 H120 O12 -
Comments: Jia, Fei; Hupatz, Henrik; Yang, Liu-Pan; Schröder, Hendrik V; Li, Dong-Hao; Xin, Shan; Lentz, Dieter; Witte, Felix; Xie, Xiaojiang; Paulus, Beate; Schalley, Christoph A.; Jiang, Wei Naphthocage: A Flexible yet Extremely Strong Binder for Singly Charged Organic Cations. Journal of the American Chemical Society 141(10) (2019) 4468-4473
Space group: P 21 21 21
Cell volume: 7843.9
Cell parameters: 13.714; 21.0582; 27.161; 90; 90; 90;  

COD ID: 4127503
CIF file Formula: - C12 H33 Cd2 Cl7 F3 N3 -
Comments: Wang, Zhong-Xia; Zhang, Yi; Tang, Yuan-Yuan; Li, Peng-Fei; Xiong, Ren-Gen Fluoridation Achieved Antiperovskite Molecular Ferroelectric in [(CH<sub>3</sub>)<sub>2</sub>(F-CH<sub>2</sub>CH<sub>2</sub>)NH]<sub>3</sub>(CdCl<sub>3</sub>)(CdCl<sub>4</sub>). Journal of the American Chemical Society 141(10) (2019) 4372-4378
Space group: P 63
Cell volume: 1311.87
Cell parameters: 15.076; 15.076; 6.6648; 90; 90; 120;  

COD ID: 4127504
CIF file Formula: - C12 H33 Cd2 Cl7 F3 N3 -
Comments: Wang, Zhong-Xia; Zhang, Yi; Tang, Yuan-Yuan; Li, Peng-Fei; Xiong, Ren-Gen Fluoridation Achieved Antiperovskite Molecular Ferroelectric in [(CH<sub>3</sub>)<sub>2</sub>(F-CH<sub>2</sub>CH<sub>2</sub>)NH]<sub>3</sub>(CdCl<sub>3</sub>)(CdCl<sub>4</sub>). Journal of the American Chemical Society 141(10) (2019) 4372-4378
Space group: P 63/m
Cell volume: 1360.25
Cell parameters: 15.2801; 15.2801; 6.7272; 90; 90; 120;  

COD ID: 4127505
CIF file Formula: - C12 H33 Cd2 Cl7 F3 N3 -
Comments: Wang, Zhong-Xia; Zhang, Yi; Tang, Yuan-Yuan; Li, Peng-Fei; Xiong, Ren-Gen Fluoridation Achieved Antiperovskite Molecular Ferroelectric in [(CH<sub>3</sub>)<sub>2</sub>(F-CH<sub>2</sub>CH<sub>2</sub>)NH]<sub>3</sub>(CdCl<sub>3</sub>)(CdCl<sub>4</sub>). Journal of the American Chemical Society 141(10) (2019) 4372-4378
Space group: P 63
Cell volume: 1348.64
Cell parameters: 15.2403; 15.2403; 6.7047; 90; 90; 120;  

COD ID: 4127506
CIF file Formula: - C4 H12 Cd Cl3 N -
Comments: Wang, Zhong-Xia; Zhang, Yi; Tang, Yuan-Yuan; Li, Peng-Fei; Xiong, Ren-Gen Fluoridation Achieved Antiperovskite Molecular Ferroelectric in [(CH<sub>3</sub>)<sub>2</sub>(F-CH<sub>2</sub>CH<sub>2</sub>)NH]<sub>3</sub>(CdCl<sub>3</sub>)(CdCl<sub>4</sub>). Journal of the American Chemical Society 141(10) (2019) 4372-4378
Space group: P 1 21/c 1
Cell volume: 930.82
Cell parameters: 6.7388; 15.1099; 10.4269; 90; 118.749; 90;  

COD ID: 4127507
CIF file Formula: - C150 H170 Cu6 F24 N6 P16 -
Comments: Nakajima, Takayuki; Kamiryo, Yoshia; Kishimoto, Masayo; Imai, Kaho; Nakamae, Kanako; Ura, Yasuyuki; Tanase, Tomoaki Synergistic Cu<sub>2</sub> Catalysts for Formic Acid Dehydrogenation. Journal of the American Chemical Society 141(22) (2019) 8732-8736
Space group: P -1
Cell volume: 4609
Cell parameters: 14.838; 16.122; 20.858; 102.267; 91.596; 108.174;  

COD ID: 4127508
CIF file Formula: - C162 H182 Cu6 F24 N8 P16 -
Comments: Nakajima, Takayuki; Kamiryo, Yoshia; Kishimoto, Masayo; Imai, Kaho; Nakamae, Kanako; Ura, Yasuyuki; Tanase, Tomoaki Synergistic Cu<sub>2</sub> Catalysts for Formic Acid Dehydrogenation. Journal of the American Chemical Society 141(22) (2019) 8732-8736
Space group: P -1
Cell volume: 9686.2
Cell parameters: 20.1652; 22.4654; 24.3771; 70.24; 69.104; 86.578;  

COD ID: 4127509
CIF file Formula: - C49 H52 Cu2 F12 N4 P6 -
Comments: Nakajima, Takayuki; Kamiryo, Yoshia; Kishimoto, Masayo; Imai, Kaho; Nakamae, Kanako; Ura, Yasuyuki; Tanase, Tomoaki Synergistic Cu<sub>2</sub> Catalysts for Formic Acid Dehydrogenation. Journal of the American Chemical Society 141(22) (2019) 8732-8736
Space group: C 1 c 1
Cell volume: 5536
Cell parameters: 15.87; 16.613; 21.508; 90; 102.508; 90;  

COD ID: 4127510
CIF file Formula: - C52 H94.6 Co4 N8 O37.3 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 3584.52
Cell parameters: 14.6328; 14.6409; 18.168; 94.984; 112.238; 90.794;  

COD ID: 4127511
CIF file Formula: - C44 H40 Cl4 Co4 N8 O10 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: I -4 3 d
Cell volume: 13726.8
Cell parameters: 23.9436; 23.9436; 23.9436; 90; 90; 90;  

COD ID: 4127512
CIF file Formula: - C50 H53 Co4 N9 O21 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2716.19
Cell parameters: 12.6957; 14.2283; 15.5843; 90.19; 105.029; 92.381;  

COD ID: 4127513
CIF file Formula: - C50 H51 B Co4 F4 N8 O17 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2723.1
Cell parameters: 12.7299; 14.2087; 15.7489; 89.78; 73.273; 86.642;  

COD ID: 4127514
CIF file Formula: - C50.5 H51 Co4 F6 N8 O16.5 P -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2827.89
Cell parameters: 12.9163; 14.142; 16.2926; 89.681; 72.126; 86.839;  

COD ID: 4127515
CIF file Formula: - C48 H58 B2 Co4 F8 N8 O20 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/n 1
Cell volume: 5897.2
Cell parameters: 15.4022; 24.0916; 16.0068; 90; 96.849; 90;  

COD ID: 4127516
CIF file Formula: - C50 H51.85 Cl Co4 N8 O20.42 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2743.49
Cell parameters: 12.7097; 14.2447; 15.7479; 90.0964; 105.617; 92.2521;  

COD ID: 4127517
CIF file Formula: - C48 H46 B2 Co4 F8 N8 O14 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5239.7
Cell parameters: 22.6584; 12.1359; 21.1615; 90; 115.784; 90;  

COD ID: 4127518
CIF file Formula: - C48 H46 Cl2 Co4 N8 O20 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5131.8
Cell parameters: 22.3692; 12.07776; 21.0774; 90; 115.686; 90;  

COD ID: 4127519
CIF file Formula: - C48 H46 Co4 N10 O20 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5183.2
Cell parameters: 22.5898; 11.955; 21.4009; 90; 116.258; 90;  

COD ID: 4127520
CIF file Formula: - C44 H56 Co4 N12 O30 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2830.48
Cell parameters: 11.7024; 12.9555; 19.8107; 91.1275; 100.374; 106.123;  

COD ID: 4127521
CIF file Formula: - C60 H72 Co4 N8 O20 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 3188.7
Cell parameters: 12.6067; 14.0325; 18.7571; 90; 106.059; 90;  

COD ID: 4127522
CIF file Formula: - C40 H37 Co2 N5 O7 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/n 1
Cell volume: 3770.9
Cell parameters: 9.2864; 21.6644; 18.8463; 90; 95.987; 90;  

COD ID: 4127523
CIF file Formula: - C66 H60.21 Co5 N15 O29.5 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 3619.75
Cell parameters: 11.9321; 13.3864; 23.8027; 91.281; 92.085; 107.581;  

COD ID: 4127524
CIF file Formula: - C52 H90 Co4 N8 O37 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 3704.6
Cell parameters: 14.7712; 17.5108; 17.9137; 63.079; 70.43; 65.817;  

COD ID: 4127525
CIF file Formula: - C48 H46 B2 Co2.3 F8 N8 Ni1.7 O14 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5242.3
Cell parameters: 22.7806; 12.0764; 21.2581; 90; 116.313; 90;  

COD ID: 4127526
CIF file Formula: - C48 H48 Cl2 Co2.3 N8 Ni1.7 O21 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5130.3
Cell parameters: 22.4421; 12.016; 21.2212; 90; 116.299; 90;  

COD ID: 4127527
CIF file Formula: - C48 H46 Cl2 Co1.94 N8 Ni2.06 O22 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5254.2
Cell parameters: 22.7499; 12.1315; 21.164; 90; 115.903; 90;  

COD ID: 4127528
CIF file Formula: - C48 H46 Co1.66 F12 N8 Ni2.34 O14 P2 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2766.35
Cell parameters: 12.2745; 13.3722; 19.5727; 88.324; 73.699; 64.454;  

COD ID: 4127529
CIF file Formula: - C50 H67 B Co1.54 F4 N8 Ni2.46 O25 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 6221.8
Cell parameters: 11.9719; 24.6331; 21.5467; 90; 101.719; 90;  

COD ID: 4127530
CIF file Formula: - C50 H61 Cl Co2.34 N8 Ni1.66 O22 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 5954.8
Cell parameters: 12.2353; 17.64; 27.9435; 90; 99.12; 90;  

COD ID: 4127531
CIF file Formula: - C50 H67 Cl Co2.32 N8 Ni1.68 O28 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 6089.9
Cell parameters: 12.0091; 23.9541; 21.5009; 90; 100.068; 90;  

COD ID: 4127532
CIF file Formula: - C50 H67 Cl Co1.9 N8 Ni2.1 O29 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 6198.65
Cell parameters: 12.0492; 24.3545; 21.4569; 90; 100.118; 90;  

COD ID: 4127533
CIF file Formula: - C50 H67 Co1.54 N9 Ni2.46 O28 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 5993.5
Cell parameters: 11.9277; 23.7667; 21.4551; 90; 99.791; 90;  

COD ID: 4127534
CIF file Formula: - C50 H67 Co2.36 F6 N8 Ni1.64 O25 P -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P 1 21/c 1
Cell volume: 6327.3
Cell parameters: 12.105; 24.6661; 21.5614; 90; 100.632; 90;  

COD ID: 4127535
CIF file Formula: - C48 H47.6 N10 Ni4 O21.42 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: C 1 2/c 1
Cell volume: 5139.55
Cell parameters: 22.5327; 11.87693; 21.4511; 90; 116.456; 90;  

COD ID: 4127536
CIF file Formula: - C44 H56 N12 Ni4 O30 -
Comments: Song, Fangyuan; Al-Ameed, Karrar; Schilling, Mauro; Fox, Thomas; Luber, Sandra; Patzke, Greta R. Mechanistically Driven Control over Cubane Oxo Cluster Catalysts. Journal of the American Chemical Society 141(22) (2019) 8846-8857
Space group: P -1
Cell volume: 2788.63
Cell parameters: 11.60874; 12.86774; 19.73943; 91.543; 99.0305; 106.203;  


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All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.