Crystallography Open Database

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Searching journal of publication like 'Chemical Science' volume of publication is 2

COD ID: 1515411
CIF file Formula: - C21 H30 -
Comments: Bojase, Gomotsang; Nguyen, Thanh V.; Payne, Alan D.; Willis, Anthony C.; Sherburn, Michael S. Synthesis and properties of the ivyanes: the parent 1,1-oligocyclopropanes Chemical Science 2(2) (2011) 229
Space group: P 1 21/c 1
Cell volume: 1665.98
Cell parameters: 9.5922; 7.2501; 24.0793; 90; 95.81; 90;  

COD ID: 1515412
CIF file Formula: - C24 H34 -
Comments: Bojase, Gomotsang; Nguyen, Thanh V.; Payne, Alan D.; Willis, Anthony C.; Sherburn, Michael S. Synthesis and properties of the ivyanes: the parent 1,1-oligocyclopropanes Chemical Science 2(2) (2011) 229
Space group: P b c n
Cell volume: 1902.71
Cell parameters: 10.5317; 13.1456; 13.7434; 90; 90; 90;  

COD ID: 1515414
CIF file Formula: - C12 H18 N2 O -
Comments: Andrews, Natalie J.; Haynes, Cally J. E.; Light, Mark E.; Moore, Stephen J.; Tong, Christine C.; Davis, Jeffery T.; Harrell Jr., William A.; Gale, Philip A. Structurally simple lipid bilayer transport agents for chloride and bicarbonate Chemical Science 2(2) (2011) 256
Space group: P c c n
Cell volume: 4793.1
Cell parameters: 21.8777; 24.4332; 8.9667; 90; 90; 90;  

COD ID: 1515415
CIF file Formula: - C14 H19 N3 S -
Comments: Andrews, Natalie J.; Haynes, Cally J. E.; Light, Mark E.; Moore, Stephen J.; Tong, Christine C.; Davis, Jeffery T.; Harrell Jr., William A.; Gale, Philip A. Structurally simple lipid bilayer transport agents for chloride and bicarbonate Chemical Science 2(2) (2011) 256
Space group: I 41/a :2
Cell volume: 6478.3
Cell parameters: 29.2158; 29.2158; 7.5897; 90; 90; 90;  

COD ID: 1515416
CIF file Formula: - C50 H56 N4 O2 Pd -
Comments: Konnick, Michael M.; Decharin, Nattawan; Popp, Brian V.; Stahl, Shannon S. O2 insertion into a palladium(ii)-hydride bond: Observation of mechanistic crossover between HX-reductive-elimination and hydrogen-atom-abstraction pathways Chemical Science 2(2) (2011) 326
Space group: P 1 21/n 1
Cell volume: 4326.6
Cell parameters: 10.8887; 22.7188; 17.5682; 90; 95.413; 90;  

COD ID: 1515417
CIF file Formula: - C100 H96 B Cl3 F24 N4 Ni2 -
Comments: Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science 2(2) (2011) 321
Space group: P -1
Cell volume: 4736.7
Cell parameters: 15.022; 18.047; 20.367; 105.35; 111.153; 100.049;  

COD ID: 1515418
CIF file Formula: - C91 H96 B Cl3 F24 N4 Ni2 Si -
Comments: Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science 2(2) (2011) 321
Space group: P -1
Cell volume: 4603
Cell parameters: 13.729; 17.963; 20.822; 69.525; 73.169; 82.761;  

COD ID: 1515419
CIF file Formula: - C88 H84 B Cl F24 N4 Ni2 O2 -
Comments: Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science 2(2) (2011) 321
Space group: P -1
Cell volume: 4352
Cell parameters: 12.531; 17.5339; 21.5138; 106.672; 104.999; 91.05;  

COD ID: 1515420
CIF file Formula: - C74 H69 B F24 N5 Ni -
Comments: Laskowski, Carl A.; Hillhouse, Gregory L. Synthesis and carbene-transfer reactivity of dimeric nickel carbene cations supported by N-heterocyclic carbene ligands Chemical Science 2(2) (2011) 321
Space group: P 1 21/c 1
Cell volume: 8132.7
Cell parameters: 20.61; 12.802; 30.984; 90; 95.837; 90;  

COD ID: 1515421
CIF file Formula: - C22.27 H24.8 Cl0.47 N2 -
Comments: Zhang, Chen; Das, Deepankar; Seidel, Daniel Azomethine ylide annulations: facile access to polycyclic ring systems Chemical Science 2(2) (2011) 233
Space group: P 1 21/c 1
Cell volume: 3552.5
Cell parameters: 12.378; 11.7627; 24.4212; 90; 92.43; 90;  

COD ID: 1515422
CIF file Formula: - C23 H26 N2 O2 -
Comments: Zhang, Chen; Das, Deepankar; Seidel, Daniel Azomethine ylide annulations: facile access to polycyclic ring systems Chemical Science 2(2) (2011) 233
Space group: P 1 21/c 1
Cell volume: 1878.36
Cell parameters: 8.9485; 12.2725; 17.1292; 90; 93.113; 90;  

COD ID: 1515423
CIF file Formula: - C13 H17 Cl2 N5 O2 Pt -
Comments: Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science 2(2) (2011) 216
Space group: P -1
Cell volume: 881.2
Cell parameters: 6.848; 11.736; 12.384; 65.95; 79.94; 76.84;  

COD ID: 1515424
CIF file Formula: - C13 H14.33 Cl2 N5 O0.67 Pt -
Comments: Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science 2(2) (2011) 216
Space group: P 1 21/c 1
Cell volume: 4707.4
Cell parameters: 12.588; 18.736; 20.805; 90; 106.39; 90;  

COD ID: 1515425
CIF file Formula: - C13 H13 Cl2 N5 O4 Pt -
Comments: Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science 2(2) (2011) 216
Space group: P 1 21/c 1
Cell volume: 1648.8
Cell parameters: 10.669; 10.411; 15.689; 90; 108.89; 90;  

COD ID: 1515426
CIF file Formula: - C13 H19 Cl2 N5 O3 Pt S -
Comments: Che, Chi-Ming; Chow, Cheuk-Fai; Yuen, Mai-Yan; Roy, V. A. L.; Lu, Wei; Chen, Yong; Chui, Stephen Sin-Yin; Zhu, Nianyong Single microcrystals of organoplatinum(II) complexes with high charge-carrier mobility Chemical Science 2(2) (2011) 216
Space group: P 1 21/c 1
Cell volume: 1899.52
Cell parameters: 9.474; 7.1809; 27.9371; 90; 91.94; 90;  

COD ID: 1515427
CIF file Formula: - C57 H65 F3 Si2 -
Comments: Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science 2(2) (2011) 363
Space group: P 1 21/c 1
Cell volume: 4707.52
Cell parameters: 14.7922; 17.7744; 18.0925; 90; 98.265; 90;  

COD ID: 1515428
CIF file Formula: - C45 H53 F3 Si2 -
Comments: Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science 2(2) (2011) 363
Space group: P 1 21/c 1
Cell volume: 3951.56
Cell parameters: 9.0009; 12.9917; 33.9922; 90; 96.2183; 90;  

COD ID: 1515429
CIF file Formula: - C44 H53 N O2 Si2 -
Comments: Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science 2(2) (2011) 363
Space group: P -1
Cell volume: 967.02
Cell parameters: 7.3935; 7.7475; 17.3713; 96.23; 100.619; 94.648;  

COD ID: 1515430
CIF file Formula: - C45 H53 F3 Si2 -
Comments: Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science 2(2) (2011) 363
Space group: P -1
Cell volume: 2007.37
Cell parameters: 7.7521; 15.8341; 17.6273; 70.941; 80.257; 81.988;  

COD ID: 1515431
CIF file Formula: - C45 H53 F3 Si2 -
Comments: Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells Chemical Science 2(2) (2011) 363
Space group: P 1 21/c 1
Cell volume: 4008.26
Cell parameters: 13.6256; 28.5329; 10.5392; 90; 101.974; 90;  

COD ID: 1515432
CIF file Formula: - C53 H51 O6 Ti -
Comments: Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science 2(2) (2011) 331
Space group: P -1
Cell volume: 2175.9
Cell parameters: 9.536; 10.7745; 21.214; 87.903; 87.712; 88.606;  

COD ID: 1515433
CIF file Formula: - C43 H39 Cl3 D N O6 Ti -
Comments: Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science 2(2) (2011) 331
Space group: P -1
Cell volume: 1934.4
Cell parameters: 12.0648; 12.6467; 14.4497; 109.368; 96.4954; 106.998;  

COD ID: 1515434
CIF file Formula: - C40 H29 Cl6 N5 O14 Ti -
Comments: Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science 2(2) (2011) 331
Space group: P -1
Cell volume: 2200.11
Cell parameters: 11.2931; 13.344; 15.1141; 96.792; 102.423; 93.434;  

COD ID: 1515435
CIF file Formula: - C35 H34 Cl2 D2 N2 O6 Ti -
Comments: Kongprakaiwoot, Natcharee; Quiroz-Guzman, Mauricio; Oliver, Allen G.; Brown, Seth N. Gauging electronic dissymmetry in bis-chelates of titanium(iv) using sterically and electronically variable 2,2′-biphenoxides Chemical Science 2(2) (2011) 331
Space group: P 1 21/n 1
Cell volume: 3305.8
Cell parameters: 12.3148; 13.2234; 20.372; 90; 94.795; 90;  

COD ID: 1515436
CIF file Formula: - C21 H18 O2 S -
Comments: Liu, Yu; Ma, Shengming Unique reactivity of Grignard reagents towards cyclopropenyl-carboxylates—highly selective carbon–carbon bond cleavage Chemical Science 2(4) (2011) 811
Space group: P 1 21 1
Cell volume: 857.51
Cell parameters: 11.6322; 5.663; 13.3325; 90; 102.479; 90;  

COD ID: 1515437
CIF file Formula: - C24 H21 I O4 S -
Comments: Liu, Yu; Ma, Shengming Unique reactivity of Grignard reagents towards cyclopropenyl-carboxylates—highly selective carbon‒carbon bond cleavage Chemical Science 2(4) (2011) 811
Space group: P -1
Cell volume: 2266.47
Cell parameters: 10.4567; 14.5947; 16.071; 82.184; 80.017; 70.323;  

COD ID: 1515438
CIF file Formula: - C36 H31 F3 N Ni O3 -
Comments: Vogt, Matthias; de Bruin, Bas; Berke, Heinz; Trincado, Mónica; Grützmacher, Hansjörg Amino olefin nickel(i) and nickel(0) complexes as dehydrogenation catalysts for amine boranes Chemical Science 2(4) (2011) 723
Space group: P 1 21/n 1
Cell volume: 2869.4
Cell parameters: 13.992; 11.424; 18.291; 90; 101.06; 90;  

COD ID: 1515439
CIF file Formula: - C48 H38 N Ni P -
Comments: Vogt, Matthias; de Bruin, Bas; Berke, Heinz; Trincado, Mónica; Grützmacher, Hansjörg Amino olefin nickel(i) and nickel(0) complexes as dehydrogenation catalysts for amine boranes Chemical Science 2(4) (2011) 723
Space group: P -1
Cell volume: 1758.7
Cell parameters: 11.413; 12.0679; 14.4208; 98.677; 95.682; 114.432;  

COD ID: 1515440
CIF file Formula: - C12 H8 Cl N O2 S2 -
Comments: Belenguer, Ana M.; Friščić, Tomislav; Day, Graeme M.; Sanders, Jeremy K. M. Solid-state dynamic combinatorial chemistry: reversibility and thermodynamic product selection in covalent mechanosynthesis Chemical Science 2(4) (2011) 696
Space group: P 1 21/n 1
Cell volume: 1244.7
Cell parameters: 13.4561; 7.103; 13.8346; 90; 109.73; 90;  

COD ID: 1515441
CIF file Formula: - C14 H14 S2 -
Comments: Belenguer, Ana M.; Friščić, Tomislav; Day, Graeme M.; Sanders, Jeremy K. M. Solid-state dynamic combinatorial chemistry: reversibility and thermodynamic product selection in covalent mechanosynthesis Chemical Science 2(4) (2011) 696
Space group: P 1 21 1
Cell volume: 640.93
Cell parameters: 7.6164; 5.7256; 14.7508; 90; 94.881; 90;  

COD ID: 1515442
CIF file Formula: - C254 H114 F24 Fe4 N34 O32 S16 -
Comments: Hristova, Yana R.; Smulders, Maarten M. J.; Clegg, Jack K.; Breiner, Boris; Nitschke, Jonathan R. Selective anion binding by a “Chameleon” capsule with a dynamically reconfigurable exterior Chemical Science 2(4) (2011) 638
Space group: P 1 21/c 1
Cell volume: 24126.5
Cell parameters: 35.2292; 20.7057; 34.2007; 90; 104.74; 90;  

COD ID: 1515443
CIF file Formula: - C169 H123 F45 Fe4 N36 O31 S10 -
Comments: Hristova, Yana R.; Smulders, Maarten M. J.; Clegg, Jack K.; Breiner, Boris; Nitschke, Jonathan R. Selective anion binding by a “Chameleon” capsule with a dynamically reconfigurable exterior Chemical Science 2(4) (2011) 638
Space group: C 1 2 1
Cell volume: 23065
Cell parameters: 26.876; 38.443; 22.391; 90; 94.44; 90;  

COD ID: 1515444
CIF file Formula: - C12 H17 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P 1 21/n 1
Cell volume: 1102.4
Cell parameters: 12.4376; 6.2473; 14.2135; 90; 93.459; 90;  

COD ID: 1515445
CIF file Formula: - C12 H17 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P 1 21/c 1
Cell volume: 1093.02
Cell parameters: 13.0268; 6.8021; 12.7876; 90; 105.286; 90;  

COD ID: 1515446
CIF file Formula: - C12 H17 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P 1 21/c 1
Cell volume: 1061.8
Cell parameters: 16.985; 5.1183; 12.565; 90; 103.577; 90;  

COD ID: 1515447
CIF file Formula: - C18 H31 N O3 Si -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P 1 21/c 1
Cell volume: 3849.3
Cell parameters: 7.3695; 47.261; 11.0525; 90; 90.47; 90;  

COD ID: 1515448
CIF file Formula: - C17 H19 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P b c a
Cell volume: 2788.6
Cell parameters: 7.7628; 11.1348; 32.262; 90; 90; 90;  

COD ID: 1515449
CIF file Formula: - C18 H21 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P c a 21
Cell volume: 3095.7
Cell parameters: 11.93; 8.5702; 30.278; 90; 90; 90;  

COD ID: 1515450
CIF file Formula: - C24 H25 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P 21 21 21
Cell volume: 1908.52
Cell parameters: 8.2299; 9.6964; 23.9162; 90; 90; 90;  

COD ID: 1515451
CIF file Formula: - C24 H25 N O2 -
Comments: Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science 2(4) (2011) 633
Space group: P 21 21 21
Cell volume: 1941.96
Cell parameters: 8.2075; 9.8258; 24.0803; 90; 90; 90;  

COD ID: 1515452
CIF file Formula: - C30 H20 Br2 Cu N4 O4 S2 -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P 1 21/n 1
Cell volume: 2901.2
Cell parameters: 17.027; 9.5242; 18.442; 90; 104.05; 90;  

COD ID: 1515453
CIF file Formula: - C15 H20 N2 O3 -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P -1
Cell volume: 716.44
Cell parameters: 7.5438; 9.0878; 11.3719; 85.485; 78.375; 69.76;  

COD ID: 1515454
CIF file Formula: - C12.5 H15 N2 O3 -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P 1 21/n 1
Cell volume: 2419.4
Cell parameters: 12.965; 14.378; 12.9795; 90; 90.445; 90;  

COD ID: 1515455
CIF file Formula: - C30 H32 Cl6 Cu N4 O4 -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P 1 21/c 1
Cell volume: 1684.1
Cell parameters: 12.997; 15.328; 9.0063; 90; 110.181; 90;  

COD ID: 1515456
CIF file Formula: - C14 H14 N2 O3 S -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P -1
Cell volume: 1470
Cell parameters: 11.368; 11.457; 12.809; 67.679; 76.787; 74.165;  

COD ID: 1515457
CIF file Formula: - C13 H16 N2 O3 -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P 1 21 1
Cell volume: 1222.56
Cell parameters: 8.2835; 13.979; 10.5581; 90; 90.255; 90;  

COD ID: 1515458
CIF file Formula: - C13 H10 N2 O2 S -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P 1 21/c 1
Cell volume: 1116.7
Cell parameters: 10.3006; 7.8737; 13.7999; 90; 93.837; 90;  

COD ID: 1515459
CIF file Formula: - C28 H34 Cu N4 O6 S2 -
Comments: Scott, Lauren E.; Telpoukhovskaia, Maria; Rodríguez-Rodríguez, Cristina; Merkel, Michael; Bowen, Meryn L.; Page, Brent D. G.; Green, David E.; Storr, Tim; Thomas, Fancy; Allen, David D.; Lockman, Paul R.; Patrick, Brian O.; Adam, Michael J.; Orvig, Chris N-Aryl-substituted 3-(β-D-glucopyranosyloxy)-2-methyl-4(1H)-pyridinones as agents for Alzheimer's therapy Chemical Science 2(4) (2011) 642
Space group: P 1 21/c 1
Cell volume: 1499.6
Cell parameters: 7.7458; 16.433; 12.0999; 90; 103.182; 90;  

COD ID: 1515460
CIF file Formula: - C26 H30 N2 O4 -
Comments: Iengo, Elisabetta; Pantoş, G. Dan; Sanders, Jeremy K. M.; Orlandi, Michele; Chiorboli, Claudio; Fracasso, Sandro; Scandola, Franco A fully self-assembled non-symmetric triad for photoinduced charge separation Chemical Science 2(4) (2011) 676
Space group: P -1
Cell volume: 561.44
Cell parameters: 4.8231; 8.3044; 14.264; 96.566; 97.473; 92.996;  

COD ID: 1515461
CIF file Formula: - C27 H31 F6 N4 P Pt -
Comments: Wai-Yin Sun, Raymond; Lok-Fung Chow, Andy; Li, Xiao-Hua; Yan, Jessie Jing; Sin-Yin Chui, Stephen; Che, Chi-Ming Luminescent cyclometalated platinum(ii) complexes containing N-heterocyclic carbene ligands with potent in vitro and in vivo anti-cancer properties accumulate in cytoplasmic structures of cancer cells Chemical Science 2(4) (2011) 728
Space group: P 1 21/n 1
Cell volume: 2879.4
Cell parameters: 13.381; 14.391; 16.034; 90; 111.16; 90;  

COD ID: 1515462
CIF file Formula: - C23 H23 I3 N4 Pt -
Comments: Wai-Yin Sun, Raymond; Lok-Fung Chow, Andy; Li, Xiao-Hua; Yan, Jessie Jing; Sin-Yin Chui, Stephen; Che, Chi-Ming Luminescent cyclometalated platinum(ii) complexes containing N-heterocyclic carbene ligands with potent in vitro and in vivo anti-cancer properties accumulate in cytoplasmic structures of cancer cells Chemical Science 2(4) (2011) 728
Space group: P -1
Cell volume: 1323.7
Cell parameters: 8.652; 11.015; 14.031; 90.68; 98.09; 90.57;  

COD ID: 1515463
CIF file Formula: - C47 H46 F12 N8 P2 Pt2 -
Comments: Wai-Yin Sun, Raymond; Lok-Fung Chow, Andy; Li, Xiao-Hua; Yan, Jessie Jing; Sin-Yin Chui, Stephen; Che, Chi-Ming Luminescent cyclometalated platinum(ii) complexes containing N-heterocyclic carbene ligands with potent in vitro and in vivo anti-cancer properties accumulate in cytoplasmic structures of cancer cells Chemical Science 2(4) (2011) 728
Space group: P b c a
Cell volume: 9622
Cell parameters: 18.526; 22.046; 23.559; 90; 90; 90;  

COD ID: 1515464
CIF file Formula: - C42 H28 -
Comments: Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity Chemical Science 2(4) (2011) 672
Space group: I 1 2/a 1
Cell volume: 5679.8
Cell parameters: 16.7865; 9.2933; 36.414; 90; 91.02; 90;  

COD ID: 1515465
CIF file Formula: - C40 H28 -
Comments: Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity Chemical Science 2(4) (2011) 672
Space group: P -1
Cell volume: 1397
Cell parameters: 9.485; 9.683; 15.5796; 79.592; 83.901; 85.662;  

COD ID: 1515466
CIF file Formula: - C40 H28 -
Comments: Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity Chemical Science 2(4) (2011) 672
Space group: P 1 21/c 1
Cell volume: 2826.5
Cell parameters: 17.2911; 9.0613; 18.1015; 90; 94.72; 90;  

COD ID: 1515467
CIF file Formula: - C36 H26 -
Comments: Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity Chemical Science 2(4) (2011) 672
Space group: P 1 21/n 1
Cell volume: 5132.8
Cell parameters: 9.1633; 28.882; 19.778; 90; 101.303; 90;  

COD ID: 1515468
CIF file Formula: - C38 H27 N -
Comments: Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity Chemical Science 2(4) (2011) 672
Space group: P -1
Cell volume: 1370.13
Cell parameters: 9.4375; 9.5683; 15.5001; 83.076; 81.063; 85.554;  

COD ID: 1515469
CIF file Formula: - C35 H25 N -
Comments: Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity Chemical Science 2(4) (2011) 672
Space group: P -1
Cell volume: 1249.27
Cell parameters: 9.3196; 9.3671; 14.8298; 88.746; 86.17; 75.274;  

COD ID: 1515470
CIF file Formula: - C77.5 H86 Cl10.2 S10 -
Comments: Zhang, Fan; Götz, Günther; Mena-Osteritz, Elena; Weil, Matthias; Sarkar, Biprajit; Kaim, Wolfgang; Bäuerle, Peter Molecular and electronic structure of cyclo[10]thiophene in various oxidation states: polaron pair vs. bipolaron Chemical Science 2(4) (2011) 781
Space group: P -1
Cell volume: 2050.98
Cell parameters: 11.0629; 13.661; 15.0564; 93.282; 107.469; 106.87;  

COD ID: 1515471
CIF file Formula: - C468 H298 Cl8 N16 Ni4 S4 -
Comments: Song, Jianxin; Aratani, Naoki; Shinokubo, Hiroshi; Osuka, Atsuhiro A β-to-β 2,5-thienylene-bridged cyclic porphyrin tetramer: its rational synthesis and 1 : 2 binding mode with C60 Chemical Science 2(4) (2011) 748
Space group: C 1 2/c 1
Cell volume: 49489
Cell parameters: 25.617; 71.86; 26.909; 90; 92.466; 90;  

COD ID: 1515472
CIF file Formula: - C264 H288 N16 S4 Zn4 -
Comments: Song, Jianxin; Aratani, Naoki; Shinokubo, Hiroshi; Osuka, Atsuhiro A β-to-β 2,5-thienylene-bridged cyclic porphyrin tetramer: its rational synthesis and 1 : 2 binding mode with C60 Chemical Science 2(4) (2011) 748
Space group: I -4 2 d
Cell volume: 38580
Cell parameters: 41.392; 41.392; 22.518; 90; 90; 90;  

COD ID: 1515473
CIF file Formula: - C18 H21 N3 O2 S -
Comments: Albrecht, Łukasz; Albrecht, Anna; Ransborg, Lars Krogager; Jørgensen, Karl Anker Asymmetric organocatalytic [3 + 2]-annulation strategy for the synthesis of N-fused heteroaromatic compounds Chemical Science 2(7) (2011) 1273
Space group: P 1 21 1
Cell volume: 823.78
Cell parameters: 7.7381; 7.317; 14.5532; 90; 91.323; 90;  

COD ID: 1515474
CIF file Formula: - C19 H17 Br N2 O2 -
Comments: Yin, Qin; You, Shu-Li Chiral phosphoric acid-catalysed Friedel–Crafts alkylation reaction of indoles with racemic spiro indolin-3-ones Chemical Science 2(7) (2011) 1344
Space group: P 21 21 21
Cell volume: 1731.4
Cell parameters: 7.8404; 10.9935; 20.087; 90; 90; 90;  

COD ID: 1515475
CIF file Formula: - C22 H28 Hf P -
Comments: Waterman, Rory; Tilley, T. Don Terminal hafnium phosphinidene complexes and phosphinidene ligand exchange Chemical Science 2(7) (2011) 1320
Space group: P 1 21/c 1
Cell volume: 1987.4
Cell parameters: 8.4351; 28.233; 8.7547; 90; 107.59; 90;  

COD ID: 1515476
CIF file Formula: - C34 H69 P5 Pt2 -
Comments: Waterman, Rory; Tilley, T. Don Terminal hafnium phosphinidene complexes and phosphinidene ligand exchange Chemical Science 2(7) (2011) 1320
Space group: P b c a
Cell volume: 8133
Cell parameters: 11.699; 15.37; 45.229; 90; 90; 90;  

COD ID: 1515478
CIF file Formula: - C120 H196 Dy6 Mn12 N8 O93 -
Comments: Liu, Jun-Liang; Guo, Fu-Sheng; Meng, Zhao-Sha; Zheng, Yan-Zhen; Leng, Ji-Dong; Tong, Ming-Liang; Ungur, Liviu; Chibotaru, Liviu F.; Heroux, Katie J.; Hendrickson, David N. Symmetry related [DyIII6MnIII12] cores with different magnetic anisotropies Chemical Science 2(7) (2011) 1268
Space group: F d d d :2
Cell volume: 38791
Cell parameters: 22.6849; 37.2467; 45.91; 90; 90; 90;  

COD ID: 1515479
CIF file Formula: - C130 H212 Dy6 Mn12 N8 O99 -
Comments: Liu, Jun-Liang; Guo, Fu-Sheng; Meng, Zhao-Sha; Zheng, Yan-Zhen; Leng, Ji-Dong; Tong, Ming-Liang; Ungur, Liviu; Chibotaru, Liviu F.; Heroux, Katie J.; Hendrickson, David N. Symmetry related [DyIII6MnIII12] cores with different magnetic anisotropies Chemical Science 2(7) (2011) 1268
Space group: P -1
Cell volume: 10017.8
Cell parameters: 19.7904; 21.4477; 26.7375; 95.344; 97.864; 115.293;  

COD ID: 1515480
CIF file Formula: - C132 H198 Mn12 N8 O90 Y6 -
Comments: Liu, Jun-Liang; Guo, Fu-Sheng; Meng, Zhao-Sha; Zheng, Yan-Zhen; Leng, Ji-Dong; Tong, Ming-Liang; Ungur, Liviu; Chibotaru, Liviu F.; Heroux, Katie J.; Hendrickson, David N. Symmetry related [DyIII6MnIII12] cores with different magnetic anisotropies Chemical Science 2(7) (2011) 1268
Space group: P -1
Cell volume: 10064.7
Cell parameters: 19.8997; 21.3603; 26.7219; 95.001; 97.626; 115.09;  

COD ID: 1515481
CIF file Formula: - C29 H36 N8 O2 -
Comments: Fuentes, José A.; Lebl, Tomas; Slawin, Alexandra M. Z.; Clarke, Matthew L. Synthesis of organocatalysts using non-covalent chemistry; understanding the reactivity of ProNap, an enamine-type organocatalyst that can self assemble with complementary co-catalysts Chemical Science 2(10) (2011) 1997
Space group: P 1 21 1
Cell volume: 2784.6
Cell parameters: 16.022; 10.006; 17.448; 90; 95.44; 90;  

COD ID: 1515482
CIF file Formula: - C34 H38 Co2 Mo O2 S4 -
Comments: Muratsugu, Satoshi; Sodeyama, Keitaro; Kitamura, Fusao; Tsukada, Satoru; Tada, Mizuki; Tsuneyuki, Shinji; Nishihara, Hiroshi Normal and inverted redox potentials and structural changes tuned by medium effects in [M2Mo(η5-C5Me5)2(S2C6H4)2(CO)2] (M: Co, Rh) Chemical Science 2(10) (2011) 1960
Space group: P 1 21/n 1
Cell volume: 3350
Cell parameters: 15.45; 11.362; 19.951; 90; 106.933; 90;  

COD ID: 1515483
CIF file Formula: - C30 H22 -
Comments: Luo, Jiye; Song, Kesheng; Gu, Feng long; Miao, Qian Switching of non-helical overcrowded tetrabenzoheptafulvalene derivatives Chemical Science 2(10) (2011) 2029
Space group: P 1 21/c 1
Cell volume: 1021.88
Cell parameters: 8.5511; 7.0723; 16.9235; 90; 93.189; 90;  

COD ID: 1515484
CIF file Formula: - C38 H24 -
Comments: Luo, Jiye; Song, Kesheng; Gu, Feng long; Miao, Qian Switching of non-helical overcrowded tetrabenzoheptafulvalene derivatives Chemical Science 2(10) (2011) 2029
Space group: P 1 21/c 1
Cell volume: 2647.8
Cell parameters: 10.0613; 15.6693; 17.3989; 90; 105.143; 90;  

COD ID: 1515485
CIF file Formula: - C3 H3 Mn3 O9 -
Comments: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K. Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2 Chemical Science 2(10) (2011) 1929
Space group: P 1 21/n 1
Cell volume: 748.23
Cell parameters: 10.9072; 5.7181; 12.633; 90; 108.259; 90;  

COD ID: 1515486
CIF file Formula: - C2 H3 Mn O3 -
Comments: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K. Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2 Chemical Science 2(10) (2011) 1929
Space group: P 1 21/a 1
Cell volume: 345.57
Cell parameters: 5.8745; 7.4316; 7.9227; 90; 92.414; 90;  

COD ID: 1515487
CIF file Formula: - C6 H10 Mn2 O6 -
Comments: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K. Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2 Chemical Science 2(10) (2011) 1929
Space group: P 1 21/a 1
Cell volume: 922.95
Cell parameters: 8.1023; 9.3777; 12.5161; 90; 103.948; 90;  

COD ID: 1515488
CIF file Formula: - C7 H12 Mn2 O6 -
Comments: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K. Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2 Chemical Science 2(10) (2011) 1929
Space group: P 1 21/a 1
Cell volume: 1018.8
Cell parameters: 8.1123; 9.3629; 13.462; 90; 94.88; 90;  

COD ID: 1515489
CIF file Formula: - C15 H20 Mn4 O14 -
Comments: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K. Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2 Chemical Science 2(10) (2011) 1929
Space group: P -1
Cell volume: 1007.68
Cell parameters: 5.0589; 10.5756; 19.1948; 79.883; 87.442; 85.762;  

COD ID: 1515490
CIF file Formula: - C21 H32 Mn4 O14 -
Comments: Saines, Paul J.; Jain, Prashant; Cheetham, Anthony K. Evolution of the structures and magnetic properties of the manganese dicarboxylates, Mn2(CO2(CH2)nCO2)(OH)2 and Mn4(CO2(CH2)nCO2)3(OH)2 Chemical Science 2(10) (2011) 1929
Space group: P -1
Cell volume: 1312.75
Cell parameters: 5.0585; 12.4647; 20.8241; 90.848; 90.047; 90.77;  

COD ID: 1515491
CIF file Formula: - C15 H35 Cl2 Cr N4 O10 -
Comments: Cho, Jaeheung; Woo, Jaeyoung; Eun Han, Jung; Kubo, Minoru; Ogura, Takashi; Nam, Wonwoo Chromium(v)-oxo and chromium(iii)-superoxo complexes bearing a macrocyclic TMC ligand in hydrogen atom abstraction reactions Chemical Science 2(10) (2011) 2057
Space group: P n m a
Cell volume: 2284.96
Cell parameters: 14.215; 9.7664; 16.4588; 90; 90; 90;  

COD ID: 1515492
CIF file Formula: - C158 H162 Cl6 N10 O6 Zn2 -
Comments: Langton, Matthew J.; Matichak, Jonathan D.; Thompson, Amber L.; Anderson, Harry L. Template-directed synthesis of π-conjugated porphyrin [2]rotaxanes and a [4]catenane based on a six-porphyrin nanoring Chemical Science 2(10) (2011) 1897
Space group: P -1
Cell volume: 7923.7
Cell parameters: 19.7916; 20.7295; 22.2512; 90.5711; 99.966; 117.623;  

COD ID: 1515494
CIF file Formula: - C26 H24 Cl2 N2 O5 -
Comments: Ding, Miao; Zhou, Feng; Liu, Yun-Lin; Wang, Cui-Hong; Zhao, Xiao-Li; Zhou, Jian Cinchona alkaloid-based phosphoramide catalyzed highly enantioselective Michael addition of unprotected 3-substituted oxindoles to nitroolefins Chemical Science 2(10) (2011) 2035
Space group: P -1
Cell volume: 2521.48
Cell parameters: 12.5561; 12.803; 16.3869; 83.594; 83.917; 75.088;  

COD ID: 1515495
CIF file Formula: - C38 H56 Lu2 N2 -
Comments: Mueller, Thomas J.; Fieser, Megan E.; Ziller, Joseph W.; Evans, William J. (C5Me4H)1−-based reduction of dinitrogen by the mixed ligand tris(polyalkylcyclopentadienyl) lutetium and yttrium complexes, (C5Me5)3−x(C5Me4H)xLn Chemical Science 2(10) (2011) 1992
Space group: P n a 21
Cell volume: 3475
Cell parameters: 21.9504; 8.4448; 18.7468; 90; 90; 90;  

COD ID: 1515496
CIF file Formula: - C40 H60 N2 Y2 -
Comments: Mueller, Thomas J.; Fieser, Megan E.; Ziller, Joseph W.; Evans, William J. (C5Me4H)1−-based reduction of dinitrogen by the mixed ligand tris(polyalkylcyclopentadienyl) lutetium and yttrium complexes, (C5Me5)3−x(C5Me4H)xLn Chemical Science 2(10) (2011) 1992
Space group: P -1
Cell volume: 1873.4
Cell parameters: 10.6716; 10.9978; 16.7386; 77.9317; 77.8776; 83.5536;  

COD ID: 1515497
CIF file Formula: - C34 H28 S4 -
Comments: Mitamura, Yukihiro; Yorimitsu, Hideki; Oshima, Koichiro; Osuka, Atsuhiro Straightforward access to aryl-substituted tetrathiafulvalenes by palladium-catalysed direct C–H arylation and their photophysical and electrochemical properties Chemical Science 2(10) (2011) 2017
Space group: P -1
Cell volume: 1423.5
Cell parameters: 9.217; 11.524; 15.597; 100.75; 105.128; 110.659;  

COD ID: 1515498
CIF file Formula: - C21 H31 I2 N O4 S -
Comments: Sampath, Magesh; Lee, Pei-Ying Beatrix; Loh, Teck-Peng Phosphine-catalyzed one-pot isomerization of 3-alkynoates and [2 + 3]-cycloaddition with imines: formal synthesis of Securinega alkaloid (±)-allosecurinine Chemical Science 2(10) (2011) 1988
Space group: C 1 2/c 1
Cell volume: 4846.8
Cell parameters: 29.1152; 11.5743; 15.8437; 90; 114.799; 90;  

COD ID: 1515499
CIF file Formula: - C25 H18 Br N O2 -
Comments: Li, Bi-Jie; Shi, Zhang-Jie Ir-catalyzed highly selective addition of pyridyl C–H bonds to aldehydes promoted by triethylsilane Chemical Science 2(3) (2011) 488
Space group: P 1 21/c 1
Cell volume: 1962.1
Cell parameters: 6.1156; 21.353; 15.092; 90; 95.378; 90;  

COD ID: 1515500
CIF file Formula: - C17 H16 Br N O2 -
Comments: Khan, Hasan A.; Kou, Kevin G. M.; Dong, Vy M. Nitrogen-directed ketone hydroacylation: Enantioselective synthesis of benzoxazecinones Chemical Science 2(3) (2011) 407
Space group: P 21 21 21
Cell volume: 1492.37
Cell parameters: 7.298; 12.069; 16.9434; 90; 90; 90;  

COD ID: 1515501
CIF file Formula: - C36 H41 B F4 N2 O3 -
Comments: Guin, Joyram; Besnard, Céline; Pattison, Philip; Lacour, Jérôme Highly selective additions of hydride and organolithium nucleophiles to helical carbenium ions Chemical Science 2(3) (2011) 425
Space group: P 1 21/n 1
Cell volume: 3244
Cell parameters: 10.639; 14.831; 20.681; 90; 96.24; 90;  

COD ID: 1515502
CIF file Formula: - C41 H36 F6 N2 O2 -
Comments: Guin, Joyram; Besnard, Céline; Pattison, Philip; Lacour, Jérôme Highly selective additions of hydride and organolithium nucleophiles to helical carbenium ions Chemical Science 2(3) (2011) 425
Space group: P -1
Cell volume: 1695.8
Cell parameters: 8.641; 12.453; 16.039; 91.073; 92.167; 100.384;  

COD ID: 1515503
CIF file Formula: - C82 H74 Cl6 F48 N16 P8 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P -1
Cell volume: 3026
Cell parameters: 10.061; 10.107; 30.25; 94.45; 97.31; 95.24;  

COD ID: 1515504
CIF file Formula: - C44 H42 F24 N10 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P -1
Cell volume: 1278.13
Cell parameters: 9.8471; 11.4921; 12.2245; 68.0681; 89.3833; 85.0539;  

COD ID: 1515505
CIF file Formula: - C46 H48 F24 N8 O2 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: C 1 2/c 1
Cell volume: 5836.11
Cell parameters: 23.7695; 11.2232; 24.0588; 90; 114.59; 90;  

COD ID: 1515506
CIF file Formula: - C40 H48 F24 N8 O6 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P 1 21/n 1
Cell volume: 2758.01
Cell parameters: 8.2914; 19.8515; 16.9016; 90; 97.5218; 90;  

COD ID: 1515507
CIF file Formula: - C52 H60 F24 N8 O4 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P 1 21/c 1
Cell volume: 3182.99
Cell parameters: 9.5897; 10.4314; 32.0723; 90; 97.2039; 90;  

COD ID: 1515508
CIF file Formula: - C46 H54 F24 N10 O4 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P 1 21/c 1
Cell volume: 5705.66
Cell parameters: 16.7324; 20.1029; 17.8841; 90; 108.474; 90;  

COD ID: 1515509
CIF file Formula: - C66 H64 F24 N10 O4 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: C 1 c 1
Cell volume: 6830.59
Cell parameters: 17.5254; 12.7345; 30.6082; 90; 90.6673; 90;  

COD ID: 1515510
CIF file Formula: - C56.15 H47.03 Co1.58 F24 N8 O7.09 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: I b a m
Cell volume: 8887.1
Cell parameters: 22.9688; 18.0778; 21.4031; 90; 90; 90;  

COD ID: 1515511
CIF file Formula: - C44.4 H54.28 Cl4 N9.47 O5.47 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P c m b
Cell volume: 4928.71
Cell parameters: 10.192; 20.0159; 24.1601; 90; 90; 90;  

COD ID: 1515512
CIF file Formula: - C46 H52.71 N20.71 O4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P 1 21/n 1
Cell volume: 2339.91
Cell parameters: 8.0143; 22.0345; 13.2696; 90; 93.0774; 90;  

COD ID: 1515513
CIF file Formula: - C136 H157 N16 O38.5 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P -1
Cell volume: 3235.03
Cell parameters: 9.1698; 16.1629; 23.2751; 101.433; 93.1531; 105.604;  

COD ID: 1515514
CIF file Formula: - C46 H50 Au Cl4 F6 N10 O2 P -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: C 1 2/c 1
Cell volume: 5056.87
Cell parameters: 34.1635; 12.097; 12.7837; 90; 106.831; 90;  

COD ID: 1515515
CIF file Formula: - C28 H12 Co4 O14 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P 1 21/c 1
Cell volume: 1488.57
Cell parameters: 12.9114; 10.3713; 12.8078; 90; 119.78; 90;  

COD ID: 1515516
CIF file Formula: - C28 H12 Co4 O14 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: P 1 21/n 1
Cell volume: 1471.3
Cell parameters: 9.6916; 13.8803; 10.966; 90; 94.153; 90;  

COD ID: 1515517
CIF file Formula: - C47 H49 Cl10.667 Fe4 N9 O4 -
Comments: Glasson, Christopher R. K.; Clegg, Jack K.; McMurtrie, John C.; Meehan, George V.; Lindoy, Leonard F.; Motti, Cherie A.; Moubaraki, Boujemaa; Murray, Keith S.; Cashion, John D. Unprecedented encapsulation of a [FeIIICl4]− anion in a cationic [FeII4L6]8+ tetrahedral cage derived from 5,5′′′-dimethyl-2,2′:5′,5′′:2′′,2′′′-quaterpyridine Chemical Science 2(3) (2011) 540
Space group: F 2 3
Cell volume: 26116.1
Cell parameters: 29.669; 29.669; 29.669; 90; 90; 90;  

COD ID: 1515518
CIF file Formula: - C132 H132 Cl4 F36 Fe5 N24 O12 P6 -
Comments: Glasson, Christopher R. K.; Clegg, Jack K.; McMurtrie, John C.; Meehan, George V.; Lindoy, Leonard F.; Motti, Cherie A.; Moubaraki, Boujemaa; Murray, Keith S.; Cashion, John D. Unprecedented encapsulation of a [FeIIICl4]− anion in a cationic [FeII4L6]8+ tetrahedral cage derived from 5,5′′′-dimethyl-2,2′:5′,5′′:2′′,2′′′-quaterpyridine Chemical Science 2(3) (2011) 540
Space group: P -4 3 n
Cell volume: 10352.5
Cell parameters: 21.7946; 21.7946; 21.7946; 90; 90; 90;  

COD ID: 1515519
CIF file Formula: - C104 H70 -
Comments: Xia, Hai; Liu, Danqing; Song, Kesheng; Miao, Qian Vapochromic and semiconducting solids of a bifunctional hydrocarbon Chemical Science 2(12) (2011) 2402
Space group: R -3 :H
Cell volume: 5569.7
Cell parameters: 22.054; 22.054; 13.223; 90; 90; 120;  

COD ID: 1515520
CIF file Formula: - C32 H20 -
Comments: Xia, Hai; Liu, Danqing; Song, Kesheng; Miao, Qian Vapochromic and semiconducting solids of a bifunctional hydrocarbon Chemical Science 2(12) (2011) 2402
Space group: P n m a
Cell volume: 2136.7
Cell parameters: 8.0144; 20.9765; 12.7099; 90; 90; 90;  

COD ID: 1515521
CIF file Formula: - C29 H41 Au N2 O2 -
Comments: Johnson, Magnus T.; Marthinus Janse van Rensburg, J.; Axelsson, Martin; Ahlquist, Mårten S. G.; Wendt, Ola F. Reactivity of NHC Au(i)‒C σ-bonds with electrophiles. An investigation of their possible involvement in catalytic C‒C bond formation Chemical Science 2(12) (2011) 2373
Space group: P 1 21/n 1
Cell volume: 3215.8
Cell parameters: 13.323; 13.5457; 18.023; 90; 98.623; 90;  

COD ID: 1515522
CIF file Formula: - C27 H29 Au N2 -
Comments: Johnson, Magnus T.; Marthinus Janse van Rensburg, J.; Axelsson, Martin; Ahlquist, Mårten S. G.; Wendt, Ola F. Reactivity of NHC Au(i)‒C σ-bonds with electrophiles. An investigation of their possible involvement in catalytic C‒C bond formation Chemical Science 2(12) (2011) 2373
Space group: P -1
Cell volume: 2445.2
Cell parameters: 9.9439; 15.6363; 16.4516; 79.47; 83.978; 77.02;  

COD ID: 1515523
CIF file Formula: - C22 H27 Au N2 -
Comments: Johnson, Magnus T.; Marthinus Janse van Rensburg, J.; Axelsson, Martin; Ahlquist, Mårten S. G.; Wendt, Ola F. Reactivity of NHC Au(i)‒C σ-bonds with electrophiles. An investigation of their possible involvement in catalytic C‒C bond formation Chemical Science 2(12) (2011) 2373
Space group: P 1 21/c 1
Cell volume: 2141.9
Cell parameters: 8.327; 29.402; 8.849; 90; 98.648; 90;  

COD ID: 1515524
CIF file Formula: - C27 H30 Au I N2 -
Comments: Johnson, Magnus T.; Marthinus Janse van Rensburg, J.; Axelsson, Martin; Ahlquist, Mårten S. G.; Wendt, Ola F. Reactivity of NHC Au(i)‒C σ-bonds with electrophiles. An investigation of their possible involvement in catalytic C‒C bond formation Chemical Science 2(12) (2011) 2373
Space group: P 1 21/c 1
Cell volume: 2528.7
Cell parameters: 9.1235; 7.999; 34.742; 90; 94.181; 90;  

COD ID: 1515525
CIF file Formula: - C29 H32 Au O2 P -
Comments: Simonneau, Antoine; Jaroschik, Florian; Lesage, Denis; Karanik, Magdalena; Guillot, Régis; Malacria, Max; Tabet, Jean-Claude; Goddard, Jean-Philippe; Fensterbank, Louis; Gandon, Vincent; Gimbert, Yves Tracking gold acetylides in gold(i)-catalyzed cycloisomerization reactions of enynes Chemical Science 2(12) (2011) 2417
Space group: P 1 21/c 1
Cell volume: 2623.9
Cell parameters: 16.9075; 9.8602; 17.2281; 90; 113.997; 90;  

COD ID: 1515526
CIF file Formula: - C17 H18 N2 O2 S -
Comments: Lu, Hongjian; Jiang, Huiling; Hu, Yang; Wojtas, Lukasz; Zhang, X. Peter Chemoselective intramolecular allylic C–H amination versus CC aziridination through Co(ii)-based metalloradical catalysis Chemical Science 2(12) (2011) 2361
Space group: C 1 2/c 1
Cell volume: 2987
Cell parameters: 34.0823; 5.4014; 16.6312; 90; 102.68; 90;  

COD ID: 1515527
CIF file Formula: - C16 H22 N2 O2 S -
Comments: Lu, Hongjian; Jiang, Huiling; Hu, Yang; Wojtas, Lukasz; Zhang, X. Peter Chemoselective intramolecular allylic C–H amination versus CC aziridination through Co(ii)-based metalloradical catalysis Chemical Science 2(12) (2011) 2361
Space group: P b c a
Cell volume: 3211.94
Cell parameters: 12.3076; 9.776; 26.6952; 90; 90; 90;  

COD ID: 1515528
CIF file Formula: - C8 H14 N2 O2 S -
Comments: Lu, Hongjian; Jiang, Huiling; Hu, Yang; Wojtas, Lukasz; Zhang, X. Peter Chemoselective intramolecular allylic C–H amination versus CC aziridination through Co(ii)-based metalloradical catalysis Chemical Science 2(12) (2011) 2361
Space group: P 21 21 21
Cell volume: 986.32
Cell parameters: 5.2071; 12.8881; 14.6972; 90; 90; 90;  

COD ID: 1515529
CIF file Formula: - C16 H22 N2 O2 S -
Comments: Lu, Hongjian; Jiang, Huiling; Hu, Yang; Wojtas, Lukasz; Zhang, X. Peter Chemoselective intramolecular allylic C–H amination versus CC aziridination through Co(ii)-based metalloradical catalysis Chemical Science 2(12) (2011) 2361
Space group: P 1 21/c 1
Cell volume: 1522.07
Cell parameters: 14.5628; 6.4095; 16.6818; 90; 102.174; 90;  

COD ID: 1515530
CIF file Formula: - C30 H41 N O3 S Si -
Comments: Saxena, Aakarsh; Lam, Hon Wai Enantioselective rhodium-catalyzed arylation of electron-deficient alkenylarenes Chemical Science 2(12) (2011) 2326
Space group: P 21 21 21
Cell volume: 2850.7
Cell parameters: 6.0485; 16.8765; 27.927; 90; 90; 90;  

COD ID: 1515531
CIF file Formula: - C63 H55 N2 O17.5 -
Comments: Adriaenssens, Louis; Severa, Lukáš; Koval, Dušan; Císařová, Ivana; Belmonte, Marta Martínez; Escudero-Adán, Eduardo C.; Novotná, Pavlína; Sázelová, Petra; Vávra, Jan; Pohl, Radek; Šaman, David; Urbanová, Marie; Kašička, Václav; Teplý, Filip [6]Saddlequat: a [6]helquat captured on its racemization pathway Chemical Science 2(12) (2011) 2314
Space group: C 1 2 1
Cell volume: 5403
Cell parameters: 24.233; 11.685; 20.507; 90; 111.491; 90;  

COD ID: 1515532
CIF file Formula: - C27 H28 Cl2 N2 O9 -
Comments: Adriaenssens, Louis; Severa, Lukáš; Koval, Dušan; Císařová, Ivana; Belmonte, Marta Martínez; Escudero-Adán, Eduardo C.; Novotná, Pavlína; Sázelová, Petra; Vávra, Jan; Pohl, Radek; Šaman, David; Urbanová, Marie; Kašička, Václav; Teplý, Filip [6]Saddlequat: a [6]helquat captured on its racemization pathway Chemical Science 2(12) (2011) 2314
Space group: P 21 21 21
Cell volume: 2566.07
Cell parameters: 11.0841; 13.3658; 17.321; 90; 90; 90;  

COD ID: 1515533
CIF file Formula: - C27 H26 F12 N2 P2 -
Comments: Adriaenssens, Louis; Severa, Lukáš; Koval, Dušan; Císařová, Ivana; Belmonte, Marta Martínez; Escudero-Adán, Eduardo C.; Novotná, Pavlína; Sázelová, Petra; Vávra, Jan; Pohl, Radek; Šaman, David; Urbanová, Marie; Kašička, Václav; Teplý, Filip [6]Saddlequat: a [6]helquat captured on its racemization pathway Chemical Science 2(12) (2011) 2314
Space group: P -1
Cell volume: 4520.9
Cell parameters: 13.8836; 17.9623; 18.7911; 75.44; 88.26; 85.425;  

COD ID: 1515534
CIF file Formula: - C29 H26 F6 N2 O6 S2 -
Comments: Adriaenssens, Louis; Severa, Lukáš; Koval, Dušan; Císařová, Ivana; Belmonte, Marta Martínez; Escudero-Adán, Eduardo C.; Novotná, Pavlína; Sázelová, Petra; Vávra, Jan; Pohl, Radek; Šaman, David; Urbanová, Marie; Kašička, Václav; Teplý, Filip [6]Saddlequat: a [6]helquat captured on its racemization pathway Chemical Science 2(12) (2011) 2314
Space group: P 1 21/c 1
Cell volume: 2922.9
Cell parameters: 9.074; 16.546; 20.709; 90; 109.934; 90;  

COD ID: 1515538
CIF file Formula: - C74 H76 F15 N8 O22 P Pd S3 -
Comments: Blanco, Victor; García, Marcos D.; Peinador, Carlos; Quintela, José M. Self-assembly of new fluorescent Pd(ii) and Pt(ii) 2,7-diazapyrenium-based metallocycles and study of their inclusion complexes and [3]catenanes Chemical Science 2(12) (2011) 2407
Space group: P -1
Cell volume: 4221
Cell parameters: 12.518; 18.378; 20.119; 97.003; 102.035; 107.893;  

COD ID: 1515539
CIF file Formula: - C122 H144 F18 N14 O46 Pd2 S6 -
Comments: Blanco, Victor; García, Marcos D.; Peinador, Carlos; Quintela, José M. Self-assembly of new fluorescent Pd(ii) and Pt(ii) 2,7-diazapyrenium-based metallocycles and study of their inclusion complexes and [3]catenanes Chemical Science 2(12) (2011) 2407
Space group: P 1 21/c 1
Cell volume: 6897
Cell parameters: 12.0255; 20.4941; 28.0429; 90; 93.676; 90;  

COD ID: 1515540
CIF file Formula: - C31 H21 F12 N5 P2 -
Comments: Blanco, Victor; García, Marcos D.; Peinador, Carlos; Quintela, José M. Self-assembly of new fluorescent Pd(ii) and Pt(ii) 2,7-diazapyrenium-based metallocycles and study of their inclusion complexes and [3]catenanes Chemical Science 2(12) (2011) 2407
Space group: P -1
Cell volume: 2902
Cell parameters: 13.067; 14.272; 17.273; 67.392; 77.696; 87.835;  

COD ID: 1515541
CIF file Formula: - Fe15.631 K8.622 Se20 -
Comments: Bacsa, J.; Ganin, A. Y.; Takabayashi, Y.; Christensen, K. E.; Prassides, K.; Rosseinsky, M. J.; Claridge, J. B. Cation vacancy order in the K0.8+xFe1.6−ySe2 system: Five-fold cell expansion accommodates 20% tetrahedral vacancies Chemical Science 2(6) (2011) 1054
Space group: I 4/m
Cell volume: 1066.49
Cell parameters: 8.7653; 8.7653; 13.8811; 90; 90; 90;  

COD ID: 1515542
CIF file Formula: - Fe15.29 K9.223 Se20 -
Comments: Bacsa, J.; Ganin, A. Y.; Takabayashi, Y.; Christensen, K. E.; Prassides, K.; Rosseinsky, M. J.; Claridge, J. B. Cation vacancy order in the K0.8+xFe1.6−ySe2 system: Five-fold cell expansion accommodates 20% tetrahedral vacancies Chemical Science 2(6) (2011) 1054
Space group: I 4/m
Cell volume: 1068.18
Cell parameters: 8.7788; 8.7788; 13.8604; 90; 90; 90;  

COD ID: 1515543
CIF file Formula: - C48 H64 O8 -
Comments: Hau, Chun-Kit; Chui, Stephen Sin-Yin; Lu, Wei; Che, Chi-Ming; Cheng, Ping-Shing; Mak, Thomas C. W.; Miao, Qian; Wong, Henry N. C. Thermotropic liquid crystals based on 1,8,9,16-tetrasubstituted tetraphenylenes and their structure–property relationship studies Chemical Science 2(6) (2011) 1068
Space group: P -1
Cell volume: 2217.5
Cell parameters: 12.6286; 13.2786; 14.6898; 85.812; 77.077; 67.47;  

COD ID: 1515544
CIF file Formula: - C48 H110 Cu5 Gd4 N8 O38 -
Comments: Langley, Stuart K.; Chilton, Nicholas F.; Moubaraki, Boujemaa; Hooper, Thomas; Brechin, Euan K.; Evangelisti, Marco; Murray, Keith S. Molecular coolers: The case for [CuII5GdIII4] Chemical Science 2(6) (2011) 1166
Space group: P -1
Cell volume: 1965.4
Cell parameters: 11.05; 13.83; 14.03; 78.8; 83.81; 69.28;  

COD ID: 1515545
CIF file Formula: - C41 H42 N2 O4 -
Comments: Li, Jie; Chen, Gang; Wang, Zheng; Zhang, Ruzhou; Zhang, Xumu; Ding, Kuiling Spiro-2,2′-bichroman-based bisoxazoline (SPANbox) ligands for ZnII-catalyzed enantioselective hydroxylation of β-keto esters and 1,3-diester Chemical Science 2(6) (2011) 1141
Space group: P 1 21 1
Cell volume: 1746.4
Cell parameters: 11.0978; 10.0421; 15.8898; 90; 99.529; 90;  

COD ID: 1515546
CIF file Formula: - C12 H18 Br N O2 S -
Comments: Chuang, Kangway V.; Navarro, Raul; Reisman, Sarah E. Benzoquinone-derived sulfinyl imines as versatile intermediates for alkaloid synthesis: Total synthesis of (–)-3-demethoxyerythratidinone Chemical Science 2(6) (2011) 1086
Space group: P 1 21 1
Cell volume: 2215.94
Cell parameters: 9.9624; 17.8137; 12.6175; 90; 98.264; 90;  

COD ID: 1515547
CIF file Formula: - C27 H26 Cl2 Cr Fe Mn N4 O14 -
Comments: Clemente-León, Miguel; Coronado, Eugenio; López-Jordà, Maurici; Desplanches, Cédric; Asthana, Saket; Wang, Hongfeng; Létard, Jean-François A hybrid magnet with coexistence of ferromagnetism and photoinduced Fe(iii) spin-crossover Chemical Science 2(6) (2011) 1121
Space group: P 1 21/c 1
Cell volume: 3279.77
Cell parameters: 11.5561; 31.6369; 9.5457; 90; 109.984; 90;  

COD ID: 1515548
CIF file Formula: - C27 H26 Cl2 Cr Fe Mn N4 O14 -
Comments: Clemente-León, Miguel; Coronado, Eugenio; López-Jordà, Maurici; Desplanches, Cédric; Asthana, Saket; Wang, Hongfeng; Létard, Jean-François A hybrid magnet with coexistence of ferromagnetism and photoinduced Fe(iii) spin-crossover Chemical Science 2(6) (2011) 1121
Space group: P 1 21/c 1
Cell volume: 3412
Cell parameters: 12.096; 32.135; 9.467; 90; 111.981; 90;  

COD ID: 1515549
CIF file Formula: - C27 H26 Cl2 Cr Fe Mn N4 O14 -
Comments: Clemente-León, Miguel; Coronado, Eugenio; López-Jordà, Maurici; Desplanches, Cédric; Asthana, Saket; Wang, Hongfeng; Létard, Jean-François A hybrid magnet with coexistence of ferromagnetism and photoinduced Fe(iii) spin-crossover Chemical Science 2(6) (2011) 1121
Space group: P 1 21/c 1
Cell volume: 3356
Cell parameters: 11.9215; 31.91; 9.4841; 90; 111.535; 90;  

COD ID: 1515550
CIF file Formula: - C27 H26 Cl2 Cr Fe Mn N4 O14 -
Comments: Clemente-León, Miguel; Coronado, Eugenio; López-Jordà, Maurici; Desplanches, Cédric; Asthana, Saket; Wang, Hongfeng; Létard, Jean-François A hybrid magnet with coexistence of ferromagnetism and photoinduced Fe(iii) spin-crossover Chemical Science 2(6) (2011) 1121
Space group: P 1 21/c 1
Cell volume: 3267.8
Cell parameters: 11.5602; 31.6268; 9.5237; 90; 110.199; 90;  

COD ID: 1515552
CIF file Formula: - C32 H28 Cu2 O14 -
Comments: Jeong, Kyung Seok; Go, Yong Bok; Shin, Sung Min; Lee, Suk Joong; Kim, Jaheon; Yaghi, Omar M.; Jeong, Nakcheol Asymmetric catalytic reactions by NbO-type chiral metal‒organic frameworks Chemical Science 2(5) (2011) 877
Space group: I 4 3 2
Cell volume: 27514.1
Cell parameters: 30.1892; 30.1892; 30.1892; 90; 90; 90;  

COD ID: 1515553
CIF file Formula: - C54 H76 N6 P -
Comments: Back, Olivier; Donnadieu, Bruno; von Hopffgarten, Moritz; Klein, Susanne; Tonner, Ralf; Frenking, Gernot; Bertrand, Guy N-Heterocyclic carbenes versus transition metals for stabilizing phosphinyl radicals Chemical Science 2(5) (2011) 858
Space group: C 1 2/c 1
Cell volume: 30321
Cell parameters: 63.385; 12.6019; 38.409; 90; 98.769; 90;  

COD ID: 1515554
CIF file Formula: - C66 H98 N7 P V -
Comments: Back, Olivier; Donnadieu, Bruno; von Hopffgarten, Moritz; Klein, Susanne; Tonner, Ralf; Frenking, Gernot; Bertrand, Guy N-Heterocyclic carbenes versus transition metals for stabilizing phosphinyl radicals Chemical Science 2(5) (2011) 858
Space group: P 1 21/n 1
Cell volume: 6477
Cell parameters: 11.516; 22.439; 25.37; 90; 98.889; 90;  

COD ID: 1515555
CIF file Formula: - C70 H73 N5 O12 -
Comments: Leontiev, Alexandre V.; Serpell, Christopher J.; White, Nicholas G.; Beer, Paul D. Cation-induced molecular motion of spring-like [2]catenanes Chemical Science 2(5) (2011) 922
Space group: P -1
Cell volume: 3140.1
Cell parameters: 11.5815; 11.8231; 25.3961; 80.0523; 87.1768; 66.4893;  

COD ID: 1515556
CIF file Formula: - C96 H102 Cl N5 O20 -
Comments: Leontiev, Alexandre V.; Serpell, Christopher J.; White, Nicholas G.; Beer, Paul D. Cation-induced molecular motion of spring-like [2]catenanes Chemical Science 2(5) (2011) 922
Space group: P 1
Cell volume: 4461
Cell parameters: 11.009; 17.213; 25.06; 73.3; 82.6; 79.77;  

COD ID: 1515557
CIF file Formula: - C102 H110 Cl N5 O22 -
Comments: Leontiev, Alexandre V.; Serpell, Christopher J.; White, Nicholas G.; Beer, Paul D. Cation-induced molecular motion of spring-like [2]catenanes Chemical Science 2(5) (2011) 922
Space group: P 1 21/c 1
Cell volume: 9375.2
Cell parameters: 12.2168; 24.953; 31.028; 90; 97.622; 90;  

COD ID: 1515558
CIF file Formula: - C95 H118 Au N3 Nb O5.5 P S -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: P 1 21/c 1
Cell volume: 8483
Cell parameters: 26.964; 14.146; 24.947; 90; 116.938; 90;  

COD ID: 1515559
CIF file Formula: - C96 H115 Au N4 Nb O5.5 P -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: P 1 21/c 1
Cell volume: 8447.9
Cell parameters: 27.017; 14.1228; 24.657; 90; 116.11; 90;  

COD ID: 1515560
CIF file Formula: - C96 H115 Ag N4 Nb O5.5 P -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: P 1 21/c 1
Cell volume: 8462.3
Cell parameters: 27.086; 14.0697; 24.79; 90; 116.396; 90;  

COD ID: 1515561
CIF file Formula: - C92.5 H122 N3 Nb O5 P Rh -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: P 1 21/n 1
Cell volume: 8007.8
Cell parameters: 23.3525; 15.0941; 25.0969; 90; 115.147; 90;  

COD ID: 1515562
CIF file Formula: - C96 H115 Cu N4 Nb O5.5 P -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: P 1 21/c 1
Cell volume: 8462.7
Cell parameters: 27.065; 14.0252; 24.972; 90; 116.777; 90;  

COD ID: 1515563
CIF file Formula: - C105 H138 N3 Na Nb O9 P -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: R -3 :H
Cell volume: 14142
Cell parameters: 17.736; 17.736; 51.913; 90; 90; 120;  

COD ID: 1515564
CIF file Formula: - C74.75 H97 N3 Na Nb O3 P -
Comments: Creutz, Sidney E.; Krummenacher, Ivo; Clough, Christopher R.; Cummins, Christopher C. A trigonal and hindered tertiary phosphine ligand rendered anionic by a niobate anchor: Formation of zwitterionic M(i) (M = Cu, Ag, Au, Rh) complexes Chemical Science 2(11) (2011) 2166
Space group: P 1 21/c 1
Cell volume: 7118.5
Cell parameters: 23.715; 16.1639; 19.4189; 90; 107.002; 90;  

COD ID: 1515565
CIF file Formula: - C34 H61 Fe2 -
Comments: Walter, Marc D.; Grunenberg, Jörg; White, Peter S. Reactivity studies on [Cp′FeI]2: From iron hydrides to P4-activation Chemical Science 2(11) (2011) 2120
Space group: P -1
Cell volume: 1631.16
Cell parameters: 10.2629; 12.4476; 14.5233; 112.514; 91.655; 105.741;  

COD ID: 1515566
CIF file Formula: - C34 H62 Fe2 -
Comments: Walter, Marc D.; Grunenberg, Jörg; White, Peter S. Reactivity studies on [Cp′FeI]2: From iron hydrides to P4-activation Chemical Science 2(11) (2011) 2120
Space group: P 41 21 2
Cell volume: 3287.21
Cell parameters: 9.0398; 9.0398; 40.2263; 90; 90; 90;  

COD ID: 1515567
CIF file Formula: - C34 H58 Fe2 P4 -
Comments: Walter, Marc D.; Grunenberg, Jörg; White, Peter S. Reactivity studies on [Cp′FeI]2: From iron hydrides to P4-activation Chemical Science 2(11) (2011) 2120
Space group: P 21 21 21
Cell volume: 3623.73
Cell parameters: 13.3878; 13.7768; 19.6471; 90; 90; 90;  

COD ID: 1515568
CIF file Formula: - C16 H12 N2 -
Comments: Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science 2(11) (2011) 2178
Space group: C 1 2/c 1
Cell volume: 4549.2
Cell parameters: 54.319; 4.7958; 18.476; 90; 109.058; 90;  

COD ID: 1515569
CIF file Formula: - C22 H16 N2 -
Comments: Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science 2(11) (2011) 2178
Space group: P 1 21/c 1
Cell volume: 1528
Cell parameters: 14.9876; 5.6399; 18.1283; 90; 94.317; 90;  

COD ID: 1515570
CIF file Formula: - C15 H10 Br2 N2 -
Comments: Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science 2(11) (2011) 2178
Space group: P b c a
Cell volume: 2667.7
Cell parameters: 18.7505; 7.0987; 20.0419; 90; 90; 90;  

COD ID: 1515571
CIF file Formula: - C16 H12 Br2 N2 -
Comments: Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science 2(11) (2011) 2178
Space group: C 1 c 1
Cell volume: 1423.6
Cell parameters: 11.3993; 20.292; 6.8679; 90; 116.348; 90;  

COD ID: 1515572
CIF file Formula: - C16 H11 Br N2 -
Comments: Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science 2(11) (2011) 2178
Space group: P 21 21 21
Cell volume: 1240.05
Cell parameters: 4.7179; 13.9491; 18.8428; 90; 90; 90;  

COD ID: 1515573
CIF file Formula: - C19 H16 N2 O3 -
Comments: Tang, Bo-Xiao; Song, Ren-Jie; Wu, Cui-Yan; Wang, Zhi-Qiang; Liu, Yu; Huang, Xiao-Cheng; Xie, Ye-Xiang; Li, Jin-Heng Ruthenium-catalyzed intramolecular carbocyclization of alkynes with an sp3 carbon involving an oxidative deprotonation process Chemical Science 2(11) (2011) 2131
Space group: P 1 21/c 1
Cell volume: 1625.8
Cell parameters: 10.4908; 17.614; 9.1784; 90; 106.541; 90;  

COD ID: 1515574
CIF file Formula: - C17 H26 O5 -
Comments: Robbins, Diane; Newton, Annabella F.; Gignoux, Camille; Legeay, Jean-Christophe; Sinclair, Alex; Rejzek, Martin; Laxon, Carly A.; Yalamanchili, Sai K.; Lewis, William; O'Connell, Maria A.; Stockman, Robert A. Synthesis of natural-product-like scaffolds in unprecedented efficiency via a 12-fold branching pathway Chemical Science 2(11) (2011) 2232
Space group: P 1 21/c 1
Cell volume: 1648.1
Cell parameters: 12.942; 5.7874; 22.755; 90; 104.764; 90;  

COD ID: 1515575
CIF file Formula: - C156 H84 N48 O68 Zn7 -
Comments: Qi, Xiao-Lin; Lin, Rui-Biao; Chen, Qing; Lin, Jian-Bin; Zhang, Jie-Peng; Chen, Xiao-Ming A flexible metal azolate framework with drastic luminescence response toward solvent vapors and carbon dioxide Chemical Science 2(11) (2011) 2214
Space group: I -4 3 d
Cell volume: 20058
Cell parameters: 27.1704; 27.1704; 27.1704; 90; 90; 90;  

COD ID: 1515578
CIF file Formula: - C62 H46 Cl4 Fe2 N13 O17.5 -
Comments: Liu, Peng; Liu, Yungen; Wong, Ella Lai-Ming; Xiang, Song; Che, Chi-Ming Iron oligopyridine complexes as efficient catalysts for practical oxidation of arenes, alkanes, tertiary amines and N-acyl cyclic amines with Oxone Chemical Science 2(11) (2011) 2187
Space group: I 41/a c d :2
Cell volume: 26108
Cell parameters: 24.217; 24.217; 44.518; 90; 90; 90;  

COD ID: 1515579
CIF file Formula: - C77 H53.25 Cl4 Fe2 N17.5 O18 -
Comments: Liu, Peng; Liu, Yungen; Wong, Ella Lai-Ming; Xiang, Song; Che, Chi-Ming Iron oligopyridine complexes as efficient catalysts for practical oxidation of arenes, alkanes, tertiary amines and N-acyl cyclic amines with Oxone Chemical Science 2(11) (2011) 2187
Space group: P 1 21/c 1
Cell volume: 15663
Cell parameters: 28.005; 23.913; 25.973; 90; 115.78; 90;  

COD ID: 1515580
CIF file Formula: - C50 H42 Cl4 Fe2 N10 O21 -
Comments: Liu, Peng; Liu, Yungen; Wong, Ella Lai-Ming; Xiang, Song; Che, Chi-Ming Iron oligopyridine complexes as efficient catalysts for practical oxidation of arenes, alkanes, tertiary amines and N-acyl cyclic amines with Oxone Chemical Science 2(11) (2011) 2187
Space group: P 1 21/n 1
Cell volume: 5499
Cell parameters: 19.005; 14.428; 20.463; 90; 101.45; 90;  

COD ID: 1515581
CIF file Formula: - C9 H8 O4 -
Comments: Varughese, Sunil; Kiran, M. S. R. N.; Solanko, Katarzyna A.; Bond, Andrew D.; Ramamurty, U.; Desiraju, Gautam R. Interaction anisotropy and shear instability of aspirin polymorphs established by nanoindentation Chemical Science 2(11) (2011) 2236
Space group: P 1 21/c 1
Cell volume: 825.44
Cell parameters: 12.1016; 6.4721; 11.3344; 90; 111.593; 90;  

COD ID: 1515582
CIF file Formula: - C9 H8 O4 -
Comments: Varughese, Sunil; Kiran, M. S. R. N.; Solanko, Katarzyna A.; Bond, Andrew D.; Ramamurty, U.; Desiraju, Gautam R. Interaction anisotropy and shear instability of aspirin polymorphs established by nanoindentation Chemical Science 2(11) (2011) 2236
Space group: P 1 21/c 1
Cell volume: 857.69
Cell parameters: 12.3578; 6.5315; 11.4964; 90; 112.436; 90;  

COD ID: 1515583
CIF file Formula: - C91 H130 B2 Cl2 Cu4 F8 N10 P4 -
Comments: Chen, Yong; Li, Jun-Li; Tong, Glenna So Ming; Lu, Wei; Fu, Wen-Fu; Lai, Siu-Wai; Che, Chi-Ming Nanostructures of tetranuclear copper(i) complexes with short Cu(i)⋯Cu(i) contacts: crystallization-induced emission enhancement Chemical Science 2(8) (2011) 1509
Space group: C 1 2/c 1
Cell volume: 10655
Cell parameters: 27.568; 15.989; 25.24; 90; 106.726; 90;  

COD ID: 1515584
CIF file Formula: - C92 H84 B2 Cl4 Cu4 F8 N10 P4 -
Comments: Chen, Yong; Li, Jun-Li; Tong, Glenna So Ming; Lu, Wei; Fu, Wen-Fu; Lai, Siu-Wai; Che, Chi-Ming Nanostructures of tetranuclear copper(i) complexes with short Cu(i)⋯Cu(i) contacts: crystallization-induced emission enhancement Chemical Science 2(8) (2011) 1509
Space group: P 1 21/n 1
Cell volume: 4620.1
Cell parameters: 12.238; 18.531; 20.929; 90; 103.246; 90;  

COD ID: 1515585
CIF file Formula: - C38 H34 B Cu F4 N5 P -
Comments: Chen, Yong; Li, Jun-Li; Tong, Glenna So Ming; Lu, Wei; Fu, Wen-Fu; Lai, Siu-Wai; Che, Chi-Ming Nanostructures of tetranuclear copper(i) complexes with short Cu(i)⋯Cu(i) contacts: crystallization-induced emission enhancement Chemical Science 2(8) (2011) 1509
Space group: P -1
Cell volume: 1749.2
Cell parameters: 8.485; 13.769; 15.231; 91.11; 100.453; 91.01;  

COD ID: 1515586
CIF file Formula: - C45 H62 Li N3 O3 Ti -
Comments: Silvia, Jared S.; Cummins, Christopher C. Binding, release, and functionalization of CO2 at a nucleophilic oxo anion complex of titanium Chemical Science 2(8) (2011) 1474
Space group: R -3 :H
Cell volume: 19407.2
Cell parameters: 30.849; 30.849; 23.5478; 90; 90; 120;  

COD ID: 1515587
CIF file Formula: - C40 H63 N3 O3 Si Ti -
Comments: Silvia, Jared S.; Cummins, Christopher C. Binding, release, and functionalization of CO2 at a nucleophilic oxo anion complex of titanium Chemical Science 2(8) (2011) 1474
Space group: P b c a
Cell volume: 8315.9
Cell parameters: 19.9166; 19.1716; 21.779; 90; 90; 90;  

COD ID: 1515588
CIF file Formula: - C40 H16 S4 -
Comments: Chiu, Chien-Yang; Kim, Bumjung; Gorodetsky, Alon A.; Sattler, Wesley; Wei, Sujun; Sattler, Aaron; Steigerwald, Michael; Nuckolls, Colin Shape-shifting in contorted dibenzotetrathienocoronenes Chemical Science 2(8) (2011) 1480
Space group: P -1
Cell volume: 612.74
Cell parameters: 3.822; 13.266; 13.858; 118.434; 93.312; 94.22;  

COD ID: 1515589
CIF file Formula: - C58.33 H50.67 S4 -
Comments: Chiu, Chien-Yang; Kim, Bumjung; Gorodetsky, Alon A.; Sattler, Wesley; Wei, Sujun; Sattler, Aaron; Steigerwald, Michael; Nuckolls, Colin Shape-shifting in contorted dibenzotetrathienocoronenes Chemical Science 2(8) (2011) 1480
Space group: P 1 21/c 1
Cell volume: 12967.8
Cell parameters: 27.556; 16.5467; 28.5253; 90; 94.415; 90;  

COD ID: 1515590
CIF file Formula: - C68 H52 N4 S4 -
Comments: Chiu, Chien-Yang; Kim, Bumjung; Gorodetsky, Alon A.; Sattler, Wesley; Wei, Sujun; Sattler, Aaron; Steigerwald, Michael; Nuckolls, Colin Shape-shifting in contorted dibenzotetrathienocoronenes Chemical Science 2(8) (2011) 1480
Space group: P 1 21/c 1
Cell volume: 5170.2
Cell parameters: 13.742; 21.483; 17.611; 90; 96.049; 90;  

COD ID: 1515591
CIF file Formula: - C310 H64 S4 -
Comments: Chiu, Chien-Yang; Kim, Bumjung; Gorodetsky, Alon A.; Sattler, Wesley; Wei, Sujun; Sattler, Aaron; Steigerwald, Michael; Nuckolls, Colin Shape-shifting in contorted dibenzotetrathienocoronenes Chemical Science 2(8) (2011) 1480
Space group: P 1 21/c 1
Cell volume: 8066
Cell parameters: 22.514; 19.373; 19.548; 90; 108.901; 90;  

COD ID: 1515592
CIF file Formula: - C132 H202 N6 O6 S U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U‒E‒U (E = S, Se) and diamond-core complexes U‒(E)2‒U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: R -3 c :H
Cell volume: 21126
Cell parameters: 17.249; 17.249; 81.989; 90; 90; 120;  

COD ID: 1515593
CIF file Formula: - C134 H192 N10 O6 S0.02 Se0.98 U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U‒E‒U (E = S, Se) and diamond-core complexes U‒(E)2‒U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: P -1
Cell volume: 3273.3
Cell parameters: 14.8605; 15.046; 17.8037; 70.931; 81.732; 60.483;  

COD ID: 1515594
CIF file Formula: - C130 H187 N2 O17 S U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U–E–U (E = S, Se) and diamond-core complexes U–(E)2–U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: P 1 21/c 1
Cell volume: 12467.5
Cell parameters: 22.837; 24.081; 25.25; 90; 116.123; 90;  

COD ID: 1515595
CIF file Formula: - C130 H187 N2 O17 Se U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U–E–U (E = S, Se) and diamond-core complexes U–(E)2–U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: P 1 21/c 1
Cell volume: 12497
Cell parameters: 22.7926; 24.1118; 25.319; 90; 116.089; 90;  

COD ID: 1515596
CIF file Formula: - C132 H192 N2 Na2 O18 S2 U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U–E–U (E = S, Se) and diamond-core complexes U–(E)2–U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: C 1 2/c 1
Cell volume: 26233
Cell parameters: 28.397; 17.161; 55.426; 90; 103.778; 90;  

COD ID: 1515597
CIF file Formula: - C132 H192 N2 Na2 O18 Se2 U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U‒E‒U (E = S, Se) and diamond-core complexes U‒(E)2‒U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: C 1 2/c 1
Cell volume: 13411
Cell parameters: 24.887; 21.404; 26.847; 90; 110.322; 90;  

COD ID: 1515598
CIF file Formula: - C134 H196 N2 Na2 O18.5 Te2 U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U‒E‒U (E = S, Se) and diamond-core complexes U‒(E)2‒U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: C 1 2/c 1
Cell volume: 13493
Cell parameters: 24.818; 21.454; 27.07; 90; 110.585; 90;  

COD ID: 1515599
CIF file Formula: - C123 H162 N3 O14 U2 -
Comments: Lam, Oanh P.; Heinemann, Frank W.; Meyer, Karsten Activation of elemental S, Se and Te with uranium(iii): bridging U‒E‒U (E = S, Se) and diamond-core complexes U‒(E)2‒U (E = O, S, Se, Te) Chemical Science 2(8) (2011) 1538
Space group: P -1
Cell volume: 5413.2
Cell parameters: 15.1722; 16.9264; 21.898; 99.027; 100.16; 96.211;  

COD ID: 1515600
CIF file Formula: - C22 H20 Br N O5 S -
Comments: Gu, Qing; You, Shu-Li Desymmetrization of cyclohexadienones via cinchonine derived thiourea-catalyzed enantioselective aza-Michael reaction and total synthesis of (-)-Mesembrine Chemical Science 2(8) (2011) 1519
Space group: P 21 21 21
Cell volume: 2167.6
Cell parameters: 10.3614; 11.1748; 18.7204; 90; 90; 90;  

COD ID: 1515601
CIF file Formula: - Ca2 F H7 Ir O7 -
Comments: Sardar, Kripasindhu; Fisher, Janet; Thompsett, David; Lees, Martin R.; Clarkson, Guy J.; Sloan, Jeremy; Kashtiban, Reza J.; Walton, Richard I. Structural variety in iridate oxides and hydroxides from hydrothermal synthesis Chemical Science 2(8) (2011) 1573
Space group: P 42/n c m :2
Cell volume: 639.9
Cell parameters: 10.6331; 10.6331; 5.6597; 90; 90; 90;  

COD ID: 1515602
CIF file Formula: - H8 Ir O8 Sr2 -
Comments: Sardar, Kripasindhu; Fisher, Janet; Thompsett, David; Lees, Martin R.; Clarkson, Guy J.; Sloan, Jeremy; Kashtiban, Reza J.; Walton, Richard I. Structural variety in iridate oxides and hydroxides from hydrothermal synthesis Chemical Science 2(8) (2011) 1573
Space group: P 1 21/c 1
Cell volume: 363.01
Cell parameters: 5.9657; 10.9919; 6.0097; 90; 112.903; 90;  

COD ID: 1515603
CIF file Formula: - C8 H22 Al N3 -
Comments: Hansmann, Max M.; Melen, Rebecca L.; Wright, Dominic S. Group 13 BN dehydrocoupling reagents, similar to transition metal catalysts but with unique reactivity Chemical Science 2(8) (2011) 1554
Space group: P 1 21/n 1
Cell volume: 1148.68
Cell parameters: 8.7047; 15.6298; 9.3874; 90; 115.922; 90;  

COD ID: 1515604
CIF file Formula: - C12 H32 Al2 N2 -
Comments: Hansmann, Max M.; Melen, Rebecca L.; Wright, Dominic S. Group 13 BN dehydrocoupling reagents, similar to transition metal catalysts but with unique reactivity Chemical Science 2(8) (2011) 1554
Space group: C 1 2/c 1
Cell volume: 1658.4
Cell parameters: 14.6013; 15.486; 8.6751; 90; 122.28; 90;  

COD ID: 1515605
CIF file Formula: - C12 H36 B3 N3 -
Comments: Hansmann, Max M.; Melen, Rebecca L.; Wright, Dominic S. Group 13 BN dehydrocoupling reagents, similar to transition metal catalysts but with unique reactivity Chemical Science 2(8) (2011) 1554
Space group: P 65
Cell volume: 10353
Cell parameters: 19.5895; 19.5895; 31.1522; 90; 90; 120;  

COD ID: 1515606
CIF file Formula: - C37 H113 B4 N9 O Si12 -
Comments: Hansmann, Max M.; Melen, Rebecca L.; Wright, Dominic S. Group 13 BN dehydrocoupling reagents, similar to transition metal catalysts but with unique reactivity Chemical Science 2(8) (2011) 1554
Space group: P 63
Cell volume: 11143.3
Cell parameters: 29.3467; 29.3467; 14.9405; 90; 90; 120;  

COD ID: 1515612
CIF file Formula: - C12 H154 N6 Na18 O165 Te8 W28 -
Comments: Gao, Jing; Yan, Jun; Mitchell, Scott G.; Miras, Haralampos N.; Boulay, Antoine G.; Long, De-Liang; Cronin, Leroy Self-assembly of a family of macrocyclic polyoxotungstates with emergent material properties Chemical Science 2(8) (2011) 1502
Space group: P m m n :2
Cell volume: 8590.1
Cell parameters: 21.1146; 32.0756; 12.6836; 90; 90; 90;  

COD ID: 1515613
CIF file Formula: - H130 K24 O177 Te8 W28 -
Comments: Gao, Jing; Yan, Jun; Mitchell, Scott G.; Miras, Haralampos N.; Boulay, Antoine G.; Long, De-Liang; Cronin, Leroy Self-assembly of a family of macrocyclic polyoxotungstates with emergent material properties Chemical Science 2(8) (2011) 1502
Space group: P 1 21/n 1
Cell volume: 16375.3
Cell parameters: 19.7207; 37.8627; 22.6396; 90; 104.374; 90;  

COD ID: 1515614
CIF file Formula: - H79 Na26 O152 Te9 W28 -
Comments: Gao, Jing; Yan, Jun; Mitchell, Scott G.; Miras, Haralampos N.; Boulay, Antoine G.; Long, De-Liang; Cronin, Leroy Self-assembly of a family of macrocyclic polyoxotungstates with emergent material properties Chemical Science 2(8) (2011) 1502
Space group: P -1
Cell volume: 9006.8
Cell parameters: 19.3418; 21.0639; 22.8563; 104.296; 91.843; 92.426;  

COD ID: 1515615
CIF file Formula: - Cl H142 Na27 O186 Te9 W28 -
Comments: Gao, Jing; Yan, Jun; Mitchell, Scott G.; Miras, Haralampos N.; Boulay, Antoine G.; Long, De-Liang; Cronin, Leroy Self-assembly of a family of macrocyclic polyoxotungstates with emergent material properties Chemical Science 2(8) (2011) 1502
Space group: C 1 2/m 1
Cell volume: 18105.7
Cell parameters: 32.5176; 20.937; 27.2721; 90; 102.804; 90;  

COD ID: 1515616
CIF file Formula: - H90 Na28 O163 Te10 W28 -
Comments: Gao, Jing; Yan, Jun; Mitchell, Scott G.; Miras, Haralampos N.; Boulay, Antoine G.; Long, De-Liang; Cronin, Leroy Self-assembly of a family of macrocyclic polyoxotungstates with emergent material properties Chemical Science 2(8) (2011) 1502
Space group: C 1 2/c 1
Cell volume: 17277.4
Cell parameters: 34.873; 18.6557; 27.5438; 90; 105.384; 90;  

COD ID: 1515617
CIF file Formula: - C27 H20 O2 -
Comments: Kuzmanich, Gregory; Xue, Jiadan; Netto-Ferreira, José-Carlos; Scaiano, J. C.; Platz, Matthew; Garcia-Garibay, Miguel A. Steady state and transient kinetics in crystalline solids: the photochemistry of nanocrystalline 1,1,3-triphenyl-3-hydroxy-2-indanone Chemical Science 2(8) (2011) 1497
Space group: P -1
Cell volume: 968.8
Cell parameters: 8.5144; 8.9709; 13.415; 92.829; 103.59; 102.048;  

COD ID: 1515618
CIF file Formula: - C19 H16 I N O3 -
Comments: Leon, Rafael; Jawalekar, Anup; Redert, Thomas; Gaunt, Matthew J. Catalytic enantioselective assembly of complex molecules containing embedded quaternary stereogenic centres from simple anisidine derivatives Chemical Science 2(8) (2011) 1487
Space group: P 21 21 21
Cell volume: 1780.29
Cell parameters: 7.0652; 11.0639; 22.775; 90; 90; 90;  

COD ID: 1515619
CIF file Formula: - C16 H18 Cl N O2 Pd S -
Comments: Xu, Yun-He; Chok, Yew Keong; Loh, Teck-Peng Synthesis and characterization of a cyclic vinylpalladium(ii) complex: vinylpalladium species as the possible intermediate in the catalytic direct olefination reaction of enamide Chemical Science 2(9) (2011) 1822
Space group: P 1 21/c 1
Cell volume: 1670.14
Cell parameters: 13.445; 9.4054; 14.8518; 90; 117.218; 90;  

COD ID: 1515620
CIF file Formula: - C20 H26 N O4.5 Pd S -
Comments: Xu, Yun-He; Chok, Yew Keong; Loh, Teck-Peng Synthesis and characterization of a cyclic vinylpalladium(ii) complex: vinylpalladium species as the possible intermediate in the catalytic direct olefination reaction of enamide Chemical Science 2(9) (2011) 1822
Space group: P 1 21/c 1
Cell volume: 2059.4
Cell parameters: 13.1411; 18.9878; 8.625; 90; 106.879; 90;  

COD ID: 1515621
CIF file Formula: - C75 H86 N22 O23 -
Comments: Wang, Qi-Qiang; Day, Victor W.; Bowman-James, Kristin Tunable, shape-shifting capsule for dicarboxylates Chemical Science 2(9) (2011) 1735
Space group: C 1 2/c 1
Cell volume: 8572.9
Cell parameters: 34.486; 11.34; 24.7183; 90; 117.519; 90;  

COD ID: 1515622
CIF file Formula: - C114 H178 N28 O22 -
Comments: Wang, Qi-Qiang; Day, Victor W.; Bowman-James, Kristin Tunable, shape-shifting capsule for dicarboxylates Chemical Science 2(9) (2011) 1735
Space group: P -1
Cell volume: 3129.2
Cell parameters: 13.477; 15.019; 17.319; 98.171; 109.671; 102.737;  

COD ID: 1515623
CIF file Formula: - C84 H118 Cl6 N26 O19 -
Comments: Wang, Qi-Qiang; Day, Victor W.; Bowman-James, Kristin Tunable, shape-shifting capsule for dicarboxylates Chemical Science 2(9) (2011) 1735
Space group: P -1
Cell volume: 2434.2
Cell parameters: 12.36; 14.699; 15.587; 70.114; 82.103; 66.078;  

COD ID: 1515624
CIF file Formula: - C154 H167 N6 O63.5 S10 -
Comments: Guo, Dong-Sheng; Uzunova, Vanya D.; Su, Xin; Liu, Yu; Nau, Werner M. Operational calixarene-based fluorescent sensing systems for choline and acetylcholine and their application to enzymatic reactions Chemical Science 2(9) (2011) 1722
Space group: C 1 2/c 1
Cell volume: 15455
Cell parameters: 29.168; 27.741; 20.935; 90; 114.17; 90;  

COD ID: 1515625
CIF file Formula: - C90 H48 B6 Cl12 N12 O12 -
Comments: Icli, Burcak; Sheepwash, Erin; Riis-Johannessen, Thomas; Schenk, Kurt; Filinchuk, Yaroslav; Scopelliti, Rosario; Severin, Kay Dative boron–nitrogen bonds in structural supramolecular chemistry: multicomponent assembly of prismatic organic cages Chemical Science 2(9) (2011) 1719
Space group: R -3 c :H
Cell volume: 14437
Cell parameters: 13.4133; 13.4133; 92.656; 90; 90; 120;  

COD ID: 1515626
CIF file Formula: - C114 H60 B6 Cl12 N12 O12 -
Comments: Icli, Burcak; Sheepwash, Erin; Riis-Johannessen, Thomas; Schenk, Kurt; Filinchuk, Yaroslav; Scopelliti, Rosario; Severin, Kay Dative boron‒nitrogen bonds in structural supramolecular chemistry: multicomponent assembly of prismatic organic cages Chemical Science 2(9) (2011) 1719
Space group: P 63/m
Cell volume: 5473.6
Cell parameters: 14.3139; 14.3139; 30.848; 90; 90; 120;  

COD ID: 1515627
CIF file Formula: - C108 H60 B6 Cl12 N12 O12 -
Comments: Icli, Burcak; Sheepwash, Erin; Riis-Johannessen, Thomas; Schenk, Kurt; Filinchuk, Yaroslav; Scopelliti, Rosario; Severin, Kay Dative boron–nitrogen bonds in structural supramolecular chemistry: multicomponent assembly of prismatic organic cages Chemical Science 2(9) (2011) 1719
Space group: R -3 c :H
Cell volume: 14738.3
Cell parameters: 13.5162; 13.5162; 93.155; 90; 90; 120;  

COD ID: 1515628
CIF file Formula: - C144 H84 B6 Cl12 N12 O12 -
Comments: Icli, Burcak; Sheepwash, Erin; Riis-Johannessen, Thomas; Schenk, Kurt; Filinchuk, Yaroslav; Scopelliti, Rosario; Severin, Kay Dative boron–nitrogen bonds in structural supramolecular chemistry: multicomponent assembly of prismatic organic cages Chemical Science 2(9) (2011) 1719
Space group: R -3 c :H
Cell volume: 18775
Cell parameters: 13.5417; 13.5417; 118.223; 90; 90; 120;  

COD ID: 1515629
CIF file Formula: - C22 H16 Cl2 -
Comments: Liu, Jianzhao; Deng, Chunmei; Tseng, Nai-Wen; Chan, Carrie Y. K.; Yue, Yanan; Ng, Jason C. Y.; Lam, Jacky W. Y.; Wang, Jian; Hong, Yuning; Sung, Herman H. Y.; Williams, Ian D.; Tang, Ben Zhong A new polymerisation route to conjugated polymers: regio- and stereoselective synthesis of linear and hyperbranched poly(arylene chlorovinylene)s by decarbonylative polyaddition of aroyl chlorides and alkynes Chemical Science 2(9) (2011) 1850
Space group: P 21 21 21
Cell volume: 1695.51
Cell parameters: 6.24573; 7.2874; 37.2516; 90; 90; 90;  

COD ID: 1515630
CIF file Formula: - C30 H21 Cl3 -
Comments: Liu, Jianzhao; Deng, Chunmei; Tseng, Nai-Wen; Chan, Carrie Y. K.; Yue, Yanan; Ng, Jason C. Y.; Lam, Jacky W. Y.; Wang, Jian; Hong, Yuning; Sung, Herman H. Y.; Williams, Ian D.; Tang, Ben Zhong A new polymerisation route to conjugated polymers: regio- and stereoselective synthesis of linear and hyperbranched poly(arylene chlorovinylene)s by decarbonylative polyaddition of aroyl chlorides and alkynes Chemical Science 2(9) (2011) 1850
Space group: R 3 c :H
Cell volume: 3641
Cell parameters: 24.8014; 24.8014; 6.835; 90; 90; 120;  

COD ID: 1515631
CIF file Formula: - C132 H180 Cl12 Co8 N72 O4 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: P a -3
Cell volume: 15818.2
Cell parameters: 25.1026; 25.1026; 25.1026; 90; 90; 90;  

COD ID: 1515632
CIF file Formula: - C132 H156 Br12 Co8 N72 O18 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: P 1 21/n 1
Cell volume: 8525
Cell parameters: 17.758; 19.38; 24.772; 90; 90.257; 90;  

COD ID: 1515633
CIF file Formula: - C138 H156 Cl16 Co10 N72 O11.5 S3 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: C 1 2/m 1
Cell volume: 9284.5
Cell parameters: 28.55; 22.5268; 19.4189; 90; 131.977; 90;  

COD ID: 1515634
CIF file Formula: - C132 H156 Co8 N84 O58.5 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: P 1 21/n 1
Cell volume: 8922
Cell parameters: 20.155; 19.422; 22.792; 90; 90.221; 90;  

COD ID: 1515635
CIF file Formula: - C138 H178 B12 Co8 F48 N74 O16.75 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: C 1 2/c 1
Cell volume: 19350
Cell parameters: 31.693; 20.047; 32.309; 90; 109.5; 90;  

COD ID: 1515636
CIF file Formula: - C132 H168 Cl12 Co8 N72 O40 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: C 1 2/c 1
Cell volume: 18633
Cell parameters: 33.008; 19.253; 32.654; 90; 116.116; 90;  

COD ID: 1515637
CIF file Formula: - C56 H88 N32 Ni4 O16 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: P b c a
Cell volume: 7505.6
Cell parameters: 17.3775; 17.494; 24.6892; 90; 90; 90;  

COD ID: 1515638
CIF file Formula: - C14 H22 Cd N8 O4 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: P 1 21/n 1
Cell volume: 1815.9
Cell parameters: 12.909; 12.071; 12.95; 90; 115.858; 90;  

COD ID: 1515639
CIF file Formula: - C132 H126 In8 N84 O39.67 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: R -3 :H
Cell volume: 13111.9
Cell parameters: 28.1055; 28.1055; 19.1669; 90; 90; 120;  

COD ID: 1515640
CIF file Formula: - C135 H175 Co8 N73 O56 S6 -
Comments: Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science 2(9) (2011) 1695
Space group: P 1 21/n 1
Cell volume: 9454.6
Cell parameters: 20.3067; 18.7195; 24.9104; 90; 93.182; 90;  

COD ID: 1515641
CIF file Formula: - C11 H20 Cl2 Fe0.5 N3 O2 Re0.5 -
Comments: Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science 2(9) (2011) 1688
Space group: P -1
Cell volume: 877.838
Cell parameters: 8.623; 10.307; 10.493; 104.88; 92.7; 101.67;  

COD ID: 1515642
CIF file Formula: - C38 H72 Cl4 Fe N6 O4 Re -
Comments: Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science 2(9) (2011) 1688
Space group: P -1
Cell volume: 1201.85
Cell parameters: 8.9348; 10.504; 14.0627; 68.984; 77.296; 85.408;  

COD ID: 1515643
CIF file Formula: - C13 H26 Cl2 Fe0.5 N3 O2 Re0.5 -
Comments: Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science 2(9) (2011) 1688
Space group: P 1 21/n 1
Cell volume: 1828.75
Cell parameters: 10.778; 12.316; 14.407; 90; 107.01; 90;  

COD ID: 1515644
CIF file Formula: - C11 H22 Cl2 Fe0.5 N3 O2 Re0.5 -
Comments: Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science 2(9) (2011) 1688
Space group: P -1
Cell volume: 810.526
Cell parameters: 9.465; 9.976; 10.631; 108.44; 109.42; 106.27;  

COD ID: 1515645
CIF file Formula: - C26 H52 Cl4 Fe N6 O4 Re -
Comments: Feng, Xiaowen; David Harris, T.; Long, Jeffrey R. Influence of structure on exchange strength and relaxation barrier in a series of FeIIReIV(CN)2 single-chain magnets Chemical Science 2(9) (2011) 1688
Space group: P 4/n :2
Cell volume: 1914.5
Cell parameters: 13.3667; 13.3667; 10.7152; 90; 90; 90;  

COD ID: 1515649
CIF file Formula: - C50 H58 N O18 Ru3 S6 -
Comments: Lai-Fung Chan, Sharon; Wai-Yin Sun, Raymond; Choi, Mei-Yuk; Zeng, Yibo; Shek, Lam; Sin-Yin Chui, Stephen; Che, Chi-Ming An anti-cancer trinuclear ruthenium(iii) complex with 2-thiosalicylate ligands attenuates Wnt-β-catenin signaling Chemical Science 2(9) (2011) 1788
Space group: P -1
Cell volume: 1397.7
Cell parameters: 10.577; 10.715; 13.367; 106.03; 90.59; 105.44;  

COD ID: 1515651
CIF file Formula: - C24 H18 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P -4 21 c
Cell volume: 4367.4
Cell parameters: 22.3613; 22.3613; 8.7343; 90; 90; 90;  

COD ID: 1515652
CIF file Formula: - C27 H22 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P -1
Cell volume: 1242.4
Cell parameters: 9.1677; 11.1135; 13.3821; 68.696; 78.909; 81.699;  

COD ID: 1515653
CIF file Formula: - C23 H20 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: C 1 2/c 1
Cell volume: 4370.6
Cell parameters: 18.5936; 9.2952; 26.1791; 90; 104.988; 90;  

COD ID: 1515654
CIF file Formula: - C38 H34 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P 1 21/n 1
Cell volume: 3452.24
Cell parameters: 13.6638; 16.1258; 16.855; 90; 111.633; 90;  

COD ID: 1515655
CIF file Formula: - C28 H28 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: C 1 2/c 1
Cell volume: 5370.7
Cell parameters: 18.8907; 17.3259; 16.9954; 90; 105.094; 90;  

COD ID: 1515656
CIF file Formula: - C33 H24 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P 1 21/n 1
Cell volume: 2974.6
Cell parameters: 8.9726; 13.4786; 24.6543; 90; 93.952; 90;  

COD ID: 1515657
CIF file Formula: - C25 H20 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: A b a 2
Cell volume: 4730
Cell parameters: 17.8309; 21.5961; 12.2832; 90; 90; 90;  

COD ID: 1515658
CIF file Formula: - C23 H22 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P 1 21/n 1
Cell volume: 2220.15
Cell parameters: 12.1379; 14.0463; 13.5423; 90; 105.934; 90;  

COD ID: 1515659
CIF file Formula: - C22 H20 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P 21 21 21
Cell volume: 2114.05
Cell parameters: 10.9724; 11.3362; 16.996; 90; 90; 90;  

COD ID: 1515660
CIF file Formula: - C30 H26 B F10 N O -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P -1
Cell volume: 1366.01
Cell parameters: 9.428; 11.0909; 14.6744; 108.637; 96.263; 105.831;  

COD ID: 1515661
CIF file Formula: - C43 H38 B F10 N O -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: P 1 21/c 1
Cell volume: 3727.1
Cell parameters: 20.3695; 9.2993; 21.591; 90; 114.314; 90;  

COD ID: 1515662
CIF file Formula: - C16 H15 Br O -
Comments: Li, Hui; Zhang, Fu-Min; Tu, Yong-Qiang; Zhang, Qing-Wei; Chen, Zhi-Min; Chen, Zhi-Hua; Li, Jian Enantioselective bromination/semipinacol rearrangement for the synthesis of β-bromoketones containing an all-α-carbon quaternary center Chemical Science 2(9) (2011) 1839
Space group: P 1 21 1
Cell volume: 1394.7
Cell parameters: 12.363; 6.388; 17.867; 90; 98.728; 90;  

COD ID: 1515663
CIF file Formula: - C56 H126 N6 O2 Si12 U2 -
Comments: Arnold, Polly L.; Turner, Zoë R.; Bellabarba, Ronan M.; Tooze, Robert P. Carbon monoxide coupling and functionalisation at a simple uranium coordination complex Chemical Science 2(1) (2011) 77
Space group: P -1
Cell volume: 2057.05
Cell parameters: 11.0022; 11.7354; 18.0634; 90.254; 94.779; 117.609;  

COD ID: 1515664
CIF file Formula: - C57 H162 N9 O3 Si18 U3 -
Comments: Arnold, Polly L.; Turner, Zoë R.; Bellabarba, Ronan M.; Tooze, Robert P. Carbon monoxide coupling and functionalisation at a simple uranium coordination complex Chemical Science 2(1) (2011) 77
Space group: P 1 21/c 1
Cell volume: 10263.2
Cell parameters: 30.0251; 15.6531; 22.4759; 90; 103.691; 90;  

COD ID: 1515665
CIF file Formula: - C57 H60 B F20 N2 O2 P Zr -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair‒nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: C 1 2/c 1
Cell volume: 11749
Cell parameters: 36.218; 12.304; 31.224; 90; 122.397; 90;  

COD ID: 1515666
CIF file Formula: - C30 H30 B F12 N2 O P -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: P 21 21 21
Cell volume: 3139.6
Cell parameters: 11.6507; 13.7877; 19.5448; 90; 90; 90;  

COD ID: 1515667
CIF file Formula: - C60 H66 B2 F24 N4 O2 P2 -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: P -1
Cell volume: 1722.62
Cell parameters: 11.691; 12.8326; 13.5442; 63.637; 88.082; 72.341;  

COD ID: 1515668
CIF file Formula: - C36 H36 B F12 N2 O P -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: P b c a
Cell volume: 6947.5
Cell parameters: 19.5019; 16.3963; 21.7273; 90; 90; 90;  

COD ID: 1515669
CIF file Formula: - C37 H47 B Cl F3 O P2 -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair‒nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: P 1 21/c 1
Cell volume: 3480.5
Cell parameters: 9.5346; 21.1476; 17.6877; 90; 102.604; 90;  

COD ID: 1515670
CIF file Formula: - C55 H42 B F20 N2 O P -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: P -1
Cell volume: 2708.21
Cell parameters: 12.3838; 12.5415; 18.4913; 94.703; 103.546; 101.734;  

COD ID: 1515671
CIF file Formula: - C42 H43 B F15 N2 O P Zr -
Comments: Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair‒nitrous oxide complexes Chemical Science 2(1) (2011) 170
Space group: P 1 21/n 1
Cell volume: 4225.5
Cell parameters: 15.6655; 12.5681; 21.5094; 90; 93.812; 90;  

COD ID: 1515672
CIF file Formula: - C120 H60 Cd13 O66 S24 -
Comments: Yuan, Daqiang; Zhao, Dan; Timmons, Daren J.; Zhou, Hong-Cai A stepwise transition from microporosity to mesoporosity in metal‒organic frameworks by thermal treatment Chemical Science 2(1) (2011) 103
Space group: F m -3 c
Cell volume: 60258
Cell parameters: 39.2048; 39.2048; 39.2048; 90; 90; 90;  

COD ID: 1515673
CIF file Formula: - C40.25 H36.5 Cl0.5 N10 -
Comments: Breiten, Benjamin; Wu, Yi-Lin; Jarowski, Peter D.; Gisselbrecht, Jean-Paul; Boudon, Corinne; Griesser, Markus; Onitsch, Christine; Gescheidt, Georg; Schweizer, W. Bernd; Langer, Nicolle; Lennartz, Christian; Diederich, François Donor-substituted octacyano[4]dendralenes: a new class of cyano-rich non-planar organic acceptors Chemical Science 2(1) (2011) 88
Space group: P 1 21/n 1
Cell volume: 4013.1
Cell parameters: 13.668; 12.3175; 24.2737; 90; 100.887; 90;  

COD ID: 1515674
CIF file Formula: - C52 H60 N10 -
Comments: Breiten, Benjamin; Wu, Yi-Lin; Jarowski, Peter D.; Gisselbrecht, Jean-Paul; Boudon, Corinne; Griesser, Markus; Onitsch, Christine; Gescheidt, Georg; Schweizer, W. Bernd; Langer, Nicolle; Lennartz, Christian; Diederich, François Donor-substituted octacyano[4]dendralenes: a new class of cyano-rich non-planar organic acceptors Chemical Science 2(1) (2011) 88
Space group: P 1 21/c 1
Cell volume: 4748.04
Cell parameters: 14.1265; 21.8947; 15.3826; 90; 93.6655; 90;  

COD ID: 1515675
CIF file Formula: - C19 H22 N2 O5 S -
Comments: Stoll, Armin H.; Blakey, Simon B. Rhodium catalyzed allene amidation: a facile entry into 2-amidoallylcations for unusual [3 + 3] annulation reactions Chemical Science 2(1) (2011) 112
Space group: P 1 21/n 1
Cell volume: 1871.2
Cell parameters: 6.9683; 21.374; 12.566; 90; 91.091; 90;  

COD ID: 1515676
CIF file Formula: - C11 H19 N O5 S -
Comments: Stoll, Armin H.; Blakey, Simon B. Rhodium catalyzed allene amidation: a facile entry into 2-amidoallylcations for unusual [3 + 3] annulation reactions Chemical Science 2(1) (2011) 112
Space group: P 1 21/n 1
Cell volume: 1442.15
Cell parameters: 12.6837; 8.7119; 13.9765; 90; 110.965; 90;  

COD ID: 1515677
CIF file Formula: - C25.5 H29.5 Cl1.5 N O2 S -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: C 1 2/c 1
Cell volume: 4644.1
Cell parameters: 35.8601; 6.0216; 23.1924; 90; 111.979; 90;  

COD ID: 1515678
CIF file Formula: - C28 H29 N O2 S -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: P 1 21 1
Cell volume: 1140.8
Cell parameters: 8.962; 10.4716; 12.3795; 90; 100.903; 90;  

COD ID: 1515679
CIF file Formula: - C27 H27 N O2 S -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: P 1 21/c 1
Cell volume: 2288.7
Cell parameters: 13.6368; 7.9693; 21.253; 90; 97.724; 90;  

COD ID: 1515680
CIF file Formula: - C33 H31 N O2 S -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: C 1 2/c 1
Cell volume: 5183.8
Cell parameters: 52.0309; 6.2004; 16.2321; 90; 98.15; 90;  

COD ID: 1515681
CIF file Formula: - C28 H29 N O2 S -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: P c c n
Cell volume: 4738.4
Cell parameters: 34.3459; 11.0908; 12.4392; 90; 90; 90;  

COD ID: 1515682
CIF file Formula: - C32 H32 O4 S2 -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: P -1
Cell volume: 1319.3
Cell parameters: 10.0661; 11.2303; 12.7093; 108.467; 92.142; 102.893;  

COD ID: 1515683
CIF file Formula: - C33 H34 O4 S2 -
Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141
Space group: P -1
Cell volume: 1376.4
Cell parameters: 10.7285; 10.9833; 13.0463; 111.389; 92.772; 103.536;  

COD ID: 1515684
CIF file Formula: - C112 H222 Co8 Gd8 N4 O73 P8 -
Comments: Zheng, Yan-Zhen; Evangelisti, Marco; Winpenny, Richard E. P. Co‒Gd phosphonate complexes as magnetic refrigerants Chemical Science 2(1) (2011) 99
Space group: C 1 2/c 1
Cell volume: 18159.3
Cell parameters: 35.624; 20.7297; 25.0866; 90; 101.416; 90;  

COD ID: 1515685
CIF file Formula: - C104 H198 Co8 Gd4 O50 P6 -
Comments: Zheng, Yan-Zhen; Evangelisti, Marco; Winpenny, Richard E. P. Co‒Gd phosphonate complexes as magnetic refrigerants Chemical Science 2(1) (2011) 99
Space group: P 1 21/n 1
Cell volume: 7872.5
Cell parameters: 22.622; 11.63; 30.189; 90; 97.612; 90;  

COD ID: 1515686
CIF file Formula: - C116 H174 Co4 Gd6 N2 O46 P6 -
Comments: Zheng, Yan-Zhen; Evangelisti, Marco; Winpenny, Richard E. P. Co‒Gd phosphonate complexes as magnetic refrigerants Chemical Science 2(1) (2011) 99
Space group: P 1 21/n 1
Cell volume: 7109.5
Cell parameters: 13.55; 29.003; 18.2506; 90; 97.588; 90;  

COD ID: 1515687
CIF file Formula: - C64 H88 Cl2 N8 O5 Zr2 -
Comments: Nguyen, Andy I.; Zarkesh, Ryan A.; Lacy, David C.; Thorson, Megan K.; Heyduk, Alan F. Catalytic nitrene transfer by a zirconium(iv) redox-active ligand complex Chemical Science 2(1) (2011) 166
Space group: P 21 21 21
Cell volume: 6424.6
Cell parameters: 14.7192; 20.6103; 21.1775; 90; 90; 90;  

COD ID: 1515688
CIF file Formula: - C84 H50 B2 F48 Pt3 -
Comments: Murahashi, Tetsuro; Usui, Kentaro; Inoue, Ryou; Ogoshi, Sensuke; Kurosawa, Hideo Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl Chemical Science 2(1) (2011) 117
Space group: C 1 2/c 1
Cell volume: 8320.1
Cell parameters: 19.6876; 18.0489; 24.2236; 90; 104.85; 90;  

COD ID: 1515689
CIF file Formula: - C81 H70 B F4 N P4 Pt2 -
Comments: Murahashi, Tetsuro; Usui, Kentaro; Inoue, Ryou; Ogoshi, Sensuke; Kurosawa, Hideo Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl Chemical Science 2(1) (2011) 117
Space group: C 1 2/c 1
Cell volume: 6959.3
Cell parameters: 27.639; 14.661; 17.671; 90; 103.616; 90;  

COD ID: 1515690
CIF file Formula: - C49 H43 B F4 P2 Pt -
Comments: Murahashi, Tetsuro; Usui, Kentaro; Inoue, Ryou; Ogoshi, Sensuke; Kurosawa, Hideo Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl Chemical Science 2(1) (2011) 117
Space group: P 1 21/a 1
Cell volume: 4087.9
Cell parameters: 13.742; 20.974; 14.377; 90; 99.419; 90;  

COD ID: 1515691
CIF file Formula: - C60 H41 B Cl2 F30 Pt3 -
Comments: Murahashi, Tetsuro; Usui, Kentaro; Inoue, Ryou; Ogoshi, Sensuke; Kurosawa, Hideo Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl Chemical Science 2(1) (2011) 117
Space group: P -1
Cell volume: 2962.6
Cell parameters: 12.3189; 15.2911; 16.4704; 97.219; 90.674; 105.503;  

COD ID: 1515692
CIF file Formula: - C56 H39 B F24 Pt3 -
Comments: Murahashi, Tetsuro; Usui, Kentaro; Inoue, Ryou; Ogoshi, Sensuke; Kurosawa, Hideo Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl Chemical Science 2(1) (2011) 117
Space group: P 1 21/n 1
Cell volume: 5442.1
Cell parameters: 11.4558; 19.1713; 25.517; 90; 103.809; 90;  

COD ID: 1515962
CIF file Formula: - C120 H84 N48 Zn12 -
Comments: Colombo, Valentina; Galli, Simona; Choi, Hye Jin; Han, Ggoch Ddeul; Maspero, Angelo; Palmisano, Giovanni; Masciocchi, Norberto; Long, Jeffrey R. High thermal and chemical stability in pyrazolate-bridged metal‒organic frameworks with exposed metal sites Chemical Science 2(7) (2011) 1311
Space group: P n -3 n
Cell volume: 6380.4
Cell parameters: 18.5474; 18.5474; 18.5474; 90; 90; 90;  

COD ID: 1515963
CIF file Formula: - C34 H38 N12 O6 Zn3 -
Comments: Colombo, Valentina; Galli, Simona; Choi, Hye Jin; Han, Ggoch Ddeul; Maspero, Angelo; Palmisano, Giovanni; Masciocchi, Norberto; Long, Jeffrey R. High thermal and chemical stability in pyrazolate-bridged metal‒organic frameworks with exposed metal sites Chemical Science 2(7) (2011) 1311
Space group: P 42/n c m
Cell volume: 4846.5
Cell parameters: 15.55503; 15.55503; 20.0304; 90; 90; 90;  

COD ID: 1515964
CIF file Formula: - C38 H70 Co3 N12 O18 -
Comments: Colombo, Valentina; Galli, Simona; Choi, Hye Jin; Han, Ggoch Ddeul; Maspero, Angelo; Palmisano, Giovanni; Masciocchi, Norberto; Long, Jeffrey R. High thermal and chemical stability in pyrazolate-bridged metal‒organic frameworks with exposed metal sites Chemical Science 2(7) (2011) 1311
Space group: P 42/n c m
Cell volume: 4793.1
Cell parameters: 15.4625; 15.4625; 20.0474; 90; 90; 90;  

COD ID: 1515965
CIF file Formula: - C38 H70 Cu3 N12 O18 -
Comments: Colombo, Valentina; Galli, Simona; Choi, Hye Jin; Han, Ggoch Ddeul; Maspero, Angelo; Palmisano, Giovanni; Masciocchi, Norberto; Long, Jeffrey R. High thermal and chemical stability in pyrazolate-bridged metal‒organic frameworks with exposed metal sites Chemical Science 2(7) (2011) 1311
Space group: P m -3 m
Cell volume: 6652.1
Cell parameters: 18.80701; 18.80701; 18.80701; 90; 90; 90;  

COD ID: 1515966
CIF file Formula: - C33 H50 N12 Ni3 O13 -
Comments: Colombo, Valentina; Galli, Simona; Choi, Hye Jin; Han, Ggoch Ddeul; Maspero, Angelo; Palmisano, Giovanni; Masciocchi, Norberto; Long, Jeffrey R. High thermal and chemical stability in pyrazolate-bridged metal‒organic frameworks with exposed metal sites Chemical Science 2(7) (2011) 1311
Space group: P m -3 m
Cell volume: 6382
Cell parameters: 18.54898; 18.54898; 18.54898; 90; 90; 90;  

COD ID: 1515967
CIF file Formula: - C23 H23 N2 O3 -
Comments: Graham, Thomas J. A.; Shields, Jason D.; Doyle, Abigail G. Transition metal-catalyzed cross coupling with N-acyliminium ions derived from quinolines and isoquinolines Chemical Science 2(5) (2011) 980
Space group: P 1 21/c 1
Cell volume: 2078.52
Cell parameters: 12.0405; 17.1549; 10.0631; 90; 90.406; 90;  


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