Crystallography Open Database

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Searching journal of publication like 'Chemistry of Materials' volume of publication is 28

COD ID: 4002641
CIF file Formula: - B2 H8 Mn -
Comments: Tumanov, Nikolay A.; Roedern, Elsa; Łodziana, Zbigniew; Nielsen, Dorrit B.; Jensen, Torben R.; Talyzin, Alexandr V.; Černý, Radovan; Chernyshov, Dmitry; Dmitriev, Vladimir; Palasyuk, Taras; Filinchuk, Yaroslav High-Pressure Study of Mn(BH4)2Reveals a Stable Polymorph with High Hydrogen Density Chemistry of Materials 28(1) (2016) 274
Space group: P -4 n 2
Cell volume: 187.23
Cell parameters: 5.5526; 5.5526; 6.07271; 90; 90; 90;  

COD ID: 4002642
CIF file Formula: - B2 H8 Mn -
Comments: Tumanov, Nikolay A.; Roedern, Elsa; Łodziana, Zbigniew; Nielsen, Dorrit B.; Jensen, Torben R.; Talyzin, Alexandr V.; Černý, Radovan; Chernyshov, Dmitry; Dmitriev, Vladimir; Palasyuk, Taras; Filinchuk, Yaroslav High-Pressure Study of Mn(BH4)2Reveals a Stable Polymorph with High Hydrogen Density Chemistry of Materials 28(1) (2016) 274
Space group: I 41/a c d :2
Cell volume: 748.919
Cell parameters: 7.85254; 7.85254; 12.14548; 90; 90; 90;  

COD ID: 4002643
CIF file Formula: - B2 H8 Mn -
Comments: Tumanov, Nikolay A.; Roedern, Elsa; Łodziana, Zbigniew; Nielsen, Dorrit B.; Jensen, Torben R.; Talyzin, Alexandr V.; Černý, Radovan; Chernyshov, Dmitry; Dmitriev, Vladimir; Palasyuk, Taras; Filinchuk, Yaroslav High-Pressure Study of Mn(BH4)2Reveals a Stable Polymorph with High Hydrogen Density Chemistry of Materials 28(1) (2016) 274
Space group: F d d d :2
Cell volume: 1084
Cell parameters: 12.638; 9.321; 9.205; 90; 90; 90;  

COD ID: 4002644
CIF file Formula: - C18 H26 Cd N2 Te2 -
Comments: Campos, Michael P.; Owen, Jonathan S. Synthesis and Surface Chemistry of Cadmium Carboxylate Passivated CdTe Nanocrystals from Cadmiumbis(Phenyltellurolate) Chemistry of Materials 28(1) (2016) 227
Space group: P 1 21/c 1
Cell volume: 2098.7
Cell parameters: 13.0754; 11.4619; 15.1442; 90; 112.377; 90;  

COD ID: 4002645
CIF file Formula: - C60 H43 N6 O14 Zn3 -
Comments: Lee, Seok J.; Doussot, Celine; Baux, Anthony; Liu, Lujia; Jameson, Geoffrey B.; Richardson, Christopher; Pak, Joshua J.; Trousselet, Fabien; Coudert, François-Xavier; Telfer, Shane G. Multicomponent Metal‒Organic Frameworks as Defect-Tolerant Materials Chemistry of Materials 28(1) (2016) 368
Space group: P -1
Cell volume: 5044.7
Cell parameters: 13.6287; 13.9657; 26.6535; 85.319; 89.286; 86.172;  

COD ID: 4002646
CIF file Formula: - C48 H36 N4 O12 Zn3 -
Comments: Lee, Seok J.; Doussot, Celine; Baux, Anthony; Liu, Lujia; Jameson, Geoffrey B.; Richardson, Christopher; Pak, Joshua J.; Trousselet, Fabien; Coudert, François-Xavier; Telfer, Shane G. Multicomponent Metal‒Organic Frameworks as Defect-Tolerant Materials Chemistry of Materials 28(1) (2016) 368
Space group: R -3 c :H
Cell volume: 46327
Cell parameters: 44.6954; 44.6954; 26.7782; 90; 90; 120;  

COD ID: 4002647
CIF file Formula: - C36 H26 N3.33 O8 Zn2 -
Comments: Lee, Seok J.; Doussot, Celine; Baux, Anthony; Liu, Lujia; Jameson, Geoffrey B.; Richardson, Christopher; Pak, Joshua J.; Trousselet, Fabien; Coudert, François-Xavier; Telfer, Shane G. Multicomponent Metal‒Organic Frameworks as Defect-Tolerant Materials Chemistry of Materials 28(1) (2016) 368
Space group: R -3 :H
Cell volume: 37777
Cell parameters: 32.8962; 32.8962; 40.309; 90; 90; 120;  

COD ID: 4002648
CIF file Formula: - C35.75 H25.8 N3.28 O8 Zn2 -
Comments: Lee, Seok J.; Doussot, Celine; Baux, Anthony; Liu, Lujia; Jameson, Geoffrey B.; Richardson, Christopher; Pak, Joshua J.; Trousselet, Fabien; Coudert, François-Xavier; Telfer, Shane G. Multicomponent Metal‒Organic Frameworks as Defect-Tolerant Materials Chemistry of Materials 28(1) (2016) 368
Space group: R -3 :H
Cell volume: 37709
Cell parameters: 32.8817; 32.8817; 40.272; 90; 90; 120;  

COD ID: 4002650
CIF file Formula: - C36 H32 Cu2 N O13 -
Comments: Sartor, Michael; Stein, Timo; Hoffmann, Frank; Fröba, Michael A New Set of Isoreticular, Homochiral Metal‒Organic Frameworks with ucp Topology Chemistry of Materials 28(2) (2016) 519
Space group: P 4 3 2
Cell volume: 24242
Cell parameters: 28.9416; 28.9416; 28.9416; 90; 90; 90;  

COD ID: 4002651
CIF file Formula: - C33 H27 Cu2 N O11 -
Comments: Sartor, Michael; Stein, Timo; Hoffmann, Frank; Fröba, Michael A New Set of Isoreticular, Homochiral Metal‒Organic Frameworks with ucp Topology Chemistry of Materials 28(2) (2016) 519
Space group: P 4 3 2
Cell volume: 24454.9
Cell parameters: 29.0261; 29.0261; 29.0261; 90; 90; 90;  

COD ID: 4002653
CIF file Formula: - F K0.119 Li0.7 O4 P V -
Comments: Fedotov, Stanislav S.; Khasanova, Nellie R.; Samarin, Aleksandr Sh.; Drozhzhin, Oleg A.; Batuk, Dmitry; Karakulina, Olesia M.; Hadermann, Joke; Abakumov, Artem M.; Antipov, Evgeny V. AVPO4F (A = Li, K): A 4 V Cathode Material for High-Power Rechargeable Batteries Chemistry of Materials 28(2) (2016) 411
Space group: P n a n
Cell volume: 852.81
Cell parameters: 12.7943; 6.3019; 10.577; 90; 90; 90;  

COD ID: 4002654
CIF file Formula: - F K O4 P V -
Comments: Fedotov, Stanislav S.; Khasanova, Nellie R.; Samarin, Aleksandr Sh.; Drozhzhin, Oleg A.; Batuk, Dmitry; Karakulina, Olesia M.; Hadermann, Joke; Abakumov, Artem M.; Antipov, Evgeny V. AVPO4F (A = Li, K): A 4 V Cathode Material for High-Power Rechargeable Batteries Chemistry of Materials 28(2) (2016) 411
Space group: P n a 21
Cell volume: 869.99
Cell parameters: 12.82; 6.39516; 10.61151; 90; 90; 90;  

COD ID: 4002655
CIF file Formula: - F K0.173 O4 P V -
Comments: Fedotov, Stanislav S.; Khasanova, Nellie R.; Samarin, Aleksandr Sh.; Drozhzhin, Oleg A.; Batuk, Dmitry; Karakulina, Olesia M.; Hadermann, Joke; Abakumov, Artem M.; Antipov, Evgeny V. AVPO4F (A = Li, K): A 4 V Cathode Material for High-Power Rechargeable Batteries Chemistry of Materials 28(2) (2016) 411
Space group: P n a n
Cell volume: 864.13
Cell parameters: 12.928; 6.2741; 10.6536; 90; 90; 90;  

COD ID: 4002656
CIF file Formula: - Al1.62 Na1.62 Sn4.38 -
Comments: Kanno, Masahiro; Yamada, Takahiro; Yamane, Hisanori; Nagai, Hideaki Synthesis, Crystal Structure, and Thermoelectric Properties of Na2+xAl2+xSn4‒x(x= −0.38, ‒0.24) Chemistry of Materials 28(2) (2016) 601
Space group: P 61 2 2
Cell volume: 218.24
Cell parameters: 6.405; 6.405; 6.1427; 90; 90; 120;  

COD ID: 4002657
CIF file Formula: - Al1.76 Na1.76 Sn4.24 -
Comments: Kanno, Masahiro; Yamada, Takahiro; Yamane, Hisanori; Nagai, Hideaki Synthesis, Crystal Structure, and Thermoelectric Properties of Na2+xAl2+xSn4‒x(x= −0.38, ‒0.24) Chemistry of Materials 28(2) (2016) 601
Space group: P 61 2 2
Cell volume: 218.149
Cell parameters: 6.3984; 6.3984; 6.1529; 90; 90; 120;  

COD ID: 4002658
CIF file Formula: - Al Li O2 -
Comments: Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers Chemistry of Materials 28(3) (2016) 915
Space group: P 41 21 2
Cell volume: 171.376
Cell parameters: 5.1965; 5.1965; 6.3464; 90; 90; 90;  

COD ID: 4002659
CIF file Formula: - Al Li O2 -
Comments: Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers Chemistry of Materials 28(3) (2016) 915
Space group: P 41 21 2
Cell volume: 166.868
Cell parameters: 5.15885; 5.15885; 6.27; 90; 90; 90;  

COD ID: 4002660
CIF file Formula: - Al Li O2 -
Comments: Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers Chemistry of Materials 28(3) (2016) 915
Space group: P 41 21 2
Cell volume: 174.841
Cell parameters: 5.2252; 5.2252; 6.4038; 90; 90; 90;  

COD ID: 4002661
CIF file Formula: - O2 Sb2 Se3 Sr2 -
Comments: Panella, Jessica R.; Chamorro, Juan; McQueen, Tyrel M. Synthesis and Structure of Three New Oxychalcogenides: A2O2Bi2Se3(A = Sr, Ba) and Sr2O2Sb2Se3 Chemistry of Materials 28(3) (2016) 890
Space group: P 1 21/c 1
Cell volume: 432.809
Cell parameters: 9.42424; 4.05707; 13.34148; 90; 121.955; 90;  

COD ID: 4002662
CIF file Formula: - Bi2 O2 Se3 Sr2 -
Comments: Panella, Jessica R.; Chamorro, Juan; McQueen, Tyrel M. Synthesis and Structure of Three New Oxychalcogenides: A2O2Bi2Se3(A = Sr, Ba) and Sr2O2Sb2Se3 Chemistry of Materials 28(3) (2016) 890
Space group: P 1 21/c 1
Cell volume: 437.984
Cell parameters: 9.49954; 4.084794; 13.43734; 90; 122.861; 90;  

COD ID: 4002663
CIF file Formula: - Ba2 Bi2 O2 Se3 -
Comments: Panella, Jessica R.; Chamorro, Juan; McQueen, Tyrel M. Synthesis and Structure of Three New Oxychalcogenides: A2O2Bi2Se3(A = Sr, Ba) and Sr2O2Sb2Se3 Chemistry of Materials 28(3) (2016) 890
Space group: P 1 21/c 1
Cell volume: 476.073
Cell parameters: 9.82047; 4.19033; 13.90442; 90; 123.692; 90;  

COD ID: 4002664
CIF file Formula: - Al156 Ca75.04 Li42.05 N220 -
Comments: Wagatha, Peter; Pust, Philipp; Weiler, Volker; Wochnik, Angela S.; Schmidt, Peter J.; Scheu, Christina; Schnick, Wolfgang Ca18.75Li10.5[Al39N55]:Eu2+—Supertetrahedron Phosphor for Solid-State Lighting Chemistry of Materials 28(4) (2016) 1220
Space group: F d -3 m :2
Cell volume: 11262
Cell parameters: 22.415; 22.415; 22.415; 90; 90; 90;  

COD ID: 4002665
CIF file Formula: - C210 H175 Au25 Cl2 F6 P10 Sb Se5 -
Comments: Song, Yongbo; Jin, Shan; Kang, Xi; Xiang, Ji; Deng, Huijuan; Yu, Haizhu; Zhu, Manzhou How a Single Electron Affects the Properties of the “Non-Superatom” Au25Nanoclusters Chemistry of Materials 28(8) (2016) 2609
Space group: P n m a
Cell volume: 25605
Cell parameters: 30.927; 26.416; 31.341; 90; 90; 90;  

COD ID: 4002666
CIF file Formula: - C234 H195 Au25 B Cl2 F6 P10 Sb Se5 -
Comments: Song, Yongbo; Jin, Shan; Kang, Xi; Xiang, Ji; Deng, Huijuan; Yu, Haizhu; Zhu, Manzhou How a Single Electron Affects the Properties of the “Non-Superatom” Au25Nanoclusters Chemistry of Materials 28(8) (2016) 2609
Space group: P 1 21/c 1
Cell volume: 23842
Cell parameters: 27.378; 29.361; 40.7368; 90; 133.273; 90;  

COD ID: 4002667
CIF file Formula: - C14 H20 I4 N2 Pb -
Comments: Kamminga, Machteld E.; Fang, Hong-Hua; Filip, Marina R.; Giustino, Feliciano; Baas, Jacob; Blake, Graeme R.; Loi, Maria Antonietta; Palstra, Thomas T. M. Confinement Effects in Low-Dimensional Lead Iodide Perovskite Hybrids Chemistry of Materials 28(13) (2016) 4554
Space group: P b c a
Cell volume: 2234.67
Cell parameters: 9.1111; 8.6338; 28.408; 90; 90; 90;  

COD ID: 4002668
CIF file Formula: - C30 H48 I7 N3 Pb2 -
Comments: Kamminga, Machteld E.; Fang, Hong-Hua; Filip, Marina R.; Giustino, Feliciano; Baas, Jacob; Blake, Graeme R.; Loi, Maria Antonietta; Palstra, Thomas T. M. Confinement Effects in Low-Dimensional Lead Iodide Perovskite Hybrids Chemistry of Materials 28(13) (2016) 4554
Space group: P -1
Cell volume: 2234.9
Cell parameters: 8.7068; 15.9947; 16.7613; 73.823; 85.57; 88.01;  

COD ID: 4002669
CIF file Formula: - C54 H84 I14 N6 Pb4 -
Comments: Kamminga, Machteld E.; Fang, Hong-Hua; Filip, Marina R.; Giustino, Feliciano; Baas, Jacob; Blake, Graeme R.; Loi, Maria Antonietta; Palstra, Thomas T. M. Confinement Effects in Low-Dimensional Lead Iodide Perovskite Hybrids Chemistry of Materials 28(13) (2016) 4554
Space group: P c a 21
Cell volume: 8445.9
Cell parameters: 8.5278; 29.824; 33.208; 90; 90; 90;  

COD ID: 4002670
CIF file Formula: - Cl La3 P6 Zn4 -
Comments: Wang, Jian; Kaseman, Derrick; Lee, Kathleen; Sen, Sabyasachi; Kovnir, Kirill Enclathration of X@La4Tetrahedra in Channels of Zn‒P Frameworks in La3Zn4P6X (X = Cl, Br) Chemistry of Materials 28(13) (2016) 4741
Space group: C m c m
Cell volume: 1191.8
Cell parameters: 4.0576; 13.6319; 21.547; 90; 90; 90;  

COD ID: 4002671
CIF file Formula: - C24 H92 Ca Cu6 N6 O53 -
Comments: Grancha, Thais; Ferrando-Soria, Jesús; Cano, Joan; Amorós, Pedro; Seoane, Beatriz; Gascon, Jorge; Bazaga-García, Montse; Losilla, Enrique R.; Cabeza, Aurelio; Armentano, Donatella; Pardo, Emilio Insights into the Dynamics of Grotthuss Mechanism in a Proton-Conducting ChiralbioMOF Chemistry of Materials 28(13) (2016) 4608
Space group: P 63
Cell volume: 3604.1
Cell parameters: 17.6943; 17.6943; 13.2921; 90; 90; 120;  

COD ID: 4002672
CIF file Formula: - Ba14 Mn1.75 O42 Ta10.5 -
Comments: Tao, Fengqiong; Genevois, Cécile; Lu, Fengqi; Kuang, Xiaojun; Porcher, Florence; Li, Liangju; Yang, Tao; Li, Wenbo; Zhou, Di; Allix, Mathieu First 14-Layer Twinned Hexagonal Perovskite Ba14Mn1.75Ta10.5O42: Atomic-Scale Imaging of Cation Ordering Chemistry of Materials 28(13) (2016) 4686
Space group: P 63 c m
Cell volume: 2941.48
Cell parameters: 10.07782; 10.07782; 33.44271; 90; 90; 120;  

COD ID: 4002673
CIF file Formula: - Ba14 Mn1.75 O42 Ta10.5 -
Comments: Tao, Fengqiong; Genevois, Cécile; Lu, Fengqi; Kuang, Xiaojun; Porcher, Florence; Li, Liangju; Yang, Tao; Li, Wenbo; Zhou, Di; Allix, Mathieu First 14-Layer Twinned Hexagonal Perovskite Ba14Mn1.75Ta10.5O42: Atomic-Scale Imaging of Cation Ordering Chemistry of Materials 28(13) (2016) 4686
Space group: P 63/m m c
Cell volume: 980.538
Cell parameters: 5.818857; 5.818857; 33.43938; 90; 90; 120;  

COD ID: 4002674
CIF file Formula: - B5 Be2 F O12 Sr3 -
Comments: Yu, Na; Wang, Shichao; Ye, Ning; Liang, Fei; Lin, Zheshuai; Luo, Min; Poeppelmeier, Kenneth R. A Deep-Ultraviolet Nonlinear Optical Crystal: Strontium Beryllium Borate Fluoride with Planar Be(O/F)3Groups Chemistry of Materials 28(13) (2016) 4563
Space group: R 3 m :H
Cell volume: 774.06
Cell parameters: 10.3179; 10.3179; 8.3958; 90; 90; 120;  

COD ID: 4002675
CIF file Formula: - C3.38 H0.12 Cl Cu N0.25 -
Comments: Ferreira, Cauê F.; Pérez-Cordero, Eduardo E.; Abboud, Khalil A.; Talham, Daniel R. Reversible Medium-Dependent Solid‒Solid Phase Transformations in Two-Dimensional Hybrid Perovskites Chemistry of Materials 28(15) (2016) 5522
Space group: I -4
Cell volume: 2206.3
Cell parameters: 7.4676; 7.4676; 39.564; 90; 90; 90;  

COD ID: 4002676
CIF file Formula: - C12 H32 Cl4 Cu N2 -
Comments: Ferreira, Cauê F.; Pérez-Cordero, Eduardo E.; Abboud, Khalil A.; Talham, Daniel R. Reversible Medium-Dependent Solid‒Solid Phase Transformations in Two-Dimensional Hybrid Perovskites Chemistry of Materials 28(15) (2016) 5522
Space group: P -1
Cell volume: 2002.43
Cell parameters: 10.4935; 10.5081; 18.6574; 81.916; 79.455; 88.315;  

COD ID: 4002677
CIF file Formula: - C58 H72 N2 O2 S6 -
Comments: Huang, Chi-Feng; Wu, San-Lien; Huang, Yi-Fan; Chen, Ying-Cheng; Chang, Shu-Ting; Wu, Tzu-Yi; Wu, Kuan-Yi; Chuang, Wei-Tsung; Wang, Chien-Lung Packing Principles for Donor‒Acceptor Oligomers from Analysis of Single Crystals Chemistry of Materials 28(15) (2016) 5175
Space group: P -1
Cell volume: 1340.3
Cell parameters: 9.7756; 10.5354; 14.2909; 80.888; 87.554; 67.288;  

COD ID: 4002678
CIF file Formula: - C4 H14 Cl4 F2 N2 Pb -
Comments: Lermer, Claudia; Birkhold, Susanne T.; Moudrakovski, Igor L.; Mayer, Peter; Schoop, Leslie M.; Schmidt-Mende, Lukas; Lotsch, Bettina V. Toward Fluorinated Spacers for MAPI-Derived Hybrid Perovskites: Synthesis, Characterization, and Phase Transitions of (FC2H4NH3)2PbCl4 Chemistry of Materials 28(18) (2016) 6560
Space group: P n m a
Cell volume: 1244.88
Cell parameters: 7.7059; 18.4574; 8.7525; 90; 90; 90;  

COD ID: 4002679
CIF file Formula: - C5 H14 Br3 F N2 O Pb -
Comments: Lermer, Claudia; Birkhold, Susanne T.; Moudrakovski, Igor L.; Mayer, Peter; Schoop, Leslie M.; Schmidt-Mende, Lukas; Lotsch, Bettina V. Toward Fluorinated Spacers for MAPI-Derived Hybrid Perovskites: Synthesis, Characterization, and Phase Transitions of (FC2H4NH3)2PbCl4 Chemistry of Materials 28(18) (2016) 6560
Space group: P -1
Cell volume: 674.11
Cell parameters: 4.4434; 11.2688; 13.7677; 83.8913; 81.48; 83.1354;  

COD ID: 4002680
CIF file Formula: - C48 H96 Bi7 I24 Na3 O12 -
Comments: Hamdeh, Umar H.; Nelson, Rainie D.; Ryan, Bradley J.; Bhattacharjee, Ujjal; Petrich, Jacob W.; Panthani, Matthew G. Solution-Processed BiI3Thin Films for Photovoltaic Applications: Improved Carrier Collection via Solvent Annealing Chemistry of Materials 28(18) (2016) 6567
Space group: R -3 m :H
Cell volume: 10801
Cell parameters: 27.88; 27.88; 16.0459; 90; 90; 120;  

COD ID: 4002681
CIF file Formula: - C24 H56 Bi4 I12 N8 O8 -
Comments: Hamdeh, Umar H.; Nelson, Rainie D.; Ryan, Bradley J.; Bhattacharjee, Ujjal; Petrich, Jacob W.; Panthani, Matthew G. Solution-Processed BiI3Thin Films for Photovoltaic Applications: Improved Carrier Collection via Solvent Annealing Chemistry of Materials 28(18) (2016) 6567
Space group: P 1 21/n 1
Cell volume: 6565.6
Cell parameters: 15.1588; 30.997; 15.7999; 90; 117.826; 90;  

COD ID: 4002682
CIF file Formula: - C21 H24 Al N7 -
Comments: Thompson, Anthony B.; Pahls, Dale R.; Bernales, Varinia; Gallington, Leighanne C.; Malonzo, Camille D.; Webber, Thomas; Tereniak, Stephen J.; Wang, Timothy C.; Desai, Sai Puneet; Li, Zhanyong; Kim, In Soo; Gagliardi, Laura; Penn, R. Lee; Chapman, Karena W.; Stein, Andreas; Farha, Omar K.; Hupp, Joseph T.; Martinson, Alex B. F.; Lu, Connie C. Installing Heterobimetallic Cobalt‒Aluminum Single Sites on a Metal Organic Framework Support Chemistry of Materials 28(18) (2016) 6753
Space group: P 1 21/n 1
Cell volume: 2048.53
Cell parameters: 8.3699; 10.7774; 22.7215; 90; 91.857; 90;  

COD ID: 4002683
CIF file Formula: - C21 H24 Al Cl Co N7 -
Comments: Thompson, Anthony B.; Pahls, Dale R.; Bernales, Varinia; Gallington, Leighanne C.; Malonzo, Camille D.; Webber, Thomas; Tereniak, Stephen J.; Wang, Timothy C.; Desai, Sai Puneet; Li, Zhanyong; Kim, In Soo; Gagliardi, Laura; Penn, R. Lee; Chapman, Karena W.; Stein, Andreas; Farha, Omar K.; Hupp, Joseph T.; Martinson, Alex B. F.; Lu, Connie C. Installing Heterobimetallic Cobalt‒Aluminum Single Sites on a Metal Organic Framework Support Chemistry of Materials 28(18) (2016) 6753
Space group: P 1 21/n 1
Cell volume: 2124.3
Cell parameters: 14.511; 9.9585; 15.004; 90; 101.548; 90;  

COD ID: 4002684
CIF file Formula: - C28 H33 Al Co N7 -
Comments: Thompson, Anthony B.; Pahls, Dale R.; Bernales, Varinia; Gallington, Leighanne C.; Malonzo, Camille D.; Webber, Thomas; Tereniak, Stephen J.; Wang, Timothy C.; Desai, Sai Puneet; Li, Zhanyong; Kim, In Soo; Gagliardi, Laura; Penn, R. Lee; Chapman, Karena W.; Stein, Andreas; Farha, Omar K.; Hupp, Joseph T.; Martinson, Alex B. F.; Lu, Connie C. Installing Heterobimetallic Cobalt‒Aluminum Single Sites on a Metal Organic Framework Support Chemistry of Materials 28(18) (2016) 6753
Space group: P -1
Cell volume: 1329.4
Cell parameters: 9.3796; 10.578; 14.373; 78.924; 72.613; 81.559;  

COD ID: 4002685
CIF file Formula: - C27 H29 Al Co N7 O -
Comments: Thompson, Anthony B.; Pahls, Dale R.; Bernales, Varinia; Gallington, Leighanne C.; Malonzo, Camille D.; Webber, Thomas; Tereniak, Stephen J.; Wang, Timothy C.; Desai, Sai Puneet; Li, Zhanyong; Kim, In Soo; Gagliardi, Laura; Penn, R. Lee; Chapman, Karena W.; Stein, Andreas; Farha, Omar K.; Hupp, Joseph T.; Martinson, Alex B. F.; Lu, Connie C. Installing Heterobimetallic Cobalt‒Aluminum Single Sites on a Metal Organic Framework Support Chemistry of Materials 28(18) (2016) 6753
Space group: P 21 21 21
Cell volume: 2513.3
Cell parameters: 10.724; 15.309; 15.309; 90; 90; 90;  

COD ID: 4002686
CIF file Formula: - Al3.94 Ce0.03 Mg4.06 N8 Sr1.97 -
Comments: Leano, Julius; Lin, Shing-Ying; Mahlik, Sebastian; Grinberg, Marek; Liang, Chaolun; Zhou, Wuzong; Molokeev, Maxim; Atuchin, Victor; Tsai, Yi-Ting; Lin, Cun Che; Sheu, Hwo-Shuenn; Liu, Ru-Shi Green Light-excitable Ce-doped Nitridomagnesoaluminate Sr[Mg2Al2N4] Phosphor for White Light-emitting Diodes Chemistry of Materials 28(19) (2016) 6822-6825
Space group: I 4/m
Cell volume: 224.468
Cell parameters: 8.176483; 8.176483; 3.35754; 90; 90; 90;  

COD ID: 4002689
CIF file Formula: - C26 H30 N2 O2 S2 -
Comments: Zhang, Zhiyun; Chen, Yi-An; Hung, Wen-Yi; Tang, Wei-Feng; Hsu, Yen-Hao; Chen, Chi-Lin; Meng, Fan-Yi; Chou, Pi-Tai Control of the Reversibility of Excited-State Intramolecular Proton Transfer (ESIPT) Reaction: Host-Polarity Tuning White Organic Light Emitting Diode on a New Thiazolo[5,4-d]thiazole ESIPT System Chemistry of Materials 28(23) (2016) 8815
Space group: P 1 21/n 1
Cell volume: 1173.82
Cell parameters: 10.3481; 11.3487; 10.7207; 90; 111.199; 90;  

COD ID: 4002690
CIF file Formula: - C25 H28 N2 O2 S2 -
Comments: Zhang, Zhiyun; Chen, Yi-An; Hung, Wen-Yi; Tang, Wei-Feng; Hsu, Yen-Hao; Chen, Chi-Lin; Meng, Fan-Yi; Chou, Pi-Tai Control of the Reversibility of Excited-State Intramolecular Proton Transfer (ESIPT) Reaction: Host-Polarity Tuning White Organic Light Emitting Diode on a New Thiazolo[5,4-d]thiazole ESIPT System Chemistry of Materials 28(23) (2016) 8815
Space group: P -1
Cell volume: 1119.12
Cell parameters: 9.8522; 10.8009; 11.8811; 116.941; 95.0276; 91.8151;  

COD ID: 4002691
CIF file Formula: - C14.69 H8.69 Ca O6 S -
Comments: Plonka, Anna M.; Chen, Xianyin; Wang, Hao; Krishna, Rajamani; Dong, Xinglong; Banerjee, Debasis; Woerner, William R.; Han, Yu; Li, Jing; Parise, John B. Light Hydrocarbon Adsorption Mechanisms in Two Calcium-Based Microporous Metal Organic Frameworks Chemistry of Materials 28(6) (2016) 1636-1646
Space group: P 1 21/n 1
Cell volume: 1460.16
Cell parameters: 11.6583; 5.5671; 22.911; 90; 100.901; 90;  

COD ID: 4002692
CIF file Formula: - C14.67 H9.35 Ca O6 S -
Comments: Plonka, Anna M.; Chen, Xianyin; Wang, Hao; Krishna, Rajamani; Dong, Xinglong; Banerjee, Debasis; Woerner, William R.; Han, Yu; Li, Jing; Parise, John B. Light Hydrocarbon Adsorption Mechanisms in Two Calcium-Based Microporous Metal Organic Frameworks Chemistry of Materials 28(6) (2016) 1636-1646
Space group: P 1 21/n 1
Cell volume: 1451.93
Cell parameters: 11.5955; 5.5581; 22.9548; 90; 101.062; 90;  

COD ID: 4002693
CIF file Formula: - C14.86 H10.58 Ca O6 S -
Comments: Plonka, Anna M.; Chen, Xianyin; Wang, Hao; Krishna, Rajamani; Dong, Xinglong; Banerjee, Debasis; Woerner, William R.; Han, Yu; Li, Jing; Parise, John B. Light Hydrocarbon Adsorption Mechanisms in Two Calcium-Based Microporous Metal Organic Frameworks Chemistry of Materials 28(6) (2016) 1636-1646
Space group: P 1 21/n 1
Cell volume: 1460
Cell parameters: 11.6667; 5.5586; 22.935; 90; 101.011; 90;  

COD ID: 4002694
CIF file Formula: - C37.5 H23.5 Ca O8 -
Comments: Plonka, Anna M.; Chen, Xianyin; Wang, Hao; Krishna, Rajamani; Dong, Xinglong; Banerjee, Debasis; Woerner, William R.; Han, Yu; Li, Jing; Parise, John B. Light Hydrocarbon Adsorption Mechanisms in Two Calcium-Based Microporous Metal Organic Frameworks Chemistry of Materials 28(6) (2016) 1636-1646
Space group: P -1
Cell volume: 831.44
Cell parameters: 5.1634; 10.5518; 15.4849; 82.725; 87.233; 83.782;  

COD ID: 4002695
CIF file Formula: - C36.93 H25.86 Ca O8 -
Comments: Plonka, Anna M.; Chen, Xianyin; Wang, Hao; Krishna, Rajamani; Dong, Xinglong; Banerjee, Debasis; Woerner, William R.; Han, Yu; Li, Jing; Parise, John B. Light Hydrocarbon Adsorption Mechanisms in Two Calcium-Based Microporous Metal Organic Frameworks Chemistry of Materials 28(6) (2016) 1636-1646
Space group: P -1
Cell volume: 828.67
Cell parameters: 5.1803; 10.6508; 15.2914; 82.591; 85.945; 82.739;  

COD ID: 4002696
CIF file Formula: - C37.16 H29.47 Ca O8 -
Comments: Plonka, Anna M.; Chen, Xianyin; Wang, Hao; Krishna, Rajamani; Dong, Xinglong; Banerjee, Debasis; Woerner, William R.; Han, Yu; Li, Jing; Parise, John B. Light Hydrocarbon Adsorption Mechanisms in Two Calcium-Based Microporous Metal Organic Frameworks Chemistry of Materials 28(6) (2016) 1636-1646
Space group: P -1
Cell volume: 833.14
Cell parameters: 5.2195; 10.5691; 15.3604; 82.533; 86.657; 83;  

COD ID: 4003191
CIF file Formula: - C12 H6 O6 Sc -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6230.5
Cell parameters: 8.7442; 20.7536; 34.333; 90; 90; 90;  

COD ID: 4003192
CIF file Formula: - C12 H6 O6 Sc -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6268
Cell parameters: 8.777; 20.772; 34.38; 90; 90; 90;  

COD ID: 4003193
CIF file Formula: - C24 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6178
Cell parameters: 8.681; 20.723; 34.341; 90; 90; 90;  

COD ID: 4003194
CIF file Formula: - C25.8 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6232
Cell parameters: 8.7561; 20.752; 34.297; 90; 90; 90;  

COD ID: 4003195
CIF file Formula: - C30 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6169.1
Cell parameters: 8.7373; 20.691; 34.124; 90; 90; 90;  

COD ID: 4003196
CIF file Formula: - C29 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6188.1
Cell parameters: 8.7185; 20.7142; 34.265; 90; 90; 90;  

COD ID: 4003197
CIF file Formula: - C24 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6225.5
Cell parameters: 8.7578; 20.7293; 34.292; 90; 90; 90;  

COD ID: 4003198
CIF file Formula: - C30 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6202.8
Cell parameters: 8.7745; 20.668; 34.203; 90; 90; 90;  

COD ID: 4003199
CIF file Formula: - C30 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6165.4
Cell parameters: 8.6945; 20.808; 34.079; 90; 90; 90;  

COD ID: 4003200
CIF file Formula: - C30 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6165.4
Cell parameters: 8.6945; 20.808; 34.079; 90; 90; 90;  

COD ID: 4003201
CIF file Formula: - C28.5 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6243
Cell parameters: 8.779; 20.742; 34.287; 90; 90; 90;  

COD ID: 4003202
CIF file Formula: - C30 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6243
Cell parameters: 8.779; 20.742; 34.287; 90; 90; 90;  

COD ID: 4003203
CIF file Formula: - C30 H12 O12 Sc2 -
Comments: McKellar, Scott C.; Sotelo, Jorge; Greenaway, Alex; Mowat, John P. S.; Kvam, Odin; Morrison, Carole A.; Wright, Paul A.; Moggach, Stephen A. Pore Shape Modification of a Microporous Metal‒Organic Framework Using High Pressure: Accessing a New Phase with Oversized Guest Molecules Chemistry of Materials 28(2) (2016) 466
Space group: F d d d :2
Cell volume: 6243
Cell parameters: 8.779; 20.742; 34.287; 90; 90; 90;  

COD ID: 4003216
CIF file Formula: - C33 H24 Cu3 N6 O18 -
Comments: Ju, Zhanfeng; Yan, Shichen; Yuan, Daqiang De Novo Tailoring Pore Morphologies and Sizes for Different Substrates in a Urea-Containing MOFs Catalytic Platform Chemistry of Materials 28(7) (2016) 2000
Space group: I 4/m
Cell volume: 41091.2
Cell parameters: 30.4638; 30.4638; 44.2772; 90; 90; 90;  

COD ID: 4003217
CIF file Formula: - C33 H24 N6 O18 Zn3 -
Comments: Ju, Zhanfeng; Yan, Shichen; Yuan, Daqiang De Novo Tailoring Pore Morphologies and Sizes for Different Substrates in a Urea-Containing MOFs Catalytic Platform Chemistry of Materials 28(7) (2016) 2000
Space group: I 4/m
Cell volume: 41944
Cell parameters: 30.5919; 30.5919; 44.8181; 90; 90; 90;  

COD ID: 4003218
CIF file Formula: - C60 H42 N12 O19 Zn4 -
Comments: Ju, Zhanfeng; Yan, Shichen; Yuan, Daqiang De Novo Tailoring Pore Morphologies and Sizes for Different Substrates in a Urea-Containing MOFs Catalytic Platform Chemistry of Materials 28(7) (2016) 2000
Space group: P a -3
Cell volume: 39235.7
Cell parameters: 33.9803; 33.9803; 33.9803; 90; 90; 90;  

COD ID: 4003219
CIF file Formula: - C60 H48 In3 N12 O22 -
Comments: Ju, Zhanfeng; Yan, Shichen; Yuan, Daqiang De Novo Tailoring Pore Morphologies and Sizes for Different Substrates in a Urea-Containing MOFs Catalytic Platform Chemistry of Materials 28(7) (2016) 2000
Space group: P 31 2 1
Cell volume: 28646.7
Cell parameters: 24.4186; 24.4186; 55.4757; 90; 90; 120;  

COD ID: 4003220
CIF file Formula: - C136 H96 Mn7 N6 O48 -
Comments: Zhang, Zhongyue; Yoshikawa, Hirofumi; Awaga, Kunio Discovery of a “Bipolar Charging” Mechanism in the Solid-State Electrochemical Process of a Flexible Metal‒Organic Framework Chemistry of Materials 28(5) (2016) 1298
Space group: P -1
Cell volume: 3423
Cell parameters: 14.691; 14.818; 17.713; 98.13; 93.1; 115.29;  

COD ID: 4003221
CIF file Formula: - C130 H78 Mn7 N4 O48 -
Comments: Zhang, Zhongyue; Yoshikawa, Hirofumi; Awaga, Kunio Discovery of a “Bipolar Charging” Mechanism in the Solid-State Electrochemical Process of a Flexible Metal‒Organic Framework Chemistry of Materials 28(5) (2016) 1298
Space group: P -1
Cell volume: 4542
Cell parameters: 14.615; 16.585; 20.559; 99.33; 107.46; 100.74;  

COD ID: 4003222
CIF file Formula: - C7 H D11.14 Fe O3 -
Comments: Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R. Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn) Chemistry of Materials 28(4) (2016) 1128
Space group: P 32 2 1
Cell volume: 2840.9
Cell parameters: 21.847; 21.847; 6.8729; 90; 90; 120;  

COD ID: 4003223
CIF file Formula: - C7 H D3.74 Fe O3 -
Comments: Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R. Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn) Chemistry of Materials 28(4) (2016) 1128
Space group: P 32 2 1
Cell volume: 2829.1
Cell parameters: 21.831; 21.831; 6.8543; 90; 90; 120;  

COD ID: 4003224
CIF file Formula: - C7 H D7.64 Fe O3 -
Comments: Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R. Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn) Chemistry of Materials 28(4) (2016) 1128
Space group: P 32 2 1
Cell volume: 2830.4
Cell parameters: 21.813; 21.813; 6.8688; 90; 90; 120;  

COD ID: 4003225
CIF file Formula: - C24 H28 Co2 N2 O8 -
Comments: Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R. Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn) Chemistry of Materials 28(4) (2016) 1128
Space group: P 32 2 1
Cell volume: 2791.93
Cell parameters: 21.7036; 21.7036; 6.844; 90; 90; 120;  

COD ID: 4003226
CIF file Formula: - C7 H0.98 D2.02 Fe O3 -
Comments: Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R. Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn) Chemistry of Materials 28(4) (2016) 1128
Space group: P 32 2 1
Cell volume: 2816.6
Cell parameters: 21.848; 21.848; 6.8136; 90; 90; 120;  

COD ID: 4003227
CIF file Formula: - C7 H D5.2 Fe O3 -
Comments: Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R. Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn) Chemistry of Materials 28(4) (2016) 1128
Space group: P 32 2 1
Cell volume: 2833.2
Cell parameters: 21.823; 21.823; 6.8695; 90; 90; 120;  

COD ID: 4003228
CIF file Formula: - C22 H22 N2 O4 -
Comments: Fu, Chaoying; Lin, Hua-ping; Macleod, Jennifer M.; Krayev, Andrey; Rosei, Federico; Perepichka, Dmitrii F. Unravelling the Self-Assembly of Hydrogen Bonded NDI Semiconductors in 2D and 3D Chemistry of Materials 28(3) (2016) 951
Space group: P 1 21/c 1
Cell volume: 1793.8
Cell parameters: 4.7647; 7.7093; 48.853; 90; 91.616; 90;  

COD ID: 4003229
CIF file Formula: - C20 H42 N4 O2 W -
Comments: Mouat, Aidan R.; Mane, Anil U.; Elam, Jeffrey W.; Delferro, Massimiliano; Marks, Tobin J.; Stair, Peter C. Volatile Hexavalent Oxo-amidinate Complexes: Molybdenum and Tungsten Precursors for Atomic Layer Deposition Chemistry of Materials 28(6) (2016) 1907
Space group: P 1 21/n 1
Cell volume: 2387.6
Cell parameters: 10.122; 16.708; 14.856; 90; 108.14; 90;  

COD ID: 4003230
CIF file Formula: - C20 H42 Mo N4 O2 -
Comments: Mouat, Aidan R.; Mane, Anil U.; Elam, Jeffrey W.; Delferro, Massimiliano; Marks, Tobin J.; Stair, Peter C. Volatile Hexavalent Oxo-amidinate Complexes: Molybdenum and Tungsten Precursors for Atomic Layer Deposition Chemistry of Materials 28(6) (2016) 1907
Space group: P 1 21/n 1
Cell volume: 2396.1
Cell parameters: 10.129; 16.708; 14.87; 90; 107.8; 90;  

COD ID: 4003231
CIF file Formula: - C25 H53 N4 O4 W2 -
Comments: Mouat, Aidan R.; Mane, Anil U.; Elam, Jeffrey W.; Delferro, Massimiliano; Marks, Tobin J.; Stair, Peter C. Volatile Hexavalent Oxo-amidinate Complexes: Molybdenum and Tungsten Precursors for Atomic Layer Deposition Chemistry of Materials 28(6) (2016) 1907
Space group: P 1 21/n 1
Cell volume: 3312.7
Cell parameters: 10.76; 24.074; 12.908; 90; 97.8; 90;  

COD ID: 4003232
CIF file Formula: - C3 Ca2 F Na3 O9 -
Comments: Luo, Min; Song, Yunxia; Lin, Chensheng; Ye, Ning; Cheng, Wendan; Long, XiFa Molecular Engineering as an Approach To Design a New Beryllium-Free Fluoride Carbonate as a Deep-Ultraviolet Nonlinear Optical Material Chemistry of Materials 28(7) (2016) 2301
Space group: C 1 m 1
Cell volume: 444.32
Cell parameters: 8.0892; 15.9002; 3.5273; 90; 101.662; 90;  

COD ID: 4003233
CIF file Formula: - C6 I5 Pb2 S4 -
Comments: Evans, Hayden A.; Lehner, Anna J.; Labram, John G.; Fabini, Douglas H.; Barreda, Omar; Smock, Sara R.; Wu, Guang; Chabinyc, Michael L.; Seshadri, Ram; Wudl, Fred (TTF)Pb2I5: A Radical Cation-Stabilized Hybrid Lead Iodide with Synergistic Optoelectronic Signatures Chemistry of Materials 28(11) (2016) 3607
Space group: P 1 21/c 1
Cell volume: 2047
Cell parameters: 12.9; 7.972; 20.23; 90; 100.25; 90;  

COD ID: 4003234
CIF file Formula: - C9 H30 I7 N3 Pb2 -
Comments: Stoumpos, Constantinos C.; Cao, Duyen H.; Clark, Daniel J.; Young, Joshua; Rondinelli, James M.; Jang, Joon I.; Hupp, Joseph T.; Kanatzidis, Mercouri G. Ruddlesden‒Popper Hybrid Lead Iodide Perovskite 2D Homologous Semiconductors Chemistry of Materials 28(8) (2016) 2852
Space group: C c 2 m
Cell volume: 3118.7
Cell parameters: 8.947; 39.347; 8.8589; 90; 90; 90;  

COD ID: 4003235
CIF file Formula: - C10 H36 I10 N4 Pb3 -
Comments: Stoumpos, Constantinos C.; Cao, Duyen H.; Clark, Daniel J.; Young, Joshua; Rondinelli, James M.; Jang, Joon I.; Hupp, Joseph T.; Kanatzidis, Mercouri G. Ruddlesden‒Popper Hybrid Lead Iodide Perovskite 2D Homologous Semiconductors Chemistry of Materials 28(8) (2016) 2852
Space group: C 2 e b
Cell volume: 4118
Cell parameters: 8.9275; 51.959; 8.8777; 90; 90; 90;  

COD ID: 4003236
CIF file Formula: - C11 H42 I13 N5 Pb4 -
Comments: Stoumpos, Constantinos C.; Cao, Duyen H.; Clark, Daniel J.; Young, Joshua; Rondinelli, James M.; Jang, Joon I.; Hupp, Joseph T.; Kanatzidis, Mercouri G. Ruddlesden‒Popper Hybrid Lead Iodide Perovskite 2D Homologous Semiconductors Chemistry of Materials 28(8) (2016) 2852
Space group: C c 2 m
Cell volume: 5104.9
Cell parameters: 8.9274; 64.383; 8.8816; 90; 90; 90;  

COD ID: 4003237
CIF file Formula: - C64 H60 Cl4 F2 N4 O8 -
Comments: Chen, Hu; Bryant, Daniel; Troughton, Joel; Kirkus, Mindaugas; Neophytou, Marios; Miao, Xiaohe; Durrant, James R.; McCulloch, Iain One-Step Facile Synthesis of a Simple Hole Transport Material for Efficient Perovskite Solar Cells Chemistry of Materials 28(8) (2016) 2515
Space group: P 1 21/n 1
Cell volume: 2903.3
Cell parameters: 12.2088; 19.5943; 12.295; 90; 99.209; 90;  

COD ID: 4003238
CIF file Formula: - C19 H18 N2 O6 S -
Comments: Hall, Victoria M.; Cox, Kristin A.; Sours, Ryan E.; Swift, Jennifer A. Urochrome Pigment in Uric Acid Crystals Chemistry of Materials 28(11) (2016) 3862
Space group: P b c a
Cell volume: 3641.6
Cell parameters: 20.1106; 7.3879; 24.51; 90; 90; 90;  

COD ID: 4003239
CIF file Formula: - C8 H26 I8 N4 O2 Pb3 -
Comments: Umeyama, Daiki; Lin, Yu; Karunadasa, Hemamala I. Red-to-Black Piezochromism in a Compressible Pb‒I‒SCN Layered Perovskite Chemistry of Materials 28(10) (2016) 3241
Space group: P n n m
Cell volume: 1700.31
Cell parameters: 17.1512; 21.8564; 4.5358; 90; 90; 90;  

COD ID: 4003240
CIF file Formula: - C10 H10 N2 O8 S2 Zn -
Comments: Ogiwara, Naoki; Inukai, Munehiro; Itakura, Tomoya; Horike, Satoshi; Kitagawa, Susumu Fast Conduction of Organic Cations in Metal Sulfate Frameworks Chemistry of Materials 28(11) (2016) 3968
Space group: P -1
Cell volume: 689.2
Cell parameters: 8.533; 8.835; 10.245; 76.559; 66.59; 85.826;  

COD ID: 4003241
CIF file Formula: - C12 H22 N4 O8 S2 Zn -
Comments: Ogiwara, Naoki; Inukai, Munehiro; Itakura, Tomoya; Horike, Satoshi; Kitagawa, Susumu Fast Conduction of Organic Cations in Metal Sulfate Frameworks Chemistry of Materials 28(11) (2016) 3968
Space group: P 42/n :2
Cell volume: 1883
Cell parameters: 14.352; 14.352; 9.142; 90; 90; 90;  

COD ID: 4003242
CIF file Formula: - C12 H22 N4 O8 S2 Zn -
Comments: Ogiwara, Naoki; Inukai, Munehiro; Itakura, Tomoya; Horike, Satoshi; Kitagawa, Susumu Fast Conduction of Organic Cations in Metal Sulfate Frameworks Chemistry of Materials 28(11) (2016) 3968
Space group: P 42/n :2
Cell volume: 1925.7
Cell parameters: 14.489; 14.489; 9.173; 90; 90; 90;  

COD ID: 4003243
CIF file Formula: - C4 H16 N2 O8 S2 Zn -
Comments: Ogiwara, Naoki; Inukai, Munehiro; Itakura, Tomoya; Horike, Satoshi; Kitagawa, Susumu Fast Conduction of Organic Cations in Metal Sulfate Frameworks Chemistry of Materials 28(11) (2016) 3968
Space group: C 1 2/m 1
Cell volume: 1280.1
Cell parameters: 17.309; 9.215; 9.142; 90; 118.615; 90;  

COD ID: 4003244
CIF file Formula: - C392 H512 F12 N32 O62 -
Comments: Pellach, Michal; Mondal, Sudipta; Shimon, Linda J. W.; Adler-Abramovich, Lihi; Buzhansky, Ludmila; Gazit, Ehud Molecular Engineering of Self-Assembling Diphenylalanine Analogues Results in the Formation of Distinctive Microstructures Chemistry of Materials 28(12) (2016) 4341
Space group: P 1 21 1
Cell volume: 10525
Cell parameters: 32.65; 9.5; 35.77; 90; 108.44; 90;  

COD ID: 4003245
CIF file Formula: - C20 H24 N2 O3 -
Comments: Pellach, Michal; Mondal, Sudipta; Shimon, Linda J. W.; Adler-Abramovich, Lihi; Buzhansky, Ludmila; Gazit, Ehud Molecular Engineering of Self-Assembling Diphenylalanine Analogues Results in the Formation of Distinctive Microstructures Chemistry of Materials 28(12) (2016) 4341
Space group: P 1 21 1
Cell volume: 2637
Cell parameters: 15.6387; 11.6835; 16.3316; 90; 117.909; 90;  

COD ID: 4003246
CIF file Formula: - C12 H36 Bi Cl6 N3 -
Comments: Zheng, Xiaoxin; Liu, Yang; Liu, Guangfeng; Liu, Jie; Ye, Xin; Han, Quanxiang; Ge, Chao; Tao, Xutang Crystalline Mixed Halide Halobismuthates and Their Induced Second Harmonic Generation Chemistry of Materials 28(12) (2016) 4421
Space group: R 3 c :H
Cell volume: 3574.3
Cell parameters: 14.699; 14.699; 19.102; 90; 90; 120;  

COD ID: 4003247
CIF file Formula: - C12 H36 Bi Br0.81 Cl5.19 N3 -
Comments: Zheng, Xiaoxin; Liu, Yang; Liu, Guangfeng; Liu, Jie; Ye, Xin; Han, Quanxiang; Ge, Chao; Tao, Xutang Crystalline Mixed Halide Halobismuthates and Their Induced Second Harmonic Generation Chemistry of Materials 28(12) (2016) 4421
Space group: R 3 c :H
Cell volume: 3607
Cell parameters: 14.739; 14.739; 19.17; 90; 90; 120;  

COD ID: 4003248
CIF file Formula: - C12 H36 Bi Br1.53 Cl4.47 N3 -
Comments: Zheng, Xiaoxin; Liu, Yang; Liu, Guangfeng; Liu, Jie; Ye, Xin; Han, Quanxiang; Ge, Chao; Tao, Xutang Crystalline Mixed Halide Halobismuthates and Their Induced Second Harmonic Generation Chemistry of Materials 28(12) (2016) 4421
Space group: R 3 c :H
Cell volume: 3653
Cell parameters: 14.796; 14.796; 19.268; 90; 90; 120;  

COD ID: 4003249
CIF file Formula: - C12 H36 Bi Br2.31 Cl3.69 N3 -
Comments: Zheng, Xiaoxin; Liu, Yang; Liu, Guangfeng; Liu, Jie; Ye, Xin; Han, Quanxiang; Ge, Chao; Tao, Xutang Crystalline Mixed Halide Halobismuthates and Their Induced Second Harmonic Generation Chemistry of Materials 28(12) (2016) 4421
Space group: R 3 c :H
Cell volume: 3697
Cell parameters: 14.848; 14.848; 19.363; 90; 90; 120;  

COD ID: 4003250
CIF file Formula: - C12 H36 Bi Br5.08 Cl0.92 N3 -
Comments: Zheng, Xiaoxin; Liu, Yang; Liu, Guangfeng; Liu, Jie; Ye, Xin; Han, Quanxiang; Ge, Chao; Tao, Xutang Crystalline Mixed Halide Halobismuthates and Their Induced Second Harmonic Generation Chemistry of Materials 28(12) (2016) 4421
Space group: R 3 c :H
Cell volume: 3864
Cell parameters: 15.076; 15.076; 19.631; 90; 90; 120;  

COD ID: 4003251
CIF file Formula: - C12 H36 Bi Br6 N3 -
Comments: Zheng, Xiaoxin; Liu, Yang; Liu, Guangfeng; Liu, Jie; Ye, Xin; Han, Quanxiang; Ge, Chao; Tao, Xutang Crystalline Mixed Halide Halobismuthates and Their Induced Second Harmonic Generation Chemistry of Materials 28(12) (2016) 4421
Space group: R 3 c :H
Cell volume: 3931
Cell parameters: 15.166; 15.166; 19.733; 90; 90; 120;  

COD ID: 4003252
CIF file Formula: - C4 O24 Si12 -
Comments: Santoro, Mario; Scelta, Demetrio; Dziubek, Kamil; Ceppatelli, Matteo; Gorelli, Federico A.; Bini, Roberto; Garbarino, Gaston; Thibaud, Jean-Marc; Di Renzo, Francesco; Cambon, Olivier; Hermet, Patrick; Rouquette, Jerome; van der Lee, Arie; Haines, Julien Synthesis of 1D Polymer/Zeolite Nanocomposites under High Pressure Chemistry of Materials 28(11) (2016) 4065
Space group: C m c 21
Cell volume: 1214.65
Cell parameters: 13.8553; 17.3992; 5.03855; 90; 90; 90;  

COD ID: 4003253
CIF file Formula: - C1.2 O25.2 Si12 -
Comments: Santoro, Mario; Scelta, Demetrio; Dziubek, Kamil; Ceppatelli, Matteo; Gorelli, Federico A.; Bini, Roberto; Garbarino, Gaston; Thibaud, Jean-Marc; Di Renzo, Francesco; Cambon, Olivier; Hermet, Patrick; Rouquette, Jerome; van der Lee, Arie; Haines, Julien Synthesis of 1D Polymer/Zeolite Nanocomposites under High Pressure Chemistry of Materials 28(11) (2016) 4065
Space group: C m c 21
Cell volume: 1222.62
Cell parameters: 13.8867; 17.4429; 5.04748; 90; 90; 90;  

COD ID: 4003254
CIF file Formula: - C6.13 H13.23 Al4 N1.4 O16 P3 Si -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: P -3 1 c
Cell volume: 3249.82
Cell parameters: 13.61328; 13.61328; 20.249; 90; 90; 120;  

COD ID: 4003255
CIF file Formula: - Al O4 P0.75 Si0.25 -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: P -3 1 c
Cell volume: 3239.95
Cell parameters: 13.7594; 13.7594; 19.761; 90; 90; 120;  

COD ID: 4003256
CIF file Formula: - C3.78 H8.43 Al3 N0.74 O12 P2.25 Si0.75 -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: R -3 :H
Cell volume: 7331.9
Cell parameters: 13.64075; 13.64075; 45.4999; 90; 90; 120;  

COD ID: 4003257
CIF file Formula: - Al O4 P0.75 Si0.25 -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: R -3 :H
Cell volume: 7358.4
Cell parameters: 13.7954; 13.7954; 44.6461; 90; 90; 120;  

COD ID: 4003258
CIF file Formula: - Al12 O48 P8.4 Si3.6 -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: P -3 1 c
Cell volume: 1636.87
Cell parameters: 13.8077; 13.8077; 9.9138; 90; 90; 120;  

COD ID: 4003259
CIF file Formula: - Al O4 P0.75 Si0.25 -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: R -3 :H
Cell volume: 7338.8
Cell parameters: 13.78419; 13.78419; 44.5996; 90; 90; 120;  

COD ID: 4003260
CIF file Formula: - Al O4 P0.75 Si0.25 -
Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998
Space group: R -3 :H
Cell volume: 7359.2
Cell parameters: 13.79468; 13.79468; 44.6557; 90; 90; 120;  

COD ID: 4003261
CIF file Formula: - C14 H30 N2 O10 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1001.6
Cell parameters: 9.2363; 8.0254; 13.7678; 90; 101.054; 90;  

COD ID: 4003262
CIF file Formula: - C14 H30 I2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1058.96
Cell parameters: 9.0205; 8.5963; 14.2881; 90; 107.101; 90;  

COD ID: 4003263
CIF file Formula: - C14 H30 I2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1075.28
Cell parameters: 9.0605; 8.6754; 14.2921; 90; 106.832; 90;  

COD ID: 4003264
CIF file Formula: - C14 H30 I2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1079.34
Cell parameters: 9.0683; 8.6955; 14.2945; 90; 106.751; 90;  

COD ID: 4003265
CIF file Formula: - C14 H30 I2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1054.48
Cell parameters: 9.0082; 8.5752; 14.2853; 90; 107.142; 90;  

COD ID: 4003266
CIF file Formula: - C16 H30 N2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1014.17
Cell parameters: 9.1465; 8.4358; 13.6024; 90; 104.915; 90;  

COD ID: 4003267
CIF file Formula: - C16 H30 N2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1022.22
Cell parameters: 9.1309; 8.4825; 13.6493; 90; 104.776; 90;  

COD ID: 4003268
CIF file Formula: - C14 H30 N2 O10 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1021.5
Cell parameters: 9.1488; 8.1812; 13.928; 90; 101.529; 90;  

COD ID: 4003269
CIF file Formula: - C16 H30 N2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1009.81
Cell parameters: 9.1539; 8.4091; 13.5804; 90; 104.987; 90;  

COD ID: 4003270
CIF file Formula: - C16 H30 N2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1001.06
Cell parameters: 9.1653; 8.3545; 13.5416; 90; 105.108; 90;  

COD ID: 4003271
CIF file Formula: - C14 H30 N2 O10 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 993.7
Cell parameters: 9.2668; 7.9623; 13.7151; 90; 100.907; 90;  

COD ID: 4003272
CIF file Formula: - C14 H30 I2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1069.42
Cell parameters: 9.0471; 8.647; 14.2901; 90; 106.938; 90;  

COD ID: 4003273
CIF file Formula: - C16 H30 N2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1018.87
Cell parameters: 9.1378; 8.4636; 13.6287; 90; 104.84; 90;  

COD ID: 4003274
CIF file Formula: - C16 H30 N2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1005.48
Cell parameters: 9.162; 8.3819; 13.5583; 90; 105.053; 90;  

COD ID: 4003275
CIF file Formula: - C14 H30 N2 O10 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1028.2
Cell parameters: 9.1231; 8.2311; 13.982; 90; 101.676; 90;  

COD ID: 4003276
CIF file Formula: - C14 H30 N2 O10 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1012.5
Cell parameters: 9.1902; 8.1108; 13.853; 90; 101.313; 90;  

COD ID: 4003277
CIF file Formula: - C14 H30 I2 O6 -
Comments: Engel, Emile R.; Smith, Vincent J.; Bezuidenhout, Charl X.; Barbour, Leonard J. Thermoresponsive Organic Inclusion Compounds: Modification of Thermal Expansion Behavior by Simple Guest Replacement Chemistry of Materials 28(14) (2016) 5073
Space group: P 1 21/n 1
Cell volume: 1063.34
Cell parameters: 9.0319; 8.6191; 14.286; 90; 107.033; 90;  

COD ID: 4003278
CIF file Formula: - C14 H12 S2 -
Comments: Takai, Atsuro; Chen, Zhihua; Yu, Xinge; Zhou, Nanjia; Marks, Tobin J.; Facchetti, Antonio Annulated Thienyl-Vinylene-Thienyl Building Blocks for π-Conjugated Copolymers: Ring Dimensions and Isomeric Structure Effects on π-Conjugation Length and Charge Transport Chemistry of Materials 28(16) (2016) 5772
Space group: P c c n
Cell volume: 1128.63
Cell parameters: 20.9002; 8.6559; 6.2386; 90; 90; 90;  

COD ID: 4003279
CIF file Formula: - C16 H16 S2 -
Comments: Takai, Atsuro; Chen, Zhihua; Yu, Xinge; Zhou, Nanjia; Marks, Tobin J.; Facchetti, Antonio Annulated Thienyl-Vinylene-Thienyl Building Blocks for π-Conjugated Copolymers: Ring Dimensions and Isomeric Structure Effects on π-Conjugation Length and Charge Transport Chemistry of Materials 28(16) (2016) 5772
Space group: P c c a
Cell volume: 1314
Cell parameters: 22.031; 8.6634; 6.8845; 90; 90; 90;  

COD ID: 4003280
CIF file Formula: - C14 H12 S2 -
Comments: Takai, Atsuro; Chen, Zhihua; Yu, Xinge; Zhou, Nanjia; Marks, Tobin J.; Facchetti, Antonio Annulated Thienyl-Vinylene-Thienyl Building Blocks for π-Conjugated Copolymers: Ring Dimensions and Isomeric Structure Effects on π-Conjugation Length and Charge Transport Chemistry of Materials 28(16) (2016) 5772
Space group: P 1 21/c 1
Cell volume: 573.11
Cell parameters: 10.5548; 8.0291; 6.8298; 90; 98.038; 90;  

COD ID: 4003281
CIF file Formula: - C35 H25 F6 N O2 S2 -
Comments: Kitagawa, Daichi; Okuyama, Tomohiro; Tanaka, Rika; Kobatake, Seiya Photoinduced Rapid and Explosive Fragmentation of Diarylethene Crystals Having Urethane Bonding Chemistry of Materials 28(14) (2016) 4889
Space group: P b c a
Cell volume: 6029
Cell parameters: 9.246; 10.857; 60.062; 90; 90; 90;  

COD ID: 4003282
CIF file Formula: - C36 H27 F6 N O2 S2 -
Comments: Kitagawa, Daichi; Okuyama, Tomohiro; Tanaka, Rika; Kobatake, Seiya Photoinduced Rapid and Explosive Fragmentation of Diarylethene Crystals Having Urethane Bonding Chemistry of Materials 28(14) (2016) 4889
Space group: P 1 21/c 1
Cell volume: 3204
Cell parameters: 32.197; 9.269; 10.859; 90; 98.61; 90;  

COD ID: 4003283
CIF file Formula: - C19 H28 Se -
Comments: Tsai, Che-En; Yu, Ruo-Han; Lin, Fang-Ju; Lai, Yu-Ying; Hsu, Jhih-Yang; Cheng, Sheng-Wen; Hsu, Chain-Shu; Cheng, Yen-Ju Synthesis of a 4,9-Didodecyl Angular-Shaped Naphthodiselenophene Building Block To Achieve High-Mobility Transistors Chemistry of Materials 28(14) (2016) 5121
Space group: P -1
Cell volume: 863.63
Cell parameters: 6.5409; 10.6885; 13.6742; 112.492; 94.702; 98.455;  

COD ID: 4003284
CIF file Formula: - C30 H21 N3 O -
Comments: Ando, Shinji; Fukushima, Takanori; Yamaguchi, Takeo Discrete Self-Assembly and Functionality of Guest Molecules in an Organic Framework Chemistry of Materials 28(16) (2016) 5847
Space group: P 1 21/c 1
Cell volume: 2218.9
Cell parameters: 8.84; 28.972; 9.023; 90; 106.224; 90;  

COD ID: 4003285
CIF file Formula: - C27 H16 N O -
Comments: Ando, Shinji; Fukushima, Takanori; Yamaguchi, Takeo Discrete Self-Assembly and Functionality of Guest Molecules in an Organic Framework Chemistry of Materials 28(16) (2016) 5847
Space group: P -1
Cell volume: 921.4
Cell parameters: 8.83; 8.862; 13.016; 104.659; 99.961; 104.811;  

COD ID: 4003286
CIF file Formula: - C32 H22 N2 O -
Comments: Ando, Shinji; Fukushima, Takanori; Yamaguchi, Takeo Discrete Self-Assembly and Functionality of Guest Molecules in an Organic Framework Chemistry of Materials 28(16) (2016) 5847
Space group: P -1
Cell volume: 1097.5
Cell parameters: 8.804; 9.4013; 14.585; 72.697; 86.345; 72.304;  

COD ID: 4003287
CIF file Formula: - C28 H19 N O -
Comments: Ando, Shinji; Fukushima, Takanori; Yamaguchi, Takeo Discrete Self-Assembly and Functionality of Guest Molecules in an Organic Framework Chemistry of Materials 28(16) (2016) 5847
Space group: P b c a
Cell volume: 3846.87
Cell parameters: 23.9625; 12.8754; 12.4685; 90; 90; 90;  

COD ID: 4003288
CIF file Formula: - C14.05 H8 Cd O6.05 S -
Comments: Chen, Shoushun; Lucier, Bryan E.G.; Boyle, Paul D.; Huang, Yining Understanding The Fascinating Origins of CO2 Adsorption and Dynamics in MOFs Chemistry of Materials 28(16) (2016) 5829
Space group: C 1 2/c 1
Cell volume: 2916.1
Cell parameters: 13.386; 21.482; 10.176; 90; 94.752; 90;  

COD ID: 4003289
CIF file Formula: - C14.43 H8 Cd O6.8 S -
Comments: Chen, Shoushun; Lucier, Bryan E.G.; Boyle, Paul D.; Huang, Yining Understanding The Fascinating Origins of CO2 Adsorption and Dynamics in MOFs Chemistry of Materials 28(16) (2016) 5829
Space group: C 1 2/c 1
Cell volume: 2911.9
Cell parameters: 13.391; 21.45; 10.1758; 90; 94.96; 90;  

COD ID: 4003290
CIF file Formula: - C14.45 H8 O6.89 Pb S -
Comments: Chen, Shoushun; Lucier, Bryan E.G.; Boyle, Paul D.; Huang, Yining Understanding The Fascinating Origins of CO2 Adsorption and Dynamics in MOFs Chemistry of Materials 28(16) (2016) 5829
Space group: P n m a
Cell volume: 1485.1
Cell parameters: 5.8815; 13.035; 19.371; 90; 90; 90;  

COD ID: 4003291
CIF file Formula: - C14 H8 Cd O6 S -
Comments: Chen, Shoushun; Lucier, Bryan E.G.; Boyle, Paul D.; Huang, Yining Understanding The Fascinating Origins of CO2 Adsorption and Dynamics in MOFs Chemistry of Materials 28(16) (2016) 5829
Space group: C 1 2/c 1
Cell volume: 2911.5
Cell parameters: 13.376; 21.481; 10.168; 90; 94.756; 90;  

COD ID: 4003292
CIF file Formula: - C16 H8 Br4 Fe I4 S4 Se8 -
Comments: Kawaguchi, Genta; Maesato, Mitsuhiko; Komatsu, Tokutaro; Imakubo, Tatsuro; Kiswandhi, Andhika; Graf, David; Kitagawa, Hiroshi Use of Halogen Bonding in a Molecular Solid Solution to Simultaneously Control Spin and Charge Chemistry of Materials 28(20) (2016) 7276
Space group: I b a m
Cell volume: 3653.9
Cell parameters: 7.343; 36.61; 13.592; 90; 90; 90;  

COD ID: 4003293
CIF file Formula: - C16 H8 Cl4 Ga I4 S4 Se8 -
Comments: Kawaguchi, Genta; Maesato, Mitsuhiko; Komatsu, Tokutaro; Imakubo, Tatsuro; Kiswandhi, Andhika; Graf, David; Kitagawa, Hiroshi Use of Halogen Bonding in a Molecular Solid Solution to Simultaneously Control Spin and Charge Chemistry of Materials 28(20) (2016) 7276
Space group: I b a m
Cell volume: 3571.5
Cell parameters: 7.339; 35.846; 13.576; 90; 90; 90;  

COD ID: 4003294
CIF file Formula: - C16 H8 Cl4 Fe I4 S4 Se8 -
Comments: Kawaguchi, Genta; Maesato, Mitsuhiko; Komatsu, Tokutaro; Imakubo, Tatsuro; Kiswandhi, Andhika; Graf, David; Kitagawa, Hiroshi Use of Halogen Bonding in a Molecular Solid Solution to Simultaneously Control Spin and Charge Chemistry of Materials 28(20) (2016) 7276
Space group: I b a m
Cell volume: 3565.4
Cell parameters: 7.3315; 35.801; 13.5837; 90; 90; 90;  

COD ID: 4003295
CIF file Formula: - C16 H8 Br4 Ga I4 S4 Se8 -
Comments: Kawaguchi, Genta; Maesato, Mitsuhiko; Komatsu, Tokutaro; Imakubo, Tatsuro; Kiswandhi, Andhika; Graf, David; Kitagawa, Hiroshi Use of Halogen Bonding in a Molecular Solid Solution to Simultaneously Control Spin and Charge Chemistry of Materials 28(20) (2016) 7276
Space group: I b a m
Cell volume: 3670.1
Cell parameters: 7.3519; 36.69; 13.606; 90; 90; 90;  

COD ID: 4003296
CIF file Formula: - C29.33 H26.67 Cu1.33 N5.33 O8 S2.67 -
Comments: Zhang, Guiyang; Wei, Guangfeng; Liu, Zhipan; Oliver, Scott R. J.; Fei, Honghan A Robust Sulfonate-Based Metal‒Organic Framework with Permanent Porosity for Efficient CO2 Capture and Conversion Chemistry of Materials 28(17) (2016) 6276
Space group: C 1 2 1
Cell volume: 5538
Cell parameters: 22.28; 22.2; 11.198; 90; 90.931; 90;  

COD ID: 4003297
CIF file Formula: - C3 H10 Br3 N Sn -
Comments: Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) Chemistry of Materials 28(19) (2016) 6968
Space group: P n a 21
Cell volume: 3139
Cell parameters: 15.877; 8.568; 23.078; 90; 90; 90;  

COD ID: 4003298
CIF file Formula: - C3 H10 Cl3 N Sn -
Comments: Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) Chemistry of Materials 28(19) (2016) 6968
Space group: C m c 21
Cell volume: 997.2
Cell parameters: 9.598; 8.368; 12.416; 90; 90; 90;  

COD ID: 4003299
CIF file Formula: - C3 H10 Cl3 N Sn -
Comments: Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) Chemistry of Materials 28(19) (2016) 6968
Space group: C 1 c 1
Cell volume: 956.4
Cell parameters: 9.37; 8.267; 12.355; 90; 92.172; 90;  

COD ID: 4003300
CIF file Formula: - C3 H10 Cl3 N Sn -
Comments: Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) Chemistry of Materials 28(19) (2016) 6968
Space group: C m c 21
Cell volume: 969.4
Cell parameters: 9.476; 8.29; 12.34; 90; 90; 90;  

COD ID: 4003301
CIF file Formula: - C24 H9 Fe3 N3 O16 -
Comments: Cairns, Amy J.; Eckert, Juergen; Wojtas, Lukasz; Thommes, Matthias; Wallacher, Dirk; Georgiev, Peter A.; Forster, Paul M.; Belmabkhout, Youssef; Ollivier, Jacques; Eddaoudi, Mohamed Gaining Insights on the H2‒Sorbent Interactions: Robust soc-MOF Platform as a Case Study Chemistry of Materials 28(20) (2016) 7353
Space group: P -4 3 n
Cell volume: 10579
Cell parameters: 21.9524; 21.9524; 21.9524; 90; 90; 90;  

COD ID: 4003302
CIF file Formula: - C24 H25.5 Br In3 N3 O21.25 -
Comments: Cairns, Amy J.; Eckert, Juergen; Wojtas, Lukasz; Thommes, Matthias; Wallacher, Dirk; Georgiev, Peter A.; Forster, Paul M.; Belmabkhout, Youssef; Ollivier, Jacques; Eddaoudi, Mohamed Gaining Insights on the H2‒Sorbent Interactions: Robust soc-MOF Platform as a Case Study Chemistry of Materials 28(20) (2016) 7353
Space group: P -4 3 n
Cell volume: 11319.4
Cell parameters: 22.453; 22.453; 22.453; 90; 90; 90;  

COD ID: 4003303
CIF file Formula: - C24 H15 Cl Fe3 N3 O16 -
Comments: Cairns, Amy J.; Eckert, Juergen; Wojtas, Lukasz; Thommes, Matthias; Wallacher, Dirk; Georgiev, Peter A.; Forster, Paul M.; Belmabkhout, Youssef; Ollivier, Jacques; Eddaoudi, Mohamed Gaining Insights on the H2‒Sorbent Interactions: Robust soc-MOF Platform as a Case Study Chemistry of Materials 28(20) (2016) 7353
Space group: P -4 3 n
Cell volume: 10463.2
Cell parameters: 21.872; 21.872; 21.872; 90; 90; 90;  

COD ID: 4003304
CIF file Formula: - C24 H23.7 Cl In3 N3 O20.35 -
Comments: Cairns, Amy J.; Eckert, Juergen; Wojtas, Lukasz; Thommes, Matthias; Wallacher, Dirk; Georgiev, Peter A.; Forster, Paul M.; Belmabkhout, Youssef; Ollivier, Jacques; Eddaoudi, Mohamed Gaining Insights on the H2‒Sorbent Interactions: Robust soc-MOF Platform as a Case Study Chemistry of Materials 28(20) (2016) 7353
Space group: P -4 3 n
Cell volume: 11325.4
Cell parameters: 22.457; 22.457; 22.457; 90; 90; 90;  

COD ID: 4003305
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1661.5
Cell parameters: 7.642; 14.5365; 14.957; 90; 90; 90;  

COD ID: 4003306
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1686.5
Cell parameters: 7.4503; 14.465; 15.649; 90; 90; 90;  

COD ID: 4003307
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1684.1
Cell parameters: 7.4439; 14.4725; 15.6319; 90; 90; 90;  

COD ID: 4003308
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1662.3
Cell parameters: 7.6421; 14.5416; 14.958; 90; 90; 90;  

COD ID: 4003309
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1673.4
Cell parameters: 7.425; 14.5177; 15.5242; 90; 90; 90;  

COD ID: 4003310
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1664.1
Cell parameters: 7.6459; 14.5442; 14.9647; 90; 90; 90;  

COD ID: 4003311
CIF file Formula: - C9 H11 Cr Mn N8 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1452.9
Cell parameters: 7.712; 13.401; 14.058; 90; 90; 90;  

COD ID: 4003312
CIF file Formula: - C9 H15 Cr Mn N8 O2 -
Comments: Yoshida, Yusuke; Inoue, Katsuya; Kikuchi, Koichi; Kurmoo, Mohamedally Biomimetic Transformation by a Crystal of a Chiral MnII‒CrIII Ferrimagnetic Prussian Blue Analogue Chemistry of Materials 28(19) (2016) 7029
Space group: P 21 21 21
Cell volume: 1679.5
Cell parameters: 7.6695; 14.586; 15.013; 90; 90; 90;  

COD ID: 4003313
CIF file Formula: - C5 H11 I4 N3 Pb -
Comments: Mao, Lingling; Tsai, Hsinhan; Nie, Wanyi; Ma, Lin; Im, Jino; Stoumpos, Constantinos C.; Malliakas, Christos D.; Hao, Feng; Wasielewski, Michael R.; Mohite, Aditya D.; Kanatzidis, Mercouri G. Role of Organic Counterion in Lead- and Tin-Based Two-Dimensional Semiconducting Iodide Perovskites and Application in Planar Solar Cells Chemistry of Materials 28(21) (2016) 7781
Space group: P 1 21/n 1
Cell volume: 1605.4
Cell parameters: 8.9159; 20.0335; 8.9925; 90; 91.875; 90;  

COD ID: 4003314
CIF file Formula: - C5 H11 I4 N3 Sn -
Comments: Mao, Lingling; Tsai, Hsinhan; Nie, Wanyi; Ma, Lin; Im, Jino; Stoumpos, Constantinos C.; Malliakas, Christos D.; Hao, Feng; Wasielewski, Michael R.; Mohite, Aditya D.; Kanatzidis, Mercouri G. Role of Organic Counterion in Lead- and Tin-Based Two-Dimensional Semiconducting Iodide Perovskites and Application in Planar Solar Cells Chemistry of Materials 28(21) (2016) 7781
Space group: P 1 21/n 1
Cell volume: 1573.62
Cell parameters: 8.7411; 20.0449; 8.9845; 90; 91.571; 90;  

COD ID: 4003315
CIF file Formula: - C14 H20 I4 N2 Pb -
Comments: Mao, Lingling; Tsai, Hsinhan; Nie, Wanyi; Ma, Lin; Im, Jino; Stoumpos, Constantinos C.; Malliakas, Christos D.; Hao, Feng; Wasielewski, Michael R.; Mohite, Aditya D.; Kanatzidis, Mercouri G. Role of Organic Counterion in Lead- and Tin-Based Two-Dimensional Semiconducting Iodide Perovskites and Application in Planar Solar Cells Chemistry of Materials 28(21) (2016) 7781
Space group: P b c a
Cell volume: 2289.46
Cell parameters: 9.1561; 8.6894; 28.7762; 90; 90; 90;  

COD ID: 4003316
CIF file Formula: - C14 H20 I4 N2 Sn -
Comments: Mao, Lingling; Tsai, Hsinhan; Nie, Wanyi; Ma, Lin; Im, Jino; Stoumpos, Constantinos C.; Malliakas, Christos D.; Hao, Feng; Wasielewski, Michael R.; Mohite, Aditya D.; Kanatzidis, Mercouri G. Role of Organic Counterion in Lead- and Tin-Based Two-Dimensional Semiconducting Iodide Perovskites and Application in Planar Solar Cells Chemistry of Materials 28(21) (2016) 7781
Space group: P b c a
Cell volume: 2265.7
Cell parameters: 9.0944; 8.6613; 28.764; 90; 90; 90;  

COD ID: 4003317
CIF file Formula: - C144 H162 Ag7.22 Au17.77 S18 -
Comments: Yan, Nan; Liao, Lingwen; Yuan, Jinyun; Lin, Yue-jian; Weng, Lin-hong; Yang, Jinlong; Wu, Zhikun Bimetal Doping in Nanoclusters: Synergistic or Counteractive? Chemistry of Materials 28(22) (2016) 8240
Space group: P 1 21/c 1
Cell volume: 8161.7
Cell parameters: 17.41; 27.438; 18.341; 90; 111.323; 90;  

COD ID: 4003318
CIF file Formula: - C51 H39 Ir N3 O3 P -
Comments: Xu, Xianbin; Guo, Haoran; Zhao, Jiang; Liu, Boao; Yang, Xiaolong; Zhou, Guijiang; Wu, Zhaoxin Asymmetric tris-Heteroleptic IridiumIII Complexes Containing a 9-Phenyl-9-phosphafluorene Oxide Moiety with Enhanced Charge Carrier Injection/Transporting Properties for Highly Efficient Solution-Processed Organic Light-Emitting Diodes Chemistry of Materials 28(23) (2016) 8556
Space group: P -1
Cell volume: 2592
Cell parameters: 13.448; 15.035; 15.51; 115.552; 93.416; 109.388;  

COD ID: 4003319
CIF file Formula: - C27 H21 Br Cd Cl N3 O10 -
Comments: An, Wen; Aulakh, Darpandeep; Zhang, Xuan; Verdegaal, Wolfgang; Dunbar, Kim R.; Wriedt, Mario Switching of Adsorption Properties in a Zwitterionic Metal‒Organic Framework Triggered by Photogenerated Radical Triplets Chemistry of Materials 28(21) (2016) 7825
Space group: P b c n
Cell volume: 6501.4
Cell parameters: 28.9782; 17.9781; 12.4794; 90; 90; 90;  

COD ID: 4003320
CIF file Formula: - C176 H328 Ag62 B2 S44 -
Comments: Jin, Shan; Wang, Shuxin; Xiong, Ling; Zhou, Meng; Chen, Shuang; Du, Wenjun; Xia, Andong; Pei, Yong; Zhu, Manzhou Two Electron Reduction: From Quantum Dots to Metal Nanoclusters Chemistry of Materials 28(21) (2016) 7905
Space group: P -1
Cell volume: 7826.3
Cell parameters: 21.432; 21.539; 21.91; 87.7621; 64.8727; 60.9692;  

COD ID: 4003321
CIF file Formula: - C176 H328 Ag62 B2 S45 -
Comments: Jin, Shan; Wang, Shuxin; Xiong, Ling; Zhou, Meng; Chen, Shuang; Du, Wenjun; Xia, Andong; Pei, Yong; Zhu, Manzhou Two Electron Reduction: From Quantum Dots to Metal Nanoclusters Chemistry of Materials 28(21) (2016) 7905
Space group: P -1
Cell volume: 7957.5
Cell parameters: 21.5488; 21.6774; 22.0348; 88; 64.954; 60.919;  

COD ID: 4003322
CIF file Formula: - C387 H291 Cl5 Cu29 N24 -
Comments: Nguyen, Thuy-Ai D.; Jones, Zachary R.; Leto, Domenick F.; Wu, Guang; Scott, Susannah L.; Hayton, Trevor W. Ligand-Exchange-Induced Growth of an Atomically Precise Cu29 Nanocluster from a Smaller Cluster Chemistry of Materials 28(22) (2016) 8385
Space group: P 3 1 c
Cell volume: 16688.1
Cell parameters: 22.4465; 22.4465; 38.2453; 90; 90; 120;  

COD ID: 4003323
CIF file Formula: - C54 H55 Cl Cu N2 O3 P -
Comments: Nguyen, Thuy-Ai D.; Jones, Zachary R.; Leto, Domenick F.; Wu, Guang; Scott, Susannah L.; Hayton, Trevor W. Ligand-Exchange-Induced Growth of an Atomically Precise Cu29 Nanocluster from a Smaller Cluster Chemistry of Materials 28(22) (2016) 8385
Space group: P 1 21/c 1
Cell volume: 4640.2
Cell parameters: 11.622; 16.3129; 24.6222; 90; 96.269; 90;  

COD ID: 4003324
CIF file Formula: - C25 H28 I N2 O0.5 -
Comments: Weissbach, Thomas; Wright, Andrew G.; Peckham, Timothy J.; Sadeghi Alavijeh, Alireza; Pan, Vivian; Kjeang, Erik; Holdcroft, Steven Simultaneous, Synergistic Control of Ion Exchange Capacity and Cross-Linking of Sterically-Protected Poly(benzimidazolium)s Chemistry of Materials 28(21) (2016) 8060
Space group: C 1 2/c 1
Cell volume: 4584.4
Cell parameters: 36.821; 7.8463; 16.111; 90; 99.967; 90;  

COD ID: 4003325
CIF file Formula: - B Br2 O3 Rb Zn2 -
Comments: Yang, Guangsai; Gong, Pifu; Lin, Zheshuai; Ye, Ning AZn2BO3X2(A = K, Rb, NH4; X = Cl, Br): New Members of KBBF Family Exhibiting Large SHG Response and the Enhancement of Layer Interaction by Modified Structures Chemistry of Materials 28(24) (2016) 9122
Space group: R 3 2 :H
Cell volume: 627.7
Cell parameters: 4.982; 4.982; 29.2; 90; 90; 120;  

COD ID: 4003326
CIF file Formula: - B Br2 K O3 Zn2 -
Comments: Yang, Guangsai; Gong, Pifu; Lin, Zheshuai; Ye, Ning AZn2BO3X2(A = K, Rb, NH4; X = Cl, Br): New Members of KBBF Family Exhibiting Large SHG Response and the Enhancement of Layer Interaction by Modified Structures Chemistry of Materials 28(24) (2016) 9122
Space group: R 3 2 :H
Cell volume: 601.23
Cell parameters: 4.9618; 4.9618; 28.199; 90; 90; 120;  

COD ID: 4003327
CIF file Formula: - B Cl2 H4 N O3 Zn2 -
Comments: Yang, Guangsai; Gong, Pifu; Lin, Zheshuai; Ye, Ning AZn2BO3X2(A = K, Rb, NH4; X = Cl, Br): New Members of KBBF Family Exhibiting Large SHG Response and the Enhancement of Layer Interaction by Modified Structures Chemistry of Materials 28(24) (2016) 9122
Space group: R 3 2 :H
Cell volume: 574.5
Cell parameters: 4.952; 4.952; 27.05; 90; 90; 120;  

COD ID: 4003328
CIF file Formula: - B Cl2 K O3 Zn2 -
Comments: Yang, Guangsai; Gong, Pifu; Lin, Zheshuai; Ye, Ning AZn2BO3X2(A = K, Rb, NH4; X = Cl, Br): New Members of KBBF Family Exhibiting Large SHG Response and the Enhancement of Layer Interaction by Modified Structures Chemistry of Materials 28(24) (2016) 9122
Space group: R 3 2 :H
Cell volume: 562.71
Cell parameters: 4.9624; 4.9624; 26.386; 90; 90; 120;  

COD ID: 4003329
CIF file Formula: - B Cl2 O3 Rb Zn2 -
Comments: Yang, Guangsai; Gong, Pifu; Lin, Zheshuai; Ye, Ning AZn2BO3X2(A = K, Rb, NH4; X = Cl, Br): New Members of KBBF Family Exhibiting Large SHG Response and the Enhancement of Layer Interaction by Modified Structures Chemistry of Materials 28(24) (2016) 9122
Space group: R 3 2 :H
Cell volume: 580.22
Cell parameters: 4.9611; 4.9611; 27.221; 90; 90; 120;  

COD ID: 4003330
CIF file Formula: - B Ba Be2 F3 O3 -
Comments: Guo, Shu; Jiang, Xingxing; Liu, Lijuan; Xia, Mingjun; Fang, Zhi; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian BaBe2BO3F3: A KBBF-Type Deep-Ultraviolet Nonlinear Optical Material with Reinforced [Be2BO3F2]∞Layers and Short Phase-Matching Wavelength Chemistry of Materials 28(24) (2016) 8871
Space group: P 63
Cell volume: 705
Cell parameters: 7.6279; 7.6279; 13.99; 90; 90; 120;  


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