Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1501599 | CIF | C109 H180 N24 O20 | I -4 | 11.8715; 11.8715; 40.004 90; 90; 90 | 5637.9 | Danielle Boils; Marie-Eve Perron; Francis Monchamp; Hugues Duval; Thierry Maris; James D. Wuest Molecular Tectonics. Disruption of Self-Association in Melts Derived from Hydrogen-Bonded Solids Macromolecules, 2004, 37, 7351-7357 |
| 1501776 | CIF | C8 H13 N O5 | P 1 1 21 | 4.819; 9.239; 10.384 90; 90; 97.16 | 458.72 | Nishiyama, Yoshiharu; Noishiki, Yasutomo; Wada, Masahisa X-ray Structure of Anhydrous β-Chitin at 1 Å Resolution Macromolecules, 2011, 44, 950 |
| 1501777 | CIF | C18 H16 Si | P 1 21/c 1 | 13.613; 18.074; 6.101 90; 98.365; 90 | 1485.1 | Liu, Jianzhao; Lam, Jacky W. Y.; Jim, Cathy K. W.; Ng, Jason C. Y.; Shi, Jianbing; Su, Huimin; Yeung, Kwok Fai; Hong, Yuning; Faisal, Mahtab; Yu, Yong; Wong, Kam Sing; Tang, Ben Zhong Thiol−Yne Click Polymerization: Regio- and Stereoselective Synthesis of Sulfur-Rich Acetylenic Polymers with Controllable Chain Conformations and Tunable Optical Properties Macromolecules, 2011, 44, 68 |
| 1501778 | CIF | C56 H52 B2 Fe2 S4 | P -1 | 7.7902; 10.2879; 15.8076 102.028; 93.015; 106.952 | 1176.51 | Li, Haiyan; Sundararaman, Anand; Pakkirisamy, Thilagar; Venkatasubbaiah, Krishnan; Schödel, Frauke; Jäkle, Frieder Synthesis and Electronic Structure of Ferrocenylborane-Modified Quaterthiophenes and Polythiophenes Macromolecules, 2011, 44, 95 |
| 1501779 | CIF | C82 H92 B2 Fe2 S4 | P -1 | 9.777; 11.5826; 16.0262 81.645; 75.313; 83.325 | 1730.94 | Li, Haiyan; Sundararaman, Anand; Pakkirisamy, Thilagar; Venkatasubbaiah, Krishnan; Schödel, Frauke; Jäkle, Frieder Synthesis and Electronic Structure of Ferrocenylborane-Modified Quaterthiophenes and Polythiophenes Macromolecules, 2011, 44, 95 |
| 1501780 | CIF | C36 H40 Cl2 N2 O4 Zr | C 1 2/c 1 | 23.2628; 8.7389; 16.6065 90; 93.635; 90 | 3369.2 | Theaker, Giles W.; Morton, Colin; Scott, Peter Zirconium-Catalyzed Polymerization of a Styrene: Catalyst Reactivation Mechanisms Using Alkenes and Dihydrogen Macromolecules, 2011, 44, 1393 |
| 1501781 | CIF | C24 H40 N5 Zr | P -1 | 8.8164; 9.4888; 16.959 75.473; 75.003; 75.112 | 1298.3 | Annunziata, Liana; Pragliola, Stefania; Pappalardo, Daniela; Tedesco, Consiglia; Pellecchia, Claudio New (Anilidomethyl)pyridine Titanium(IV) and Zirconium(IV) Catalyst Precursors for the Highly Chemo- and Stereoselectivecis-1,4-Polymerization of 1,3-Butadiene Macromolecules, 2011, 44, 1934 |
| 1501782 | CIF | C24 H40 N5 Ti | P -1 | 8.743; 9.44; 16.825 96.416; 104.72; 105.838 | 1267.4 | Annunziata, Liana; Pragliola, Stefania; Pappalardo, Daniela; Tedesco, Consiglia; Pellecchia, Claudio New (Anilidomethyl)pyridine Titanium(IV) and Zirconium(IV) Catalyst Precursors for the Highly Chemo- and Stereoselectivecis-1,4-Polymerization of 1,3-Butadiene Macromolecules, 2011, 44, 1934 |
| 1501783 | CIF | C20 H32 N5 Ti | P 1 21/n 1 | 13.614; 10.374; 15.394 90; 98.326; 90 | 2151.2 | Annunziata, Liana; Pragliola, Stefania; Pappalardo, Daniela; Tedesco, Consiglia; Pellecchia, Claudio New (Anilidomethyl)pyridine Titanium(IV) and Zirconium(IV) Catalyst Precursors for the Highly Chemo- and Stereoselectivecis-1,4-Polymerization of 1,3-Butadiene Macromolecules, 2011, 44, 1934 |
| 1501784 | CIF | C14 H20 Cl2 N2 Ti | P 1 21/c 1 | 12.4924; 15.1082; 25.6216 90; 96.8486; 90 | 4801.26 | Nomura, Kotohiro; Fukuda, Hiroya; Katao, Shohei; Fujiki, Michiya; Kim, Hyun Joon; Kim, Dong-Hyun; Saeed, Irfan Olefin Polymerization by Half-Titanocenes Containing η2-Pyrazolato Ligands−MAO Catalyst Systems Macromolecules, 2011, 44, 1986 |
| 1501785 | CIF | C20 H11 Cl2 N2 Ti | P b c a | 14.606; 12.1974; 20.733 90; 90; 90 | 3693.69 | Nomura, Kotohiro; Fukuda, Hiroya; Katao, Shohei; Fujiki, Michiya; Kim, Hyun Joon; Kim, Dong-Hyun; Saeed, Irfan Olefin Polymerization by Half-Titanocenes Containing η2-Pyrazolato Ligands−MAO Catalyst Systems Macromolecules, 2011, 44, 1986 |
| 1501786 | CIF | C19 H26 Cl2 N2 Ti | P 1 21/c 1 | 6.694; 17.8966; 17.2184 90; 93.3214; 90 | 2059.3 | Nomura, Kotohiro; Fukuda, Hiroya; Katao, Shohei; Fujiki, Michiya; Kim, Hyun Joon; Kim, Dong-Hyun; Saeed, Irfan Olefin Polymerization by Half-Titanocenes Containing η2-Pyrazolato Ligands−MAO Catalyst Systems Macromolecules, 2011, 44, 1986 |
| 1501787 | CIF | C14 H20 Cl2 N2 Ti | P -1 | 6.6559; 10.1468; 11.8754 88.737; 83.429; 79.4303 | 783.23 | Nomura, Kotohiro; Fukuda, Hiroya; Katao, Shohei; Fujiki, Michiya; Kim, Hyun Joon; Kim, Dong-Hyun; Saeed, Irfan Olefin Polymerization by Half-Titanocenes Containing η2-Pyrazolato Ligands−MAO Catalyst Systems Macromolecules, 2011, 44, 1986 |
| 1501788 | CIF | C18 H28 Cl2 N2 Ti | C 1 2/c 1 | 30.917; 10.5621; 12.0811 90; 92.5986; 90 | 3941.01 | Nomura, Kotohiro; Fukuda, Hiroya; Katao, Shohei; Fujiki, Michiya; Kim, Hyun Joon; Kim, Dong-Hyun; Saeed, Irfan Olefin Polymerization by Half-Titanocenes Containing η2-Pyrazolato Ligands−MAO Catalyst Systems Macromolecules, 2011, 44, 1986 |
| 1501789 | CIF | C462 H376 O12 Si8 | P -1 | 21.6705; 22.7273; 27.648 70.874; 88.818; 64.954 | 11544.1 | Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M. Crystalline Hybrid Polyphenylene Macromolecules from Octaalkynylsilsesquioxanes, Crystal Structures, and a Potential Route to 3-D Graphenes Macromolecules, 2011, 44, 3425 |
| 1501790 | CIF | C447 H394 O12 Si8 | P 4/n :2 | 32.6146; 32.6146; 41.178 90; 90; 90 | 43802 | Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M. Crystalline Hybrid Polyphenylene Macromolecules from Octaalkynylsilsesquioxanes, Crystal Structures, and a Potential Route to 3-D Graphenes Macromolecules, 2011, 44, 3425 |
| 1501791 | CIF | C7 H12 O4 | P 1 21/c 1 | 6.446; 5.578; 22.186 90; 101.943; 90 | 780.4 | Darensbourg, Donald J.; Moncada, Adriana I.; Wei, Sheng-Hsuan Aliphatic Polycarbonates Produced from the Coupling of Carbon Dioxide and Oxetanes and Their Depolymerization via Cyclic Carbonate Formation Macromolecules, 2011, 44, 2568 |
| 1501792 | CIF | C36 H36 Cl Cr N2 O6 | P 1 21/c 1 | 17.268; 18.138; 11.499 90; 106.48; 90 | 3454 | Darensbourg, Donald J.; Moncada, Adriana I.; Wei, Sheng-Hsuan Aliphatic Polycarbonates Produced from the Coupling of Carbon Dioxide and Oxetanes and Their Depolymerization via Cyclic Carbonate Formation Macromolecules, 2011, 44, 2568 |
| 1501793 | CIF | C26 H44 F6 O6 P2 Pd S2 | P 21 21 21 | 9.1472; 11.3899; 32.6773 90; 90; 90 | 3404.5 | Stempfle, Florian; Quinzler, Dorothee; Heckler, Ilona; Mecking, Stefan Long-Chain Linear C19and C23Monomers and Polycondensates from Unsaturated Fatty Acid Esters Macromolecules, 2011, 44, 4159 |
| 1502770 | CIF | C23 H17 I2 N O2 S2 | P n a 21 | 8.628; 14.8751; 17.4444 90; 90; 90 | 2238.86 | Song, Changsik; Walker, D. Barney; Swager, Timothy M. Conducting Thiophene-Annulated Azepine Polymers Macromolecules, 2010, 43, 5233 |
| 1502771 | CIF | C25 H18 B N O | P -1 | 8.9304; 10.2803; 10.9208 107.466; 90.523; 104.484 | 922.1 | Tokoro, Yuichiro; Nagai, Atsushi; Chujo, Yoshiki Synthesis of π-Conjugated Polymers Containing Organoboron Benzo[h]quinolate in the Main Chain Macromolecules, 2010, 43, 6229 |
| 1502772 | CIF | C26 H20 N2 O S2 | P 1 21/c 1 | 17.0896; 7.5023; 16.288 90; 100.417; 90 | 2053.89 | Häussler, Matthias; Lok, Y. Phei; Chen, Ming; Jasieniak, Jacek; Adhikari, Raju; King, Simon P.; Haque, Saif A.; Forsyth, Craig M.; Winzenberg, Kevin; Watkins, Scott E.; Rizzardo, Ezio; Wilson, Gerard J. Benzothiadiazole-Containing Pendant Polymers Prepared by RAFT and Their Electro-Optical Properties Macromolecules, 2010, 43, 7101 |
| 1502773 | CIF | C30 H53 Mg N3 O2 Si2 | P 21 21 21 | 13.032; 14.817; 17.543 90; 90; 90 | 3387.5 | Wang, Liying; Ma, Haiyan Highly Active Magnesium Initiators for Ring-Opening Polymerization ofrac-Lactide Macromolecules, 2010, 43, 6535 |
| 1502774 | CIF | C32 H52 N2 Zr | P -1 | 9.1654; 17.1904; 21.4248 106.018; 97.63; 97.011 | 3170.9 | Kuhlman, Roger L.; Klosin, Jerzy Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection Macromolecules, 2010, 43, 7903 |
| 1502775 | CIF | C32 H52 Hf N2 | P -1 | 9.1512; 17.1942; 21.2757 105.558; 97.417; 96.995 | 3154.9 | Kuhlman, Roger L.; Klosin, Jerzy Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection Macromolecules, 2010, 43, 7903 |
| 1502776 | CIF | C28 H52 Hf N2 | P 1 21/c 1 | 17.7939; 9.7642; 17.6714 90; 99.741; 90 | 3026 | Kuhlman, Roger L.; Klosin, Jerzy Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection Macromolecules, 2010, 43, 7903 |
| 1502777 | CIF | C57 H116 O40 | P 21 21 21 | 28.29; 29.3; 8.01 90; 90; 90 | 6639 | Nishiyama, Yoshiharu; Mazeau, Karim; Morin, Morgane; Cardoso, Mateus B.; Chanzy, Henri; Putaux, Jean-Luc Molecular and Crystal Structure of 7-Fold V-Amylose Complexed with 2-Propanol Macromolecules, 2010, 43, 8628 |
| 1502778 | CIF | C20 H12 Br2 N2 Ni O2 | P b c a | 10.084; 14.552; 24.36 90; 90; 90 | 3574.6 | Fukumoto, Hiroki; Yamane, Kazuto; Kase, Yumiko; Yamamoto, Takakazu π-Conjugated Poly(aryleneethynylene)s Consisting of Salophen and Ni−Salophen Units in the π-Conjugated Main Chain: Preparation and Chemical Properties Macromolecules, 2010, 43, 10366 |
| 1502779 | CIF | C41 H39 Br Ir N3 | P 1 21/c 1 | 11.081; 25.643; 12.99 90; 102.64; 90 | 3601.7 | Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects Macromolecules, 2010, 43, 8479 |
| 1502780 | CIF | C41 H39 Br Ir N3 | C 1 c 1 | 11.597; 19.586; 15.383 90; 100.67; 90 | 3433.7 | Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects Macromolecules, 2010, 43, 8479 |
| 1502781 | CIF | C41 H38 Br2 Ir N3 | P 1 21/c 1 | 11.015; 25.825; 12.846 90; 102.17; 90 | 3572.1 | Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects Macromolecules, 2010, 43, 8479 |
| 1502782 | CIF | C29 H17 B F2 I2 N2 | P -1 | 7.4515; 11.6557; 15.1935 110.611; 93.971; 92.562 | 1228.8 | Nagai, Atsushi; Chujo, Yoshiki Aromatic Ring-Fused BODIPY-Based Conjugated Polymers Exhibiting Narrow Near-Infrared Emission Bands Macromolecules, 2010, 43, 193 |
| 1502783 | CIF | C50 H62 Si3 | P -1 | 12.4453; 13.3899; 16.7988 107.042; 91.713; 115.539 | 2375 | Liu, Jianzhao; Zhong, Yongchun; Lam, Jacky W. Y.; Lu, Ping; Hong, Yuning; Yu, Yong; Yue, Yanan; Faisal, Mahtab; Sung, Herman H. Y.; Williams, Ian D.; Wong, Kam Sing; Tang, Ben Zhong Hyperbranched Conjugated Polysiloles: Synthesis, Structure, Aggregation-Enhanced Emission, Multicolor Fluorescent Photopatterning, and Superamplified Detection of Explosives Macromolecules, 2010, 43, 4921 |
| 1502784 | CIF | C78 H57 B Cl2 F20 N2 Ni O2 | P -1 | 14.532; 16.824; 17.536 64.33; 89.93; 71.81 | 3625.8 | Wegner, Marcus M.; Ott, Anna K.; Rieger, Bernhard Gas Phase Polymerization of Ethylene with Supported α-Diimine Nickel(II) Catalysts Macromolecules, 2010, 43, 3624 |
| 1502785 | CIF | C49 H74 Co3 N4 O10 | P -1 | 10.0735; 13.7187; 19.7827 77.02; 78.813; 80.483 | 2592.12 | Kember, Michael R.; White, Andrew J. P.; Williams, Charlotte K. Highly Active Di- and Trimetallic Cobalt Catalysts for the Copolymerization of CHO and CO2at Atmospheric Pressure Macromolecules, 2010, 43, 2291 |
| 1502786 | CIF | C49 H86 Co2 N4 O9 | C 1 2/c 1 | 40.1077; 11.9548; 27.7661 90; 128.183; 90 | 10464.8 | Kember, Michael R.; White, Andrew J. P.; Williams, Charlotte K. Highly Active Di- and Trimetallic Cobalt Catalysts for the Copolymerization of CHO and CO2at Atmospheric Pressure Macromolecules, 2010, 43, 2291 |
| 1502787 | CIF | C32 H48 B2 Ge O4 | P 1 21/c 1 | 15.597; 18.542; 11.201 90; 94.484; 90 | 3229.4 | Allard, Nicolas; Aïch, Réda Badrou; Gendron, David; Boudreault, Pierre-Luc T.; Tessier, Christian; Alem, Salima; Tse, Shing-Chi; Tao, Ye; Leclerc, Mario Germafluorenes: New Heterocycles for Plastic Electronics Macromolecules, 2010, 43, 2328 |
| 1502788 | CIF | C40 H64 B2 Ge O4 | P 1 21/c 1 | 19.72; 19.029; 10.873 90; 94.88; 90 | 4065 | Allard, Nicolas; Aïch, Réda Badrou; Gendron, David; Boudreault, Pierre-Luc T.; Tessier, Christian; Alem, Salima; Tse, Shing-Chi; Tao, Ye; Leclerc, Mario Germafluorenes: New Heterocycles for Plastic Electronics Macromolecules, 2010, 43, 2328 |
| 1502789 | CIF | C79 H104 Cl4 O2 Si2 Ti2 | C 1 2/c 1 | 26.407; 14.346; 20.052 90; 96.115; 90 | 7553 | Senda, Taichi; Hanaoka, Hidenori; Nakahara, Shinya; Oda, Yoshiaki; Tsurugi, Hayato; Mashima, Kazushi Rational Design of Silicon-Bridged Fluorenyl−Phenoxy Group 4 Metal Complexes as Catalysts for Producing High Molecular Weight Copolymers of Ethylene and 1-Hexene at Elevated Temperature Macromolecules, 2010, 43, 2299 |
| 1502790 | CIF | C34 H44 O Si | P -1 | 9.23; 10.5413; 15.742 96.051; 97.568; 95.234 | 1501.2 | Senda, Taichi; Hanaoka, Hidenori; Nakahara, Shinya; Oda, Yoshiaki; Tsurugi, Hayato; Mashima, Kazushi Rational Design of Silicon-Bridged Fluorenyl−Phenoxy Group 4 Metal Complexes as Catalysts for Producing High Molecular Weight Copolymers of Ethylene and 1-Hexene at Elevated Temperature Macromolecules, 2010, 43, 2299 |
| 1503456 | CIF | C155 H176 N4 O9 | P 1 | 11.6351; 16.2914; 20.4165 75.588; 87.355; 77.305 | 3656.4 | Gibson, Harry W.; Wang, Hong; Niu, Zhenbin; Slebodnick, Carla; Zhakharov, Lev N.; Rheingold, Arnold L. Rotaxanes from Tetralactams Macromolecules, 2012, 45, 1270 |
| 1503457 | CIF | C31 H23 N O3 | P -1 | 10.99; 11.295; 11.649 117.001; 95.826; 104.191 | 1210.58 | Lee, Chung-Chieh; Leung, Man-kit; Lee, Pei-Yu; Chiu, Tien-Lung; Lee, Jiun-Haw; Liu, Chun; Chou, Pi-Tai Synthesis and Properties of Oxygen-LinkedN-Phenylcarbazole Dendrimers Macromolecules, 2012, 45, 751 |
| 1503458 | CIF | C30 H44 Fe2 O2 Si4 | P 1 21/n 1 | 21.9636; 12.4959; 23.6723 90; 101.38; 90 | 6369.2 | Bruña, Sonia; González-Vadillo, Ana M; Nieto, Daniel; Pastor, César J.; Cuadrado, Isabel Redox-Active Macrocyclic and Linear Oligo-Carbosiloxanes Prepared via Hydrosilylation from 1,3-Divinyl-1,3-Dimethyl-1,3-Diferrocenyldisiloxane Macromolecules, 2012, 45, 781 |
| 1503676 | CIF | C25 H30 N2 Ni O | P 1 21/c 1 | 15.7604; 8.4707; 16.8054 90; 96.515; 90 | 2229.1 | Guironnet, Damien; Göttker-Schnetmann, Inigo; Mecking, Stefan Catalytic Polymerization in Dense CO2to Controlled Microstructure Polyethylenes Macromolecules, 2009, 42, 8157 |
| 1504416 | CIF | C31 H17 B F20 O Si | P -1 | 10.1347; 17.4222; 19.6456 67.543; 80.967; 81.909 | 3153.6 | Zhang, Yuetao; Chen, Eugene Y.-X. Controlled Polymerization of Methacrylates to High Molecular Weight Polymers Using Oxidatively Activated Group Transfer Polymerization Initiators Macromolecules, 2008, 41, 36 |
| 1504417 | CIF | C27 H42 N2 O6 | P 21 21 21 | 12.127; 20.474; 10.506 90; 90; 90 | 2608.5 | Katsumata, Toru; Qu, Jinqing; Shiotsuki, Masashi; Satoh, Masaharu; Wada, Jun; Igarashi, Jun; Mizoguchi, Kenji; Masuda, Toshio Synthesis, Characterization, and Charge/Discharge Properties of Polynorbornenes Carrying 2,2,6,6-Tetramethylpiperidine-1-oxy Radicals at High Density Macromolecules, 2008, 41, 1175 |
| 1504418 | CIF | C14 H13 Br2 N O3 | P 1 21/n 1 | 7.0959; 24.662; 8.981 90; 99.033; 90 | 1552.2 | Nagata, Yuuya; Otaka, Hiromichi; Chujo, Yoshiki Synthesis of New Main-Chain-Type Organoboron Quinolate Polymer Linked on Quinolate Ligand Macromolecules, 2008, 41, 737 |
| 1504419 | CIF | C14 H18 Cl2 Zr | P n 21 a | 6.6716; 10.4461; 21.497 90; 90; 90 | 1498.2 | Huang, Rubin; Duchateau, Robbert; Koning, Cor E.; Chadwick, John C. Zirconocene Immobilization and Activation on MgCl2-Based Supports: Factors Affecting Ethylene Polymerization Activity Macromolecules, 2008, 41, 579 |
| 1504420 | CIF | C31 H45 Ho N2 Si2 | P 1 21/c 1 | 10.5662; 23.2337; 13.8856 90; 107.19; 90 | 3256.5 | Wang, Baoli; Cui, Dongmei; Lv, Kui Highly 3,4-Selective Living Polymerization of Isoprene with Rare Earth Metal Fluorenyl N-Heterocyclic Carbene Precursors Macromolecules, 2008, 41, 1983 |
| 1504421 | CIF | C38.5 H50.5 Ho N2 Si2 | C 1 2/c 1 | 37.866; 11.041; 20.5883 90; 117.228; 90 | 7653.8 | Wang, Baoli; Cui, Dongmei; Lv, Kui Highly 3,4-Selective Living Polymerization of Isoprene with Rare Earth Metal Fluorenyl N-Heterocyclic Carbene Precursors Macromolecules, 2008, 41, 1983 |
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