Crystallography Open Database

Result: there are 2395 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching journal of publication like 'ACS Catalysis'

Left arrow Left arrow First | Left arrow Previous 50 | of 48 | Next 50 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
4501447 CIFC39 H42 Cl4 N2 O2 TiP 1 21/c 116.8818; 10.7967; 20.6102
90; 99.5901; 90		3704.08Terao, Hiroshi; Iwashita, Akihiko; Matsukawa, Naoto; Ishii, Seiichi; Mitani, Makoto; Tanaka, Hidetsugu; Nakano, Takashi; Fujita, Terunori
Ethylene and Ethylene/α-Olefin (Co)Polymerization Behavior of Bis(phenoxy−imine)Ti Catalysts: Significant Substituent Effects on Activity and Comonomer Incorporation
ACS Catalysis, 2011, 1, 254
4501448 CIFC47 H59 Cl2 N2 O2 TiP 1 21/a 115.976; 25.591; 10.943
90; 102.3; 90		4371Terao, Hiroshi; Iwashita, Akihiko; Matsukawa, Naoto; Ishii, Seiichi; Mitani, Makoto; Tanaka, Hidetsugu; Nakano, Takashi; Fujita, Terunori
Ethylene and Ethylene/α-Olefin (Co)Polymerization Behavior of Bis(phenoxy−imine)Ti Catalysts: Significant Substituent Effects on Activity and Comonomer Incorporation
ACS Catalysis, 2011, 1, 254
4501449 CIFC20 H19 Br N4 O5P 1 21 17.8416; 13.964; 9.5724
90; 106.198; 90		1006.6Hua, Qiu-Lin; Li, Chao; Wang, Xu-Fan; Lu, Liang-Qiu; Chen, Jia-Rong; Xiao, Wen-Jing
Enantioselective Synthesis of Chromans with a Quaternary Stereogenic Centre through Catalytic Asymmetric Cascade Reactions
ACS Catalysis, 2011, 1, 221
4501450 CIFC22 H32 B N3 O3 ZnP 1 21/c 110.8363; 13.4156; 16.1656
90; 96.788; 90		2333.61Mukherjee, Debabrata; Thompson, Richard R.; Ellern, Arkady; Sadow, Aaron D.
Coordinatively Saturated Tris(oxazolinyl)borato Zinc Hydride-Catalyzed Cross Dehydrocoupling of Silanes and Alcohols
ACS Catalysis, 2011, 1, 698
4501451 CIFC31 H42 B N3 O4.5 ZnP 1 21/c 121.569; 9.896; 15.813
90; 106.292; 90		3240Mukherjee, Debabrata; Thompson, Richard R.; Ellern, Arkady; Sadow, Aaron D.
Coordinatively Saturated Tris(oxazolinyl)borato Zinc Hydride-Catalyzed Cross Dehydrocoupling of Silanes and Alcohols
ACS Catalysis, 2011, 1, 698
4501452 CIFC17 H20 O2 SiP -17.821; 8.589; 13.088
84.193; 86.915; 63.19		780.6Mukherjee, Debabrata; Thompson, Richard R.; Ellern, Arkady; Sadow, Aaron D.
Coordinatively Saturated Tris(oxazolinyl)borato Zinc Hydride-Catalyzed Cross Dehydrocoupling of Silanes and Alcohols
ACS Catalysis, 2011, 1, 698
4501453 CIFC13 H20 O2 SiP 1 21/c 17.7423; 12.8158; 13.6032
90; 97.565; 90		1338.01Mukherjee, Debabrata; Thompson, Richard R.; Ellern, Arkady; Sadow, Aaron D.
Coordinatively Saturated Tris(oxazolinyl)borato Zinc Hydride-Catalyzed Cross Dehydrocoupling of Silanes and Alcohols
ACS Catalysis, 2011, 1, 698
4501454 CIFC53.33 H52 Co F6 N4 O6.67 S2.67 SbP -115.694; 16.579; 17.451
87.054; 88.06; 62.315		4015.2Venkatasubbaiah, Krishnan; Zhu, Xunjin; Kays, Elizabeth; Hardcastle, Kenneth I.; Jones, Christopher W.
Co(III)-Porphyrin-Mediated Highly Regioselective Ring-Opening of Terminal Epoxides with Alcohols and Phenols
ACS Catalysis, 2011, 489
4501455 CIFC41 H55 Hf N5 SP 1 21/c 117.633; 10.0494; 22.504
90; 97.714; 90		3951.6Diamond, Gary M.; Hall, Keith A.; LaPointe, Anne M.; Leclerc, Margarete K.; Longmire, James; Shoemaker, James A. W.; Sun, Pu
High-Throughput Discovery and Optimization of Hafnium Heteroaryl-amido Catalysts for the Isospecific Polymerization of Propylene
ACS Catalysis, 2011, 1, 887
4501456 CIFC38 H46 Hf N2 SP -111.2458; 13.4734; 13.5863
67.489; 81.795; 88.766		1881Diamond, Gary M.; Hall, Keith A.; LaPointe, Anne M.; Leclerc, Margarete K.; Longmire, James; Shoemaker, James A. W.; Sun, Pu
High-Throughput Discovery and Optimization of Hafnium Heteroaryl-amido Catalysts for the Isospecific Polymerization of Propylene
ACS Catalysis, 2011, 1, 887
4501457 CIFC35 H46 Hf N4 O SP 1 21/c 114.4153; 14.2346; 16.653
90; 98.959; 90		3375.4Diamond, Gary M.; Hall, Keith A.; LaPointe, Anne M.; Leclerc, Margarete K.; Longmire, James; Shoemaker, James A. W.; Sun, Pu
High-Throughput Discovery and Optimization of Hafnium Heteroaryl-amido Catalysts for the Isospecific Polymerization of Propylene
ACS Catalysis, 2011, 1, 887
4501458 CIFC48 H72 Hf N6 OP 1 21/n 121.626; 19.173; 25.68
90; 108.965; 90		10070Diamond, Gary M.; Hall, Keith A.; LaPointe, Anne M.; Leclerc, Margarete K.; Longmire, James; Shoemaker, James A. W.; Sun, Pu
High-Throughput Discovery and Optimization of Hafnium Heteroaryl-amido Catalysts for the Isospecific Polymerization of Propylene
ACS Catalysis, 2011, 1, 887
4501459 CIFC33 H49 Cl N O P RuP -18.972; 9.6985; 18.4616
100.458; 94.892; 90.021		1573.79Schachner, Jörg A.; Cabrera, José; Padilla, Robin; Fischer, Christoph; van der Schaaf, Paul A.; Pretot, Roger; Rominger, Frank; Limbach, Michael
A Set of Olefin Metathesis Catalysts with Extraordinary Stickiness to Silica
ACS Catalysis, 2011, 1, 872
4501460 CIFC43 H50 Cl N3 O RuP 1 21/c 116.7458; 16.9502; 14.9589
90; 109.887; 90		3992.8Schachner, Jörg A.; Cabrera, José; Padilla, Robin; Fischer, Christoph; van der Schaaf, Paul A.; Pretot, Roger; Rominger, Frank; Limbach, Michael
A Set of Olefin Metathesis Catalysts with Extraordinary Stickiness to Silica
ACS Catalysis, 2011, 1, 872
4501461 CIFC18 H36 F5 N4 O4 ZnP -17.944; 8.854; 16.032
79.805; 81.63; 80.763		1087.4Maegawa, Yusuke; Ohshima, Takashi; Hayashi, Yukiko; Agura, Kazushi; Iwasaki, Takanori; Mashima, Kazushi
Additive Effect ofN-Heteroaromatics on Transesterification Catalyzed by Tetranuclear Zinc Cluster
ACS Catalysis, 2011, 1, 1178
4501462 CIFC42 H78 N2 O8 Pd Si2P 1 21/n 113.76; 24.958; 14.913
90; 101.799; 90		5013Choi, Yeon S.; Moschetta, Eric G.; Miller, Jeffrey T.; Fasulo, Meg; McMurdo, Meredith J.; Rioux, Robert M.; Tilley, T. Don
Highly Dispersed Pd-SBA15 Materials from Tris(tert-butoxy)siloxy Complexes of Pd(II)
ACS Catalysis, 2011, 1, 1166
4501463 CIFC31 H54 N2 O4 Pd SiC 1 2/c 133.989; 9.3744; 28.483
90; 121.11; 90		7770.2Choi, Yeon S.; Moschetta, Eric G.; Miller, Jeffrey T.; Fasulo, Meg; McMurdo, Meredith J.; Rioux, Robert M.; Tilley, T. Don
Highly Dispersed Pd-SBA15 Materials from Tris(tert-butoxy)siloxy Complexes of Pd(II)
ACS Catalysis, 2011, 1, 1166
4501464 CIFC16 H30 F6 Fe N4 O6 S2F d d 28.8289; 32.679; 16.3726
90; 90; 90		4723.8Feng, Yan; England, Jason; Que, Lawrence
Iron-Catalyzed Olefin Epoxidation and cis-Dihydroxylation by Tetraalkylcyclam Complexes: the Importance of cis-Labile Sites
ACS Catalysis, 2011, 1, 1035
4501465 CIFC20 H23 Cl4 N3 Ni O2P -17.7306; 10.879; 13.935
87.26; 78.61; 82.14		1137.8Zhang, Liping; Hao, Xiang; Sun, Wen-Hua; Redshaw, Carl
Synthesis, Characterization, and Ethylene Polymerization Behavior of 8-(Nitroarylamino)-5,6,7-trihydroquinolylnickel Dichlorides: Influence of the Nitro Group and Impurities on Catalytic Activity
ACS Catalysis, 2011, 1, 1213
4501466 CIFC21 H25 Cl2 N3 Ni O2P 1 21/n 19.1206; 28.489; 9.4194
90; 116.45; 90		2191.3Zhang, Liping; Hao, Xiang; Sun, Wen-Hua; Redshaw, Carl
Synthesis, Characterization, and Ethylene Polymerization Behavior of 8-(Nitroarylamino)-5,6,7-trihydroquinolylnickel Dichlorides: Influence of the Nitro Group and Impurities on Catalytic Activity
ACS Catalysis, 2011, 1, 1213
4501467 CIFC21 H25 Cl2 N3 Ni O2P -18.4918; 11.126; 14.794
107.41; 103.11; 96.34		1274.8Zhang, Liping; Hao, Xiang; Sun, Wen-Hua; Redshaw, Carl
Synthesis, Characterization, and Ethylene Polymerization Behavior of 8-(Nitroarylamino)-5,6,7-trihydroquinolylnickel Dichlorides: Influence of the Nitro Group and Impurities on Catalytic Activity
ACS Catalysis, 2011, 1, 1213
4501468 CIFC20 H23 Cl3 N3 Ni0.5 O2P -19.1269; 10.212; 12.557
112.06; 96.8; 98.4		1053.7Zhang, Liping; Hao, Xiang; Sun, Wen-Hua; Redshaw, Carl
Synthesis, Characterization, and Ethylene Polymerization Behavior of 8-(Nitroarylamino)-5,6,7-trihydroquinolylnickel Dichlorides: Influence of the Nitro Group and Impurities on Catalytic Activity
ACS Catalysis, 2011, 1, 1213
4505631 CIFC48 H56 Br4 N4 Ni2P 1 21/n 114.0495; 9.9391; 17.681
90; 110.777; 90		2308.4Zai, Shaobo; Gao, Haiyang; Huang, Zengfang; Hu, Haibin; Wu, Han; Wu, Qing
Substituent Effects of Pyridine-amine Nickel Catalyst Precursors on Ethylene Polymerization
ACS Catalysis, 2012, 2, 433
4505632 CIFC27 H35 Br2 Cl4 N2 Ni OP 1 21/c 118.146; 12.048; 18.386
90; 119.14; 90		3510.9Zai, Shaobo; Gao, Haiyang; Huang, Zengfang; Hu, Haibin; Wu, Han; Wu, Qing
Substituent Effects of Pyridine-amine Nickel Catalyst Precursors on Ethylene Polymerization
ACS Catalysis, 2012, 2, 433
4505633 CIFC38 H52 Br2 N4 NiP 1 21/c 111.7518; 10.9119; 18.5929
90; 128.486; 90		1866.3Zai, Shaobo; Gao, Haiyang; Huang, Zengfang; Hu, Haibin; Wu, Han; Wu, Qing
Substituent Effects of Pyridine-amine Nickel Catalyst Precursors on Ethylene Polymerization
ACS Catalysis, 2012, 2, 433
4505634 CIFC18 H20 I N O5 SP 1 21/n 19.806; 12.76; 15.657
90; 102.62; 90		1911.7Guilbault, Audrey-Anne; Legault, Claude Y.
Drastic Enhancement of Activity in Iodane-Based α-Tosyloxylation of Ketones: Iodine(III) Does the Hypervalent Twist
ACS Catalysis, 2012, 2, 219
4505635 CIFC19 H22 I N O5 SP 1 21/c 17.172; 7.921; 33.699
90; 93.67; 90		1910.5Guilbault, Audrey-Anne; Legault, Claude Y.
Drastic Enhancement of Activity in Iodane-Based α-Tosyloxylation of Ketones: Iodine(III) Does the Hypervalent Twist
ACS Catalysis, 2012, 2, 219
4506119 CIFC50 H58 Cl4 O6 P2 Pd2 S2C 1 2/c 120.009; 13.184; 19.278
90; 95.989; 90		5058Cai, Zhengguo; Shen, Zhongliang; Zhou, Xiaoyuan; Jordan, Richard F.
Enhancement of Chain Growth and Chain Transfer Rates in Ethylene Polymerization by (Phosphine-sulfonate)PdMe Catalysts by Binding of B(C6F5)3to the Sulfonate Group
ACS Catalysis, 2012, 2, 1187
4506120 CIFC72 H102 O6 P2 Pd2 S2P 1 21/c 117.934; 10.371; 25.392
90; 131.536; 90		3535.2Cai, Zhengguo; Shen, Zhongliang; Zhou, Xiaoyuan; Jordan, Richard F.
Enhancement of Chain Growth and Chain Transfer Rates in Ethylene Polymerization by (Phosphine-sulfonate)PdMe Catalysts by Binding of B(C6F5)3to the Sulfonate Group
ACS Catalysis, 2012, 2, 1187
4506121 CIFC58 H61 B F15 O4 P Pd SC 1 2/c 136.529; 13.21; 24.939
90; 100.456; 90		11834Cai, Zhengguo; Shen, Zhongliang; Zhou, Xiaoyuan; Jordan, Richard F.
Enhancement of Chain Growth and Chain Transfer Rates in Ethylene Polymerization by (Phosphine-sulfonate)PdMe Catalysts by Binding of B(C6F5)3to the Sulfonate Group
ACS Catalysis, 2012, 2, 1187
4506122 CIFC56 H48 Cl12 N4 O18 Rh2I 2 337.1893; 37.1893; 37.1893
90; 90; 90		51434.4Lindsay, Vincent N. G.; Charette, André B.
Design and Synthesis of Chiral Heteroleptic Rhodium(II) Carboxylate Catalysts: Experimental Investigation of Halogen Bond Rigidification Effects in Asymmetric Cyclopropanation
ACS Catalysis, 2012, 2, 1221
4506582 CIFC21 H27 N O3 SiP 1 21 111.7148; 6.9828; 13.444
90; 114.935; 90		997.24Min, Taewoo; Fettinger, James C.; Franz, Annaliese K.
Enantiocontrol with a Hydrogen-bond Directing Pyrrolidinylsilanol Catalyst
ACS Catalysis, 2012, 2, 1661
4506583 CIFC23 H32 F3 N O4 S SiP 21 21 218.52; 8.5557; 33.4637
90; 90; 90		2439.32Min, Taewoo; Fettinger, James C.; Franz, Annaliese K.
Enantiocontrol with a Hydrogen-bond Directing Pyrrolidinylsilanol Catalyst
ACS Catalysis, 2012, 2, 1661
4506584 CIFC27 H39 N O3 SiP 21 21 2112.6433; 13.8501; 14.684
90; 90; 90		2571.33Min, Taewoo; Fettinger, James C.; Franz, Annaliese K.
Enantiocontrol with a Hydrogen-bond Directing Pyrrolidinylsilanol Catalyst
ACS Catalysis, 2012, 2, 1661
4506585 CIFC16 H20 Cl N O SiP 21 21 217.5343; 8.5707; 25.2748
90; 90; 90		1632.1Min, Taewoo; Fettinger, James C.; Franz, Annaliese K.
Enantiocontrol with a Hydrogen-bond Directing Pyrrolidinylsilanol Catalyst
ACS Catalysis, 2012, 2, 1661
4506586 CIFC11 H8 Br N3 O3P 1 21 19.4259; 5.1093; 12.799
90; 110.279; 90		578.19Li, Wenjun; Liu, Hui; Jiang, Xuefeng; Wang, Jian
Enantioselective Organocatalytic Conjugate Addition of Nitroalkanes to Electrophilic 2-Iminochromenes
ACS Catalysis, 2012, 2, 1535
4506587 CIFC62 H70 Fe2 N16 O2C 1 2/c 131.222; 17.025; 23.69
90; 101.133; 90		12356Yu, Renyuan Pony; Darmon, Jonathan M.; Hoyt, Jordan M.; Margulieux, Grant W.; Turner, Zoë R.; Chirik, Paul J.
High-Activity Iron Catalysts for the Hydrogenation of Hindered, Unfunctionalized Alkenes
ACS Catalysis, 2012, 2, 1760
4506588 CIFC29 H29 Fe N9P 1 21/c 115.7139; 10.318; 17.0218
90; 98.758; 90		2727.7Yu, Renyuan Pony; Darmon, Jonathan M.; Hoyt, Jordan M.; Margulieux, Grant W.; Turner, Zoë R.; Chirik, Paul J.
High-Activity Iron Catalysts for the Hydrogenation of Hindered, Unfunctionalized Alkenes
ACS Catalysis, 2012, 2, 1760
4507135 CIFC39 H21 Ag3 F18 N6P -19.7393; 13.5428; 16.9533
94.039; 104.186; 109.322		2017.54Flores, Jaime A.; Komine, Nobuyuki; Pal, Kuntal; Pinter, Balazs; Pink, Maren; Chen, Chun-Hsing; Caulton, Kenneth G.; Mindiola, Daniel J.
Silver(I)-Catalyzed Insertion of Carbene into Alkane C‒H Bonds and the Origin of the Special Challenge of Methane Activation Using DFT as a Mechanistic Probe
ACS Catalysis, 2012, 2, 2066
4507136 CIFC31 H31 Cl3 Cr N4 PP b c a11.2332; 16.7375; 33.095
90; 90; 90		6222.4Sydora, Orson L.; Jones, Thomas C.; Small, Brooke L.; Nett, Alex J.; Fischer, Anne A.; Carney, Michael J.
Selective Ethylene Tri-/Tetramerization Catalysts
ACS Catalysis, 2012, 2, 2452
4507137 CIFC23 H26 Cl3 Cr N3 PP n a 2111.5487; 14.419; 15.38
90; 90; 90		2561.1Sydora, Orson L.; Jones, Thomas C.; Small, Brooke L.; Nett, Alex J.; Fischer, Anne A.; Carney, Michael J.
Selective Ethylene Tri-/Tetramerization Catalysts
ACS Catalysis, 2012, 2, 2452
4507138 CIFC33 H40 Cl3 F3 N2 O3 Ru SP -110.788; 12.131; 16.206
89.72; 71.49; 64.83		1799.1Schreiber, Dominique F.; O’Connor, Crystal; Grave, Christian; Ortin, Yannick; Müller-Bunz, Helge; Phillips, Andrew D.
Application of β-Diketiminato Arene-Substituted Ru(II) Complexes in Highly Efficient H2Dehydrocoupling of Amine Boranes
ACS Catalysis, 2012, 2, 2505
4507139 CIFC35 H44 Cl3 F3 N2 O3 Ru SP 1 21/c 113.3963; 12.4531; 23.0725
90; 106.164; 90		3696.92Schreiber, Dominique F.; O’Connor, Crystal; Grave, Christian; Ortin, Yannick; Müller-Bunz, Helge; Phillips, Andrew D.
Application of β-Diketiminato Arene-Substituted Ru(II) Complexes in Highly Efficient H2Dehydrocoupling of Amine Boranes
ACS Catalysis, 2012, 2, 2505
4507140 CIFC29.91 H29 Cl0.09 F2.73 N2 O2.73 Ru S0.91P -113.411; 14.9649; 18.0317
98.982; 96.074; 108.632		3340Schreiber, Dominique F.; O’Connor, Crystal; Grave, Christian; Ortin, Yannick; Müller-Bunz, Helge; Phillips, Andrew D.
Application of β-Diketiminato Arene-Substituted Ru(II) Complexes in Highly Efficient H2Dehydrocoupling of Amine Boranes
ACS Catalysis, 2012, 2, 2505
4507141 CIFC28 H34 N2 RuP 1 21 17.7447; 12.5622; 12.1814
90; 94.917; 90		1180.77Schreiber, Dominique F.; O’Connor, Crystal; Grave, Christian; Ortin, Yannick; Müller-Bunz, Helge; Phillips, Andrew D.
Application of β-Diketiminato Arene-Substituted Ru(II) Complexes in Highly Efficient H2Dehydrocoupling of Amine Boranes
ACS Catalysis, 2012, 2, 2505
4507142 CIFC51 H48 B F25 N P2 RhP 1 21/c 117.2281; 17.5318; 18.888
90; 104.533; 90		5522.39Pernik, Indrek; Hooper, Joel F.; Chaplin, Adrian B.; Weller, Andrew S.; Willis, Michael C.
Exploring Small Bite-Angle Ligands for the Rhodium-Catalyzed Intermolecular Hydroacylation of β-S-Substituted Aldehydes with 1-Octene and 1-Octyne
ACS Catalysis, 2012, 2, 2779
4507143 CIFC53 H51 B F24 N O P2 Rh SP -112.2384; 15.4948; 17.5543
103.603; 109.864; 98.834		2942.02Pernik, Indrek; Hooper, Joel F.; Chaplin, Adrian B.; Weller, Andrew S.; Willis, Michael C.
Exploring Small Bite-Angle Ligands for the Rhodium-Catalyzed Intermolecular Hydroacylation of β-S-Substituted Aldehydes with 1-Octene and 1-Octyne
ACS Catalysis, 2012, 2, 2779
4507144 CIFC57 H52 B F26 P2 RhP 4313.1403; 13.1403; 34.4622
90; 90; 90		5950.5Pernik, Indrek; Hooper, Joel F.; Chaplin, Adrian B.; Weller, Andrew S.; Willis, Michael C.
Exploring Small Bite-Angle Ligands for the Rhodium-Catalyzed Intermolecular Hydroacylation of β-S-Substituted Aldehydes with 1-Octene and 1-Octyne
ACS Catalysis, 2012, 2, 2779
4507145 CIFC52 H49 B F25 P2 RhP 1 21/c 117.7994; 17.3901; 19.0524
90; 109.328; 90		5564.97Pernik, Indrek; Hooper, Joel F.; Chaplin, Adrian B.; Weller, Andrew S.; Willis, Michael C.
Exploring Small Bite-Angle Ligands for the Rhodium-Catalyzed Intermolecular Hydroacylation of β-S-Substituted Aldehydes with 1-Octene and 1-Octyne
ACS Catalysis, 2012, 2, 2779
4507146 CIFC59 H56 B F26 P2 RhP -112.6572; 13.247; 19.6804
104.275; 106.494; 91.3854		3050.53Pernik, Indrek; Hooper, Joel F.; Chaplin, Adrian B.; Weller, Andrew S.; Willis, Michael C.
Exploring Small Bite-Angle Ligands for the Rhodium-Catalyzed Intermolecular Hydroacylation of β-S-Substituted Aldehydes with 1-Octene and 1-Octyne
ACS Catalysis, 2012, 2, 2779

Left arrow Left arrow First | Left arrow Previous 50 | of 48 | Next 50 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.