Crystallography Open Database

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1540718 CIFC35 H37 F3 N O7 P2 Rh SP 1 21/c 111.2087; 15.5479; 20.7874
90; 97.185; 90
3594.2Wang, Peng; Liu, Huan; Li, Yong-Qi; Zhao, Xiao-Li; Lu, Yong; Liu, Ye
Phosphonium-based aminophosphines as bifunctional ligands for sequential catalysis of one-pot hydroformylation‒acetalization of olefins
Catal. Sci. Technol., 2016, 6, 3854
1541895 CIFC15 H16 N2P 1 21/c 115.783; 12.467; 12.928
90; 102.277; 90
2485.6Xiu, Jianmin; Yi, Wenbin
Radical-based regioselective cross-coupling of indoles and cycloalkanes
Catal. Sci. Technol., 2016, 6, 998
1542279 CIFC42 H28 Cu La4 N6 O38 S2P -19.4008; 11.5017; 13.7959
108.56; 106.079; 97.893
1316.5Cancino, P.; Vega, A.; Santiago-Portillo, Andrea; Navalon, Sergio; Alvaro, Mercedes; Aguirre, P.; Spodine, E.; García, Hermenegildo
A novel copper(ii)‒lanthanum(iii) metal organic framework as a selective catalyst for the aerobic oxidation of benzylic hydrocarbons and cycloalkenes
Catal. Sci. Technol., 2016, 6, 3727
1542345 CIFC21 H26 F3 Ir N2 O4 SiC 1 2/c 128.294; 11.04; 15.2266
90; 111.304; 90
4431.3Julián, Alejandro; Jaseer, E. A.; Garcés, Karin; Fernández-Alvarez, Francisco J.; García-Orduña, Pilar; Lahoz, Fernando J.; Oro, Luis A.
Tuning the activity and selectivity of iridium-NSiN catalyzed CO2hydrosilylation processes
Catal. Sci. Technol., 2016, 6, 4410
1542353 CIFC28 H41 B F4 Fe N3 O PP 1 21/c 117.888; 8.6252; 21.0338
90; 111.094; 90
3027.8Butschke, B.; Feller, M.; Diskin-Posner, Y.; Milstein, D.
Ketone hydrogenation catalyzed by a new iron(ii)‒PNN complex
Catal. Sci. Technol., 2016, 6, 4428
1542366 CIFC22 H36 Cl3 P RuP -17.6344; 10.5128; 15.3514
103.182; 92.237; 90.962
1198.29González-Fernández, Rebeca; González-Liste, Pedro J.; Borge, Javier; Crochet, Pascale; Cadierno, Victorio
Chlorophosphines as auxiliary ligands in ruthenium-catalyzed nitrile hydration reactions: application to the preparation of β-ketoamides
Catal. Sci. Technol., 2016, 6, 4398
1542367 CIFC24 H23 Cl2 F6 O P RuP 1 21/c 16.8231; 11.2772; 33.5183
90; 91.031; 90
2578.66González-Fernández, Rebeca; González-Liste, Pedro J.; Borge, Javier; Crochet, Pascale; Cadierno, Victorio
Chlorophosphines as auxiliary ligands in ruthenium-catalyzed nitrile hydration reactions: application to the preparation of β-ketoamides
Catal. Sci. Technol., 2016, 6, 4398
1542404 CIFC12 H18 Cu N O6P -17.5973; 8.106; 12.4901
89.576; 86.095; 69.787
720.03Fernandes, Tiago A.; Santos, Carla I. M.; André, Vânia; Dias, Sara S. P.; Kirillova, Marina V.; Kirillov, Alexander M.
New aqua-soluble dicopper(ii) aminoalcoholate cores for mild and water-assisted catalytic oxidation of alkanes
Catal. Sci. Technol., 2016, 6, 4584
1542405 CIFC14 H27 Cu N2 O9P 1 21/c 19.2907; 13.3305; 15.2281
90; 107.358; 90
1800.11Fernandes, Tiago A.; Santos, Carla I. M.; André, Vânia; Dias, Sara S. P.; Kirillova, Marina V.; Kirillov, Alexander M.
New aqua-soluble dicopper(ii) aminoalcoholate cores for mild and water-assisted catalytic oxidation of alkanes
Catal. Sci. Technol., 2016, 6, 4584
1542415 CIFC19 H19 Br2 Fe N3 NiP 1 21/c 114.1412; 9.6921; 13.6154
90; 93.23; 90
1863.13Obuah, Collins; Jordaan, Johan H. L.; Darkwa, James
(Ferrocenylpyrazolyl)nickel(ii)-catalysed ethylene oligomerisation
Catal. Sci. Technol., 2016, 6, 4814
1542416 CIFC20 H19 Br2 Fe N3 NiP 1 21/c 114.2482; 9.8031; 14.1378
90; 96.793; 90
1960.86Obuah, Collins; Jordaan, Johan H. L.; Darkwa, James
(Ferrocenylpyrazolyl)nickel(ii)-catalysed ethylene oligomerisation
Catal. Sci. Technol., 2016, 6, 4814
1542536 CIFC22 H16 F6 N4 O6 S2 ZnC 1 2/c 19.92044; 14.02733; 18.6185
90; 101.515; 90
2538.75Comerford, James W.; Hart, Sam J.; North, Michael; Whitwood, Adrian C.
Homogeneous and silica-supported zinc complexes for the synthesis of propylene carbonate from propane-1,2-diol and carbon dioxide
Catal. Sci. Technol., 2016, 6, 4824
1542537 CIFC26 H16 F6 N4 O6 S2 ZnC 1 2/c 19.75476; 14.26536; 19.5942
90; 95.2384; 90
2715.25Comerford, James W.; Hart, Sam J.; North, Michael; Whitwood, Adrian C.
Homogeneous and silica-supported zinc complexes for the synthesis of propylene carbonate from propane-1,2-diol and carbon dioxide
Catal. Sci. Technol., 2016, 6, 4824
1542538 CIFC24 H32 F6 N8 O6 S2 ZnP 18.3731; 8.6907; 11.7281
68.851; 81.968; 82.401
785.04Comerford, James W.; Hart, Sam J.; North, Michael; Whitwood, Adrian C.
Homogeneous and silica-supported zinc complexes for the synthesis of propylene carbonate from propane-1,2-diol and carbon dioxide
Catal. Sci. Technol., 2016, 6, 4824
1542578 CIFC16 H11 F3 Mo O3P -17.1145; 7.6417; 15.3159
93.275; 97.569; 113.744
749.96Reich, Robert M.; Kaposi, Marlene; Pöthig, Alexander; Kühn, Fritz E.
Kinetic studies of fluorinated aryl molybdenum(ii) tricarbonyl precursors in epoxidation catalysis
Catal. Sci. Technol., 2016, 6, 4970
1542579 CIFC16 H11 F3 Mo O3P 1 21/c 17.2471; 31.8822; 6.7406
90; 104.266; 90
1509.41Reich, Robert M.; Kaposi, Marlene; Pöthig, Alexander; Kühn, Fritz E.
Kinetic studies of fluorinated aryl molybdenum(ii) tricarbonyl precursors in epoxidation catalysis
Catal. Sci. Technol., 2016, 6, 4970
1542580 CIFC16 H11 F3 Mo O3P 1 21/c 18.9791; 12.3295; 13.7453
90; 100.651; 90
1495.49Reich, Robert M.; Kaposi, Marlene; Pöthig, Alexander; Kühn, Fritz E.
Kinetic studies of fluorinated aryl molybdenum(ii) tricarbonyl precursors in epoxidation catalysis
Catal. Sci. Technol., 2016, 6, 4970
1542581 CIFC17 H10 F6 Mo O3P -18.4202; 10.2245; 10.5319
101.377; 102.663; 103.044
832.29Reich, Robert M.; Kaposi, Marlene; Pöthig, Alexander; Kühn, Fritz E.
Kinetic studies of fluorinated aryl molybdenum(ii) tricarbonyl precursors in epoxidation catalysis
Catal. Sci. Technol., 2016, 6, 4970
1542628 CIFC63 H39 B F24 N3 P PdP -112.7129; 13.3917; 17.6166
93.824; 90.923; 93.204
2987.2Ojwach, Stephen O.; Ogweno, Aloice O.; Akerman, Matthew P.
(Pyridyl)benzoazole palladium(ii) complexes as homogeneous catalysts in hydrogenation of alkenes and alkynes
Catal. Sci. Technol., 2016, 6, 5069
1542764 CIFC50 H45 Cl F12 N10 O3 P2 Ru2C 1 2/c 136.067; 15.5582; 18.7893
90; 92.869; 90
10530.2Roeser, Stephan; Bozoglian, Fernando; Richmond, Craig J.; League, Aaron B.; Ertem, Mehmed Z.; Francàs, Laia; Miró, Pere; Benet-Buchholz, Jordi; Cramer, Christopher J.; Llobet, Antoni
Water oxidation catalysis with ligand substituted Ru‒bpp type complexes
Catal. Sci. Technol., 2016, 6, 5088
1542765 CIFC50.5 H43.25 Cl2 N13.75 O10 Ru2P 1 21/n 115.1819; 26.556; 15.5336
90; 112.382; 90
5790.9Roeser, Stephan; Bozoglian, Fernando; Richmond, Craig J.; League, Aaron B.; Ertem, Mehmed Z.; Francàs, Laia; Miró, Pere; Benet-Buchholz, Jordi; Cramer, Christopher J.; Llobet, Antoni
Water oxidation catalysis with ligand substituted Ru‒bpp type complexes
Catal. Sci. Technol., 2016, 6, 5088
1542911 CIFC21 H17 N O7P 18.914; 10.559; 10.6874
82.779; 72.066; 70.261
900.55Osorio-Planes, Laura; Rodríguez-Escrich, Carles; Pericàs, Miquel A.
Removing the superfluous: a supported squaramide catalyst with a minimalistic linker applied to the enantioselective flow synthesis of pyranonaphthoquinones
Catal. Sci. Technol., 2016, 6, 4686
1542955 CIFC38 H60 Cl Fe N2 O3P 1 21/n 112.492; 9.7027; 31.799
90; 94.843; 90
3840.5Alhashmialameer, Dalal; Collins, Julie; Hattenhauer, Karen; Kerton, Francesca M.
Iron amino-bis(phenolate) complexes for the formation of organic carbonates from CO2and oxiranes
Catal. Sci. Technol., 2016, 6, 5364
1542956 CIFC30.5 H45 Cl Fe N2 O2.5C 1 2/c 127.898; 9.683; 23.472
90; 110.032; 90
5957Alhashmialameer, Dalal; Collins, Julie; Hattenhauer, Karen; Kerton, Francesca M.
Iron amino-bis(phenolate) complexes for the formation of organic carbonates from CO2and oxiranes
Catal. Sci. Technol., 2016, 6, 5364
1543272 CIFC23 H15 NP b c a19.533; 7.5052; 21.247
90; 90; 90
3114.8Singh, Karandeep; Singh, Ajay K.; Singh, Devendra; Singh, Rakhi; Sharma, Siddharth
Pd/Fe3O4supported on nitrogen-doped reduced graphene oxide for room-temperature isocyanide insertion reactions
Catal. Sci. Technol., 2016, 6, 3723
1543573 CIFC30 H36 F6 N5 O3 P Ru SP -18.287; 8.486; 25.305
95.062; 92.854; 97.449
1754.25Marcé, Patricia; Paterson, Andrew J.; Mahon, Mary F.; Frost, Christopher G.
Mechanistic insight into ruthenium catalysed meta-sulfonation of 2-phenylpyridine
Catal. Sci. Technol., 2016, 6, 7068
1544135 CIFC26 H20 F10 N4 ZnP 1 2/c 112.2298; 7.6667; 17.9898
90; 125.106; 90
1379.9Li, Xiao-Qing; Wang, Bin; Ji, He-Yuan; Li, Yue-Sheng
Insights into the mechanism for ring-opening polymerization of lactide catalyzed by Zn(C6F5)2/organic superbase Lewis pairs
Catal. Sci. Technol., 2016, 6, 7763
1544219 CIFC22 H22 Cl5 F5 N2 RuP 1 21/c 115.969; 10.6225; 15.6395
90; 91.922; 90
2651.45Ventura-Espinosa, David; Vicent, Cristian; Baya, Miguel; Mata, Jose A.
Ruthenium molecular complexes immobilized on graphene as active catalysts for the synthesis of carboxylic acids from alcohol dehydrogenation
Catal. Sci. Technol., 2016, 6, 8024
1544220 CIFC36 H39 Cl8 N2 RuP -111.3681; 14.3155; 14.8357
62.367; 84.064; 77.725
2090.04Ventura-Espinosa, David; Vicent, Cristian; Baya, Miguel; Mata, Jose A.
Ruthenium molecular complexes immobilized on graphene as active catalysts for the synthesis of carboxylic acids from alcohol dehydrogenation
Catal. Sci. Technol., 2016, 6, 8024
1544266 CIFC20 H26 Cl2 Co N4C 2 2 2111.8914; 12.9438; 15.3741
90; 90; 90
2366.4Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming
The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations
Catal. Sci. Technol., 2016, 6, 7408
1544267 CIFC17 H24 Cl2 Co N4P b c n14.2357; 8.2893; 15.2974
90; 90; 90
1805.2Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming
The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations
Catal. Sci. Technol., 2016, 6, 7408
1544268 CIFC28 H31 Cl2 Co N5P 1 21 111.1898; 8.5968; 14.2382
90; 103.253; 90
1333.2Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming
The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations
Catal. Sci. Technol., 2016, 6, 7408
1544269 CIFC12 H34 Cl2 Co N4 O2P -19.0263; 9.19; 13.2981
83.343; 81.332; 61.722
959.1Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming
The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations
Catal. Sci. Technol., 2016, 6, 7408
1544270 CIFC22 H32 Cl2 Co N4 OC 2 2 2111.2962; 13.9276; 14.5394
90; 90; 90
2287.5Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming
The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations
Catal. Sci. Technol., 2016, 6, 7408
1544367 CIFC19 H20.24 Cl2 Co N4 O0.12P 32 2 19.044; 9.044; 40.737
90; 90; 120
2885.6Wang, Junfei; Li, Chao; Zhou, Qianxiong; Wang, Weibo; Hou, Yuanjun; Zhang, Baowen; Wang, Xuesong
A polypyridyl Co(ii) complex-based water reduction catalyst with double H2 evolution sites
Catal. Sci. Technol., 2016, 6, 8482
1544368 CIFC18 H17 Br Cl2 Co N4P 1 21/n 114.188; 6.883; 21.321
90; 107.131; 90
1989.7Wang, Junfei; Li, Chao; Zhou, Qianxiong; Wang, Weibo; Hou, Yuanjun; Zhang, Baowen; Wang, Xuesong
A polypyridyl Co(ii) complex-based water reduction catalyst with double H2 evolution sites
Catal. Sci. Technol., 2016, 6, 8482
1544478 CIFC44 H56 N3 O RhP 1 21/n 111.4926; 17.417; 19.109
90; 103.684; 90
3716.4Palacios, Laura; Di Giuseppe, Andrea; Artigas, María José; Polo, Victor; Lahoz, Fernando J.; Castarlenas, Ricardo; Pérez-Torrente, Jesús J.; Oro, Luis A.
Mechanistic insight into the pyridine enhanced α-selectivity in alkyne hydrothiolation catalysed by quinolinolate‒rhodium(i)‒N-heterocyclic carbene complexes
Catal. Sci. Technol., 2016, 6, 8548
1544479 CIFC45 H58 N3 O RhP 1 21/n 111.3475; 17.783; 19.583
90; 103.994; 90
3834.4Palacios, Laura; Di Giuseppe, Andrea; Artigas, María José; Polo, Victor; Lahoz, Fernando J.; Castarlenas, Ricardo; Pérez-Torrente, Jesús J.; Oro, Luis A.
Mechanistic insight into the pyridine enhanced α-selectivity in alkyne hydrothiolation catalysed by quinolinolate‒rhodium(i)‒N-heterocyclic carbene complexes
Catal. Sci. Technol., 2016, 6, 8548
1544480 CIFC63 H72 N3 O RhP 1 21/n 111.4003; 29.8414; 16.2873
90; 105.512; 90
5339.1Palacios, Laura; Di Giuseppe, Andrea; Artigas, María José; Polo, Victor; Lahoz, Fernando J.; Castarlenas, Ricardo; Pérez-Torrente, Jesús J.; Oro, Luis A.
Mechanistic insight into the pyridine enhanced α-selectivity in alkyne hydrothiolation catalysed by quinolinolate‒rhodium(i)‒N-heterocyclic carbene complexes
Catal. Sci. Technol., 2016, 6, 8548
1544553 CIFC46 H32 O5P 21 21 219.6965; 17.3653; 19.2464
90; 90; 90
3240.8Samoilichenko, Yuri; Kondratenko, Veronica; Ezernitskaya, Mariam; Lyssenko, Konstantin; Peregudov, Alexander; Khrustalev, Victor; Maleev, Victor; Moskalenko, Margarita; North, Michael; Tsaloev, Alan; Gugkaeva, Zalina T.; Belokon, Yuri
A mechanistic study of the Lewis acid‒Brønsted base‒Brønsted acid catalysed asymmetric Michael addition of diethyl malonate to cyclohexenone
Catal. Sci. Technol., 2017, 7, 90
1544776 CIFC41 H52 Cl8 N8 O6 Ru2 S2C 1 2/c 131.425; 9.0156; 34.41
90; 147.193; 90
5282Su, Wei; Younus, Hussein A.; Zhou, Kui; Khattak, Zafar A. K.; Chaemcheun, Somboon; Chen, Cheng; Verpoort, Francis
Chemical and photochemical water oxidation catalyzed by novel ruthenium complexes comprising a negatively charged NCNHCO ligand
Catal. Sci. Technol., 2017, 7, 387
1545800 CIFC15 H28 N4 O7 S2P 1 21/c 17.8403; 12.7512; 10.5247
90; 91.486; 90
1051.83Deng, Jie; Xu, Bao-Hua; Wang, Yao-Feng; Mo, Xian-En; Zhang, Rui; Li, You; Zhang, Suo-Jiang
Brønsted acidic ionic liquid-catalyzed dehydrative formation of isosorbide from sorbitol: introduction of a continuous process
Catal. Sci. Technol., 2017
1545881 CIFC24 H14 Co2 O6P -18.4376; 10.1022; 13.0614
98.593; 92.973; 100.142
1080.1Wang, Gongbao; Lindeboom, Erik-Jan; Heerewaarden, Chris van; Minnaard, Adriaan J.
Synthesis of Ene-yne-enes by Nickel-Catalyzed Double SN2’ substitution of 1,6-Dichlorohexa-2,4-diyne
Catal. Sci. Technol., 2017
1545893 CIFC4 H12 Cu2 I2 N2P 42/n11.7663; 11.7663; 7.5184
90; 90; 90
1040.89Jin, Xiaodong; Davies, Robert P.
Copper-catalysed aromatic-Finkelstein reactions with amine-based ligand systems
Catal. Sci. Technol., 2017
1545894 CIFC20 H65 Cu2 I4 N15P 21 21 219.18796; 12.5494; 35.7355
90; 90; 90
4120.42Jin, Xiaodong; Davies, Robert P.
Copper-catalysed aromatic-Finkelstein reactions with amine-based ligand systems
Catal. Sci. Technol., 2017
1545895 CIFC8 H24 Cu2 I2 N4P 1 21/c 113.3569; 11.5554; 11.4189
90; 95.026; 90
1755.7Jin, Xiaodong; Davies, Robert P.
Copper-catalysed aromatic-Finkelstein reactions with amine-based ligand systems
Catal. Sci. Technol., 2017
1545973 CIFC41 H40 Cl2 N2 P2 RuP 1 21/n 111.188; 25.322; 16.401
90; 93.32; 90
4638.6Wang, Zheng; Pan, Bing; Liu, Qingbin; Yue, Erlin; Solan, Gregory A.; Ma, Yanping; Sun, Wen-Hua
Efficient acceptorless dehydrogenation of secondary alcohols to ketones mediated by a PNN-Ru(ii) catalyst
Catal. Sci. Technol., 2017, 7, 1654
1545996 CIFC25 H27 Cl2 N7 Ni O3P 1 21/c 116.1455; 19.402; 9.224
90; 103.732; 90
2806.9Dai, Zengjin; Luo, Qin; Jiang, Huan; Luo, Qi; Li, Hua; Zhang, Jing; Peng, Tianyou
Ni(II)-N′NN′ Pincer Complexes Catalyzed Dehydrogenation of Primary Alcohols to Carboxylic acids and H2 Accompanied by the Alcohol Etherification
Catal. Sci. Technol., 2017
1546243 CIFC61.5 H59 Al Cl8 N4 NiP 1 21 116.975; 15.547; 24.68
90; 101.91; 90
6373Gomes, Pedro T.; Gomes, Clara S. B.; Ribeiro, Alejandro F. G.; Fernandes, Anabela C.; Bento, Artur; do Rosário Ribeiro, Maria; Pascu, Sofia I.; Kociok-Kohn, Gabriele; Duarte, Maria Teresa Teresa
Reactivity of cationic α-diimine cyclopentadienyl nickel complexes towards AlEt2Cl: Synthesis, characterisation and ethylene polymerisation
Catal. Sci. Technol., 2017
1546244 CIFC90 H84 Al Cl9 N6 Ni3P -114.507; 16.966; 19.647
112.115; 101.465; 100.432
4212.5Gomes, Pedro T.; Gomes, Clara S. B.; Ribeiro, Alejandro F. G.; Fernandes, Anabela C.; Bento, Artur; do Rosário Ribeiro, Maria; Pascu, Sofia I.; Kociok-Kohn, Gabriele; Duarte, Maria Teresa Teresa
Reactivity of cationic α-diimine cyclopentadienyl nickel complexes towards AlEt2Cl: Synthesis, characterisation and ethylene polymerisation
Catal. Sci. Technol., 2017

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