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
1546245 CIFC34.25 H41.5 Al Cl4.75 N2 NiP 1 21 112.652; 23.843; 12.739
90; 100.858; 90
3774.07Gomes, 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
1546320 CIFC22 H19 Bi F3 N O3 SP -19.8797; 10.1848; 10.9733
78.19; 86.738; 83.332
1072.86Toma, Ana M.; Raţ, Ciprian I.; Pavel, Octavian D.; Hardacre, Christopher; Rüffer, Tobias; Lang, Heinrich; Mehring, Michael; Silvestru, Anca; Pârvulescu, Vasile I.
Heterocyclic bismuth(iii) compounds with transannular N→Bi interactions as catalysts for the oxidation of thiophenol to diphenyldisulfide
Catal. Sci. Technol., 2017
1546321 CIFC21 H19 Bi N2 O3P -19.634; 10.1839; 19.5747
91.79; 104.227; 93.993
1854.76Toma, Ana M.; Raţ, Ciprian I.; Pavel, Octavian D.; Hardacre, Christopher; Rüffer, Tobias; Lang, Heinrich; Mehring, Michael; Silvestru, Anca; Pârvulescu, Vasile I.
Heterocyclic bismuth(iii) compounds with transannular N→Bi interactions as catalysts for the oxidation of thiophenol to diphenyldisulfide
Catal. Sci. Technol., 2017
1546322 CIFC22 H21 Bi N2 O3P 1 21/c 19.567; 18.155; 12.596
90; 110.952; 90
2043.1Toma, Ana M.; Raţ, Ciprian I.; Pavel, Octavian D.; Hardacre, Christopher; Rüffer, Tobias; Lang, Heinrich; Mehring, Michael; Silvestru, Anca; Pârvulescu, Vasile I.
Heterocyclic bismuth(iii) compounds with transannular N→Bi interactions as catalysts for the oxidation of thiophenol to diphenyldisulfide
Catal. Sci. Technol., 2017
1546323 CIFC29 H26 Bi N O3 SP 1 21/n 112.068; 14.0151; 15.1158
90; 91.579; 90
2555.6Toma, Ana M.; Raţ, Ciprian I.; Pavel, Octavian D.; Hardacre, Christopher; Rüffer, Tobias; Lang, Heinrich; Mehring, Michael; Silvestru, Anca; Pârvulescu, Vasile I.
Heterocyclic bismuth(iii) compounds with transannular N→Bi interactions as catalysts for the oxidation of thiophenol to diphenyldisulfide
Catal. Sci. Technol., 2017
1546440 CIFC23.5 H22.5 Cu3 N4.5 O13P 1 21/m 114.9611; 18.8833; 15.2457
90; 102.243; 90
4209.2Truong, Thanh; Tran, Thuan V.; Le, Hanh T. N; Ha, Hiep Q.; Duong, Xuan N. T; Nguyen, Linh H. T; Doan, Tan L. H; Nguyen, Ha Lac
Five coordination Cu(II) cluster-based MOF and its application in synthesis of pharmaceuticals via Sp3C-H/N-H oxidative couplings
Catal. Sci. Technol., 2017
1546512 CIFC37 H33 Cl5 N2 O2 P2 RuP -18.8067; 13.5906; 16.3003
83.2903; 78.3035; 72.0401
1814.26Sahoo, Apurba Ranjan; Jiang, Fan; Bruneau, Christian; Gangavaram, Sharma; Surisetti, Suresh; Roisnel, Thierry; Dorcet, Vincent; Achard, Mathieu
Phosphine-Pyridonate Ligands Containing Octahedral Ruthenium Complexes : Access to Esters and Formic Acid
Catal. Sci. Technol., 2017
1546513 CIFC35 H40 Cl2 N2 O3 P2 RuP 1 21/n 113.1524; 14.2669; 18.7481
90; 104.965; 90
3398.7Sahoo, Apurba Ranjan; Jiang, Fan; Bruneau, Christian; Gangavaram, Sharma; Surisetti, Suresh; Roisnel, Thierry; Dorcet, Vincent; Achard, Mathieu
Phosphine-Pyridonate Ligands Containing Octahedral Ruthenium Complexes : Access to Esters and Formic Acid
Catal. Sci. Technol., 2017
1546514 CIFC37 H34 Cl4 N2 O2 P2 RuP 1 21/n 114.1626; 17.2124; 15.9415
90; 110.623; 90
3637.1Sahoo, Apurba Ranjan; Jiang, Fan; Bruneau, Christian; Gangavaram, Sharma; Surisetti, Suresh; Roisnel, Thierry; Dorcet, Vincent; Achard, Mathieu
Phosphine-Pyridonate Ligands Containing Octahedral Ruthenium Complexes : Access to Esters and Formic Acid
Catal. Sci. Technol., 2017
1546515 CIFC38.5 H36 Cl N3 O3 P2 RuP 1 c 116.1179; 16.1688; 15.2936
90; 107.19; 90
3807.6Sahoo, Apurba Ranjan; Jiang, Fan; Bruneau, Christian; Gangavaram, Sharma; Surisetti, Suresh; Roisnel, Thierry; Dorcet, Vincent; Achard, Mathieu
Phosphine-Pyridonate Ligands Containing Octahedral Ruthenium Complexes : Access to Esters and Formic Acid
Catal. Sci. Technol., 2017
1546811 CIFC48 H44 Fe2 N2 O8P -110.0781; 12.2736; 18.584
74.2212; 75.854; 70.4236
2054.25Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo
Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides
Catalysis Science & Technology, 2017, 7, 4375-4387
1546812 CIFC20 H17 N O3P 1 21/c 115.0129; 6.7964; 16.6082
90; 107.336; 90
1617.62Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo
Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides
Catalysis Science & Technology, 2017, 7, 4375-4387
1546813 CIFC24 H24 N2 O6C 1 2/c 117.9282; 11.5903; 21.7086
90; 94.633; 90
4496.2Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo
Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides
Catalysis Science & Technology, 2017, 7, 4375-4387
1546814 CIFC58 H44 Fe2 N4 O10P 1 21/n 18.639; 28.5416; 10.0003
90; 98.528; 90
2438.52Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo
Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides
Catalysis Science & Technology, 2017, 7, 4375-4387
1546834 CIFC12 H6 Hf3 O16F d -3 m34.9801; 34.9801; 34.9801
90; 90; 90
42802Nguyen, Linh H. T.; Nguyen, The T.; Nguyen, Ha L.; Doan, Tan L. H.; Tran, Phuong Hoang
A new superacid hafnium-based metal–organic framework as a highly active heterogeneous catalyst for the synthesis of benzoxazoles under solvent-free conditions
Catalysis Science & Technology, 2017, 7, 4346-4350
1546835 CIFC9 H3 Hf3 O13 S6F d -3 m34.901; 34.901; 34.901
90; 90; 90
42512Nguyen, Linh H. T.; Nguyen, The T.; Nguyen, Ha L.; Doan, Tan L. H.; Tran, Phuong Hoang
A new superacid hafnium-based metal–organic framework as a highly active heterogeneous catalyst for the synthesis of benzoxazoles under solvent-free conditions
Catalysis Science & Technology, 2017, 7, 4346-4350
1546912 CIFC0.75 K0.08 O3.52 Si1.5P -6 m 213.265; 13.265; 7.545
90; 90; 120
1149.8Łukaszuk, Katarzyna Anna; Rojo-Gama, Daniel; Øien-Ødegaard, Sigurd; Lazzarini, Andrea; Berlier, Gloria; Bordiga, Silvia; Lillerud, Karl Petter; Olsbye, Unni; Beato, Pablo; Lundegaard, Lars Fahl; Svelle, Stian
Zeolite morphology and catalyst performance: Conversion of methanol to hydrocarbons over offretite
Catal. Sci. Technol., 2017
1546913 CIFC14 K O40 Si18P -6 m 213.2558; 13.2558; 7.5358
90; 90; 120
1146.76Łukaszuk, Katarzyna Anna; Rojo-Gama, Daniel; Øien-Ødegaard, Sigurd; Lazzarini, Andrea; Berlier, Gloria; Bordiga, Silvia; Lillerud, Karl Petter; Olsbye, Unni; Beato, Pablo; Lundegaard, Lars Fahl; Svelle, Stian
Zeolite morphology and catalyst performance: Conversion of methanol to hydrocarbons over offretite
Catal. Sci. Technol., 2017
1546914 CIFC14 K O40 Si18P -6 m 213.2269; 13.2269; 7.5381
90; 90; 120
1142.1Łukaszuk, Katarzyna Anna; Rojo-Gama, Daniel; Øien-Ødegaard, Sigurd; Lazzarini, Andrea; Berlier, Gloria; Bordiga, Silvia; Lillerud, Karl Petter; Olsbye, Unni; Beato, Pablo; Lundegaard, Lars Fahl; Svelle, Stian
Zeolite morphology and catalyst performance: Conversion of methanol to hydrocarbons over offretite
Catal. Sci. Technol., 2017
1547134 CIFC35.61 H35.61 Cl4 Fe N4 O3.11P 1 21/c 127.042; 10.5667; 28.273
90; 118.213; 90
7119.1Patra, Ranjan; Coin, Guillaume; Castro, Ludovic; Dubourdeaux, Patrick; Clémancey, Martin; Pécaut, Jacques; Lebrun, Colette; Maldivi, Pascale; Latour, Jean-Marc
Rational design of Fe catalysts for olefin aziridination through DFT-based mechanistic analysis
Catal. Sci. Technol., 2017
1547242 CIFC23 H33 F6 N3 P2 RuP b c a12.4248; 20.3497; 20.8058
90; 90; 90
5260.6Landman, Iris; Paulson, Erik; Rheingold, Arnold L.; Grotjahn, Douglas; Rothenberg, Gadi
Designing bifunctional alkene isomerization catalysts using predictive modelling
Catal. Sci. Technol., 2017
1547243 CIFC37 H59 F6 N7 P2 RuP -111.7704; 13.58; 15.0853
80.426; 68.805; 70.553
2117Landman, Iris; Paulson, Erik; Rheingold, Arnold L.; Grotjahn, Douglas; Rothenberg, Gadi
Designing bifunctional alkene isomerization catalysts using predictive modelling
Catal. Sci. Technol., 2017
1547383 CIFC57 H61 Au Cl4 O3 PP 21 21 219.0107; 22.8169; 25.9541
90; 90; 90
5336.1Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547384 CIFC62 H45 Au Cl O3 P Si2P 21 21 219.7873; 12.8393; 39.6173
90; 90; 90
4978.4Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547385 CIFC32 H25 Au Cl Fe PP 4113.2861; 13.2861; 14.7974
90; 90; 90
2612Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547386 CIFC28 H33 Au Cl Fe PP 319.7478; 9.7478; 23.296
90; 90; 120
1917Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547387 CIFC32 H38 Fe O SP 21 21 219.6442; 15.8547; 17.74
90; 90; 90
2712.6Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547388 CIFC30 H57 Au Cl O3 PC 1 2 119.461; 9.2739; 20.008
90; 112.325; 90
3340.4Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547389 CIFC63 H47 O4 P Si2P 21 21 2111.6873; 13.7576; 34.499
90; 90; 90
5547.1Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena
Modular chiral gold(i) phosphite complexes
Catalysis Science & Technology, 2013, 3, 3007-3012
1547402 CIFC24 H30 Cu3 Lu2 O36P 6/m c c14.021; 14.021; 15.713
90; 90; 120
2675.1Cancino, Patricio; Paredes-Garcia, Veronica; Torres, Julia; Martínez, Sebastián; Kremer, Carlos; Spodine, Evgenia
{[Cu3Lu2(ODA)6(H2O)6]•10H2O}n . First heterometallic framework based on copper(II)/lutetium(III) for the catalytic oxidation of olefins and aromatic benzylic substrates.
Catal. Sci. Technol., 2017
1547457 CIFC24 H30 N8P -19.4167; 14.0835; 17.8245
80.071; 89.817; 79.781
2290.6Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547458 CIFC26 H32 F6 N8 O6 S2C 1 2/c 130.0913; 10.7187; 23.0764
90; 116.049; 90
6687Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547459 CIFC18 H16 N2 O2C 1 2/c 115.7795; 8.7261; 21.0431
90; 101.069; 90
2843.6Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547460 CIFC19 H15 Cl N2 O2P 1 21/c 110.335; 31.4198; 9.5959
90; 90.414; 90
3115.93Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547461 CIFC22 H28 Cl2 N8P -110.14276; 10.2202; 11.6711
79.961; 89.7958; 87.646
1190.3Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547462 CIFC29 H22 N2 O2P b c a19.4045; 7.14236; 30.4827
90; 90; 90
4224.72Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547463 CIFC24 H17 F3 N2 O2P 1 n 19.8771; 10.6875; 36.521
90; 96.428; 90
3831Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547464 CIFC20 H18 N2 O2P -111.5272; 12.3657; 12.7398
100.159; 112.561; 92.319
1638.97Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547465 CIFC96 H82 N6 O5P -111.9737; 15.384; 21.9422
70.396; 80.794; 74.763
3662.21Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547466 CIFC25 H23 Cl N2 O3 SP 1 21/n 19.1959; 11.7982; 21.0279
90; 100.29; 90
2244.73Etayo, Pablo; Escudero, Eduardo Carmelo; Pericas, Miquel A.
5,5’-Bistriazoles as axially chiral, multidentate ligands: Synthesis, configurational stability and catalytic application of their scandium(III) complexes
Catal. Sci. Technol., 2017
1547792 CIFC6 H16 N O4 ReP 1 21/c 114.9581; 7.55701; 9.3623
90; 107.339; 90
1010.21Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547793 CIFC7 H10 N O4 ReP 1 21/c 19.674; 12.4192; 8.5156
90; 108.736; 90
968.878Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547794 CIFC8 H12 N O4 ReP 1 21/c 112.2151; 10.4607; 8.8902
90; 105.704; 90
1093.57Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547795 CIFC5 H5 Br N O4 ReP -18.3466; 10.4128; 10.9082
113.523; 92.589; 97.987
855.53Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547796 CIFC6 H14 N O4 ReC 1 2/c 113.0504; 12.1955; 12.2542
90; 95.553; 90
1941.18Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547797 CIFC14 H24 N O4 ReP 1 21/m 18.9052; 8.4384; 10.9159
90; 90.016; 90
820.28Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547798 CIFC5 H5 Cl N O4 ReP 1 21/c 15.2446; 12.7123; 12.802
90; 95.597; 90
849.45Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B.
Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts
Catal. Sci. Technol., 2017
1547864 CIFC43 H38 F3 Ir N4 O3 SP 1 21/n 19.7977; 32.2237; 12.8805
90; 110.07; 90
3819.66Islamova, Regina M. M; Dobrynin, Mikhail V.; Vlasov, Andrey V.; Eremina, Anzhelika A.; Kinzhalov, Mikhail A.; Kolesnikov, Ilya E.; Zolotarev, Andrei; Masloborodova, Eleonora A.; Luzyanin, Konstantin
Iridium(III)-catalysed cross-linking of polysiloxanes leading to the thermally resistant luminescent silicone rubbers
Catalysis Science & Technology, 2017
1547865 CIFC32 H27 Cl3 Ir N3P 1 21/n 116.7446; 8.57762; 21.5557
90; 112.277; 90
2864.94Islamova, Regina M. M; Dobrynin, Mikhail V.; Vlasov, Andrey V.; Eremina, Anzhelika A.; Kinzhalov, Mikhail A.; Kolesnikov, Ilya E.; Zolotarev, Andrei; Masloborodova, Eleonora A.; Luzyanin, Konstantin
Iridium(III)-catalysed cross-linking of polysiloxanes leading to the thermally resistant luminescent silicone rubbers
Catalysis Science & Technology, 2017
1547866 CIFC33 H29 Cl3 Ir N3P 1 21/n 117.0427; 8.6872; 21.3383
90; 109.838; 90
2971.73Islamova, Regina M. M; Dobrynin, Mikhail V.; Vlasov, Andrey V.; Eremina, Anzhelika A.; Kinzhalov, Mikhail A.; Kolesnikov, Ilya E.; Zolotarev, Andrei; Masloborodova, Eleonora A.; Luzyanin, Konstantin
Iridium(III)-catalysed cross-linking of polysiloxanes leading to the thermally resistant luminescent silicone rubbers
Catalysis Science & Technology, 2017

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