Class information for:
Level 1: ACTIVATION STRAIN MODEL//CARBOIODINATION//IU CINQUIMA QUIM INORGAN

Basic class information

Class id #P Avg. number of
references
Database coverage
of references
18197 562 53.8 71%



Bar chart of Publication_year

Last years might be incomplete

Hierarchy of classes

The table includes all classes above and classes immediately below the current class.



Cluster id Level Cluster label #P
5 4 CHEMISTRY, ORGANIC//CHEMISTRY, INORGANIC & NUCLEAR//CHEMISTRY, MULTIDISCIPLINARY 1745167
1 3       CHEMISTRY, ORGANIC//TETRAHEDRON LETTERS//JOURNAL OF ORGANIC CHEMISTRY 237069
151 2             CROSS COUPLING//PALLADIUM//C H ACTIVATION 23051
18197 1                   ACTIVATION STRAIN MODEL//CARBOIODINATION//IU CINQUIMA QUIM INORGAN 562

Terms with highest relevance score



rank Term termType Chi square Shr. of publ. in
class containing
term
Class's shr. of
term's tot. occurrences
#P with
term in
class
1 ACTIVATION STRAIN MODEL authKW 581543 3% 63% 17
2 CARBOIODINATION authKW 217329 1% 100% 4
3 IU CINQUIMA QUIM INORGAN address 210146 4% 18% 21
4 CARBOHALOGENATION authKW 122246 1% 75% 3
5 DOUBLE GROUP TRANSFER REACTIONS authKW 122246 1% 75% 3
6 COBALTOCENYL PHOSPHINE authKW 108664 0% 100% 2
7 TRANSITION METAL MEDIATED REACTION authKW 108664 0% 100% 2
8 EIKUNDIG address 79621 3% 8% 18
9 AMSTERDAM MULTISCALE MODELING address 76394 3% 9% 16
10 ENS CHIMECOLE NORMALE SUPER address 72442 0% 67% 2

Web of Science journal categories



Rank Term Chi square Shr. of publ. in
class containing
term
Class's shr. of
term's tot. occurrences
#P with
term in
class
1 Chemistry, Inorganic & Nuclear 5791 36% 0% 203
2 Chemistry, Organic 4796 42% 0% 235
3 Chemistry, Multidisciplinary 2178 41% 0% 229
4 Chemistry, Physical 37 9% 0% 49
5 Physics, Atomic, Molecular & Chemical 14 3% 0% 19
6 Crystallography 9 2% 0% 10
7 Mathematical & Computational Biology 9 1% 0% 6
8 Chemistry, Applied 0 1% 0% 5
9 Computer Science, Interdisciplinary Applications -1 0% 0% 2
10 Mathematics, Interdisciplinary Applications -1 0% 0% 1

Address terms



Rank Term Chi square Shr. of publ. in
class containing
term
Class's shr. of
term's tot. occurrences
#P with
term in
class
1 IU CINQUIMA QUIM INORGAN 210146 4% 18% 21
2 EIKUNDIG 79621 3% 8% 18
3 AMSTERDAM MULTISCALE MODELING 76394 3% 9% 16
4 ENS CHIMECOLE NORMALE SUPER 72442 0% 67% 2
5 QUIM KIMIKA FAK 72442 0% 67% 2
6 CATALAN CHEM 54332 0% 100% 1
7 CHIM MOL ARECO ELE OSYNTH ORGANOMET 54332 0% 100% 1
8 CHIM MOL ARECO METALLOCENES HETEROCHIM 54332 0% 100% 1
9 CHIM THEORUPMC 54332 0% 100% 1
10 DSM IRAMIS NIMBE LCMCE 54332 0% 100% 1

Journals



Rank Term Chi square Shr. of publ. in
class containing
term
Class's shr. of
term's tot. occurrences
#P with
term in
class
1 ORGANOMETALLICS 24813 19% 0% 109
2 WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE 7540 1% 2% 6
3 CHEMISTRY-A EUROPEAN JOURNAL 4894 8% 0% 46
4 JOURNAL OF ORGANOMETALLIC CHEMISTRY 3455 7% 0% 42
5 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 2432 12% 0% 65
6 ORGANIC CHEMISTRY FRONTIERS 788 1% 0% 3
7 ACS CATALYSIS 568 1% 0% 6
8 DALTON TRANSACTIONS 564 2% 0% 14
9 JOURNAL OF COMPUTATIONAL CHEMISTRY 554 1% 0% 8
10 ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 531 4% 0% 20

Author Key Words



Rank Term Chi square Shr. of publ. in
class containing
term
Class's shr. of
term's tot. occurrences
#P with
term in
class
LCSH search Wikipedia search
1 ACTIVATION STRAIN MODEL 581543 3% 63% 17 Search ACTIVATION+STRAIN+MODEL Search ACTIVATION+STRAIN+MODEL
2 CARBOIODINATION 217329 1% 100% 4 Search CARBOIODINATION Search CARBOIODINATION
3 CARBOHALOGENATION 122246 1% 75% 3 Search CARBOHALOGENATION Search CARBOHALOGENATION
4 DOUBLE GROUP TRANSFER REACTIONS 122246 1% 75% 3 Search DOUBLE+GROUP+TRANSFER+REACTIONS Search DOUBLE+GROUP+TRANSFER+REACTIONS
5 COBALTOCENYL PHOSPHINE 108664 0% 100% 2 Search COBALTOCENYL+PHOSPHINE Search COBALTOCENYL+PHOSPHINE
6 TRANSITION METAL MEDIATED REACTION 108664 0% 100% 2 Search TRANSITION+METAL+MEDIATED+REACTION Search TRANSITION+METAL+MEDIATED+REACTION
7 PDII PRECATALYST 72442 0% 67% 2 Search PDII+PRECATALYST Search PDII+PRECATALYST
8 REDUCTIVE ELIMINATION 70230 3% 9% 15 Search REDUCTIVE+ELIMINATION Search REDUCTIVE+ELIMINATION
9 ENERGETIC SPAN MODEL 69852 1% 43% 3 Search ENERGETIC+SPAN+MODEL Search ENERGETIC+SPAN+MODEL
10 OXIDATIVE ADDITION 69559 5% 5% 27 Search OXIDATIVE+ADDITION Search OXIDATIVE+ADDITION

Core articles

The table includes core articles in the class. The following variables is taken into account for the relevance score of an article in a cluster c:
(1) Number of references referring to publications in the class.
(2) Share of total number of active references referring to publications in the class.
(3) Age of the article. New articles get higher score than old articles.
(4) Citation rate, normalized to year.



Rank Reference # ref.
in cl.
Shr. of ref. in
cl.
Citations
1 XUE, LQ , LIN, ZY , (2010) THEORETICAL ASPECTS OF PALLADIUM-CATALYSED CARBON-CARBON CROSS-COUPLING REACTIONS.CHEMICAL SOCIETY REVIEWS. VOL. 39. ISSUE 5. P. 1692 -1705 46 46% 164
2 GARCIA-MELCHOR, M , BRAGA, AAC , LLEDOS, A , UJAQUE, G , MASERAS, F , (2013) COMPUTATIONAL PERSPECTIVE ON PD-CATALYZED C-C CROSS-COUPLING REACTION MECHANISMS.ACCOUNTS OF CHEMICAL RESEARCH. VOL. 46. ISSUE 11. P. 2626-2634 33 62% 67
3 BORJIAN, S , TOM, DME , BAIRD, MC , (2014) PD(ETA(3)-1-PHC3H4)(ETA(5)-C5H5) AS A CATALYST PRECURSOR FOR BUCHWALD-HARTWIG AMINATION REACTIONS.ORGANOMETALLICS. VOL. 33. ISSUE 15. P. 3928 -3935 42 44% 3
4 ORTUNO, MA , LLEDOS, A , MASERAS, F , UJAQUE, G , (2014) THE TRANSMETALATION PROCESS IN SUZUKI-MIYAURA REACTIONS: CALCULATIONS INDICATE LOWER BARRIER VIA BORONATE INTERMEDIATE.CHEMCATCHEM. VOL. 6. ISSUE 11. P. 3132 -3138 35 49% 7
5 PEREZ-RODRIGUEZ, M , BRAGA, AAC , GARCIA-MELCHOR, M , PEREZ-TEMPRANO, MH , CASARES, JA , UJAQUE, G , DE LERA, AR , ALVAREZ, R , MASERAS, F , ESPINET, P , (2009) C-C REDUCTIVE ELIMINATION IN PALLADIUM COMPLEXES, AND THE ROLE OF COUPLING ADDITIVES. A DFT STUDY SUPPORTED BY EXPERIMENT.JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. VOL. 131. ISSUE 10. P. 3650 -3657 27 63% 75
6 JOVER, J , FEY, N , PURDIE, M , LLOYD-JONES, GC , HARVEY, JN , (2010) A COMPUTATIONAL STUDY OF PHOSPHINE LIGAND EFFECTS IN SUZUKI-MIYAURA COUPLING.JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL. VOL. 324. ISSUE 1-2. P. 39-47 37 45% 62
7 HIRAKAWA, T , URAMOTO, Y , MIMURA, D , TAKEDA, A , YANAGISAWA, S , IKEDA, T , INAGAKI, K , MORIKAWA, Y , (2017) FIRST-PRINCIPLES MOLECULAR DYNAMICS ANALYSIS OF LIGAND-FREE SUZUKI-MIYAURA CROSS-COUPLING IN WATER SOLVENT: OXIDATIVE ADDITION STEP.JOURNAL OF PHYSICAL CHEMISTRY B. VOL. 121. ISSUE 1. P. 164 -173 35 47% 0
8 VIDOSSICH, P , UJAQUE, G , LLEDOS, A , (2014) PALLADIUM MONOPHOSPHINE PD(PPH3): IS IT REALLY ACCESSIBLE IN SOLUTION?.CHEMICAL COMMUNICATIONS. VOL. 50. ISSUE 6. P. 661 -663 23 68% 11
9 SCHOENEBECK, F , HOUK, KN , (2010) LIGAND-CONTROLLED REGIOSELECTIVITY IN PALLADIUM-CATALYZED CROSS COUPLING REACTIONS.JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. VOL. 132. ISSUE 8. P. 2496 -+ 22 69% 84
10 BONNEY, KJ , SCHOENEBECK, F , (2014) EXPERIMENT AND COMPUTATION: A COMBINED APPROACH TO STUDY THE REACTIVITY OF PALLADIUM COMPLEXES IN OXIDATION STATES 0 TO IV.CHEMICAL SOCIETY REVIEWS. VOL. 43. ISSUE 18. P. 6609 -6638 57 23% 36

Classes with closest relation at Level 1



Rank Class id link
1 36939 ARYLMERCURIALS//ARYLMERCURIC CHLORIDES//ARYLMERCURIC HALIDES
2 13918 ARENEDIAZONIUM SALTS//HECK REACTION//LIVERPOOL MAT CATALYSIS
3 7366 METHYL BISULFATE//SCRIPPS ENERGY MAT//OLEFIN HYDROARYLATION
4 441 HECK REACTION//SUZUKI REACTION//SUZUKI MIYAURA REACTION
5 26071 TETRAMETHYLDIVINYLDISILOXANE//DIVINYLDIMETHYLSILANE//PLATINUM0
6 5649 CROSS COUPLING//GRIGNARD REAGENTS//C O ACTIVATION
7 10733 CATELLANI REACTION//CARBOPALLADATION//DOMINO REACTIONS
8 23983 MALCOLM H FILSON S//SITE SELECTIVITY//WATERBORNE CONDITIONS
9 27899 CYCLOOCTADIENE PLATINUM COMPLEXES//ORGANOAMIDE//POLYFLUOROPHENYL
10 37599 IODOPLATINATION//ACRYLAMIDE AND N N METHYLENEBISACRYLAMIDE//C C BOND IODOPLATINATION

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