Ligand rotation distinguishes first- and second-generation ruthenium metathesis catalysts

Adlhart, Christian; Chen, Peter

doi:10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q

Full metadata record

DC Field	Value	Language
dc.contributor.author	Adlhart, Christian	-
dc.contributor.author	Chen, Peter	-
dc.date.accessioned	2018-01-17T12:25:30Z	-
dc.date.available	2018-01-17T12:25:30Z	-
dc.date.issued	2002-12-02	-
dc.identifier.issn	1433-7851	de_CH
dc.identifier.issn	0570-0833	de_CH
dc.identifier.uri	https://digitalcollection.zhaw.ch/handle/11475/2096	-
dc.description.abstract	QM/MM provides a new twist: In olefin metathesis with first‐generation Ru catalyst 1, the rotation of the phosphane ligand with threefold symmetry is the rate‐determining step. Second‐generation catalyst 2 is more active: the rotation step is not required as the carbene ligand has twofold symmetry. Combined QM/MM calculations confirm the results of earlier experimental investigations.	de_CH
dc.language.iso	en	de_CH
dc.publisher	Wiley	de_CH
dc.relation.ispartof	Angewandte Chemie: International Edition	de_CH
dc.rights	Licence according to publishing contract	de_CH
dc.subject	Force-field calculations	de_CH
dc.subject	Theoretical chemistry	de_CH
dc.subject	Density-functional calculations	de_CH
dc.subject	Homogeneous catalysis	de_CH
dc.subject.ddc	660: Technische Chemie	de_CH
dc.title	Ligand rotation distinguishes first- and second-generation ruthenium metathesis catalysts	de_CH
dc.type	Beitrag in wissenschaftlicher Zeitschrift	de_CH
dcterms.type	Text	de_CH
zhaw.departement	Life Sciences und Facility Management	de_CH
zhaw.organisationalunit	Institut für Chemie und Biotechnologie (ICBT)	de_CH
dc.identifier.doi	10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q	de_CH
zhaw.funding.eu	No	de_CH
zhaw.issue	23	de_CH
zhaw.originated.zhaw	Yes	de_CH
zhaw.pages.end	4487	de_CH
zhaw.pages.start	4484	de_CH
zhaw.publication.status	publishedVersion	de_CH
zhaw.volume	41	de_CH
zhaw.publication.review	Peer review (Publikation)	de_CH
Appears in collections:	Publikationen Life Sciences und Facility Management

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Adlhart, C., & Chen, P. (2002). Ligand rotation distinguishes first- and second-generation ruthenium metathesis catalysts. Angewandte Chemie: International Edition, 41(23), 4484–4487. https://doi.org/10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q

Adlhart, C. and Chen, P. (2002) ‘Ligand rotation distinguishes first- and second-generation ruthenium metathesis catalysts’, Angewandte Chemie: International Edition, 41(23), pp. 4484–4487. Available at: https://doi.org/10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q.

C. Adlhart and P. Chen, “Ligand rotation distinguishes first- and second-generation ruthenium metathesis catalysts,” Angewandte Chemie: International Edition, vol. 41, no. 23, pp. 4484–4487, Dec. 2002, doi: 10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q.

ADLHART, Christian und Peter CHEN, 2002. Ligand rotation distinguishes first- and second-generation ruthenium metathesis catalysts. Angewandte Chemie: International Edition. 2 Dezember 2002. Bd. 41, Nr. 23, S. 4484–4487. DOI 10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q

Adlhart, Christian, and Peter Chen. 2002. “Ligand Rotation Distinguishes First- and Second-Generation Ruthenium Metathesis Catalysts.” Angewandte Chemie: International Edition 41 (23): 4484–87. https://doi.org/10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q.

Adlhart, Christian, and Peter Chen. “Ligand Rotation Distinguishes First- and Second-Generation Ruthenium Metathesis Catalysts.” Angewandte Chemie: International Edition, vol. 41, no. 23, Dec. 2002, pp. 4484–87, https://doi.org/10.1002/1521-3773(20021202)41:23<4484::AID-ANIE4484>3.0.CO;2-Q.