Mapping the properties of bidentate ligands with calculated descriptors (LKB-bid)-Reference-Cited by-同舟云学术

Mapping the properties of bidentate ligands with calculated descriptors (LKB-bid)

Published:2020 Issue:24 Volume:49 Page:8169-8178
ISSN:1477-9226
Container-title:Dalton Transactions
language:en
Short-container-title:Dalton Trans.

Author:

Fey Natalie¹²³⁴^ORCID,Koumi Alexander¹²³⁴,Malkov Andrei V.⁵⁶⁷⁴^ORCID,Moseley Jonathan D.⁸⁹⁴^ORCID,Nguyen Bao N.¹¹⁰¹¹⁴^ORCID,Tyler Simon N. G.⁸⁹⁴,Willans Charlotte E.¹¹⁰¹¹⁴^ORCID

Affiliation:

1. School of Chemistry

2. University of Bristol

3. Bristol BS8 1TS

4. UK

5. Department of Chemistry

6. Loughborough University

7. Leicestershire

8. CatSci Ltd.

9. Cardiff

10. University of Leeds

11. Leeds

Abstract

Ligand space for bidentates has been mapped, computationally, varying donors, substituents and backbones, to give a new database, LKB-bid.

Funder

Llywodraeth Cymru

Engineering and Physical Sciences Research Council

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2020/DT/D0DT01694B

Reference49 articles.

1. Rational design of diphosphorus ligands – a route to superior catalysts

2. Parameterization of phosphine ligands demonstrates enhancement of nickel catalysis via remote steric effects

3. Catalytic applications of small bite-angle diphosphorus ligands with single-atom linkers

4. Computational Ligand Descriptors for Catalyst Design

5. The Development of L2X2RuCHR Olefin Metathesis Catalysts: An Organometallic Success Story

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