Systematic experimental charge density: linking structural modifications to electron density distributions
Systematic experimental charge density: linking structural modifications to electron density distributions
Recent elegant examples illustrate the power of charge density analysis, employed in a systematic way, to link electron density distribution to molecular structure. This leads to new insights into important chemical systems and the effects of systematic modifications to them. The advances made in extracting the electron density distribution from standard resolution X-ray diffraction data and the subsequent use of this information in systematic studies are also described.
2-9
Kirby, Isabelle L.
5839d488-f346-4741-b757-9ecf30777938
Pitak, Mateusz B.
eeb6a00f-2291-4376-830f-d30dfd607ed1
Coles, Simon J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Gale, Philip A.
c840b7e9-6847-4843-91af-fa0f8563d943
2015
Kirby, Isabelle L.
5839d488-f346-4741-b757-9ecf30777938
Pitak, Mateusz B.
eeb6a00f-2291-4376-830f-d30dfd607ed1
Coles, Simon J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Gale, Philip A.
c840b7e9-6847-4843-91af-fa0f8563d943
Kirby, Isabelle L., Pitak, Mateusz B., Coles, Simon J. and Gale, Philip A.
(2015)
Systematic experimental charge density: linking structural modifications to electron density distributions.
Chemistry Letters, 44 (1), .
(doi:10.1246/cl.140929).
Abstract
Recent elegant examples illustrate the power of charge density analysis, employed in a systematic way, to link electron density distribution to molecular structure. This leads to new insights into important chemical systems and the effects of systematic modifications to them. The advances made in extracting the electron density distribution from standard resolution X-ray diffraction data and the subsequent use of this information in systematic studies are also described.
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Accepted/In Press date: 19 October 2014
e-pub ahead of print date: 25 October 2014
Published date: 2015
Organisations:
Organic Chemistry: Synthesis, Catalysis and Flow
Identifiers
Local EPrints ID: 373810
URI: http://eprints.soton.ac.uk/id/eprint/373810
ISSN: 0366-7022
PURE UUID: 67eb464c-d39e-4705-8b20-cb514e4d8a1f
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Date deposited: 02 Feb 2015 13:01
Last modified: 15 Mar 2024 03:06
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Contributors
Author:
Isabelle L. Kirby
Author:
Mateusz B. Pitak
Author:
Philip A. Gale
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