Zobrazeno 1 - 9
of 9
pro vyhledávání: '"Simon Gückel"'
Autor:
Martin Kaupp, Seyed Mohammad Bagher Hosseini Ghazvini, Paul J. Low, Josef B. G. Gluyas, Simon Gückel, Parvin Safari, Michael R. Hall
Publikováno v:
Organometallics. 40:346-357
The spectroelectrochemically generated infrared (IR) and near-infrared spectra of the homo-bimetallic, hexa-1,3,5-triyn-1,6-diyl-bridged complex cations [{Cp*(dppe)M}(μ-C≡CC≡CC≡C){M(dppe)Cp*}]+ (M ...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e75b0eae49431434355fed1f9bea009d
https://doi.org/10.1021/acs.organomet.0c00681
https://doi.org/10.1021/acs.organomet.0c00681
Autor:
Parvin Safari, Simon Gückel, Josef B. G. Gluyas, Stephen A. Moggach, Martin Kaupp, Paul J. Low
Publikováno v:
Chemistry (Weinheim an der Bergstrasse, Germany). 28(44)
The electronic structure and associated spectroscopic properties of ligand-bridged, bimetallic 'mixed-valence' complexes of the general form {M}(μ-B){M
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e156d3f8542da9cd879572fa2bebfac2
https://pubmed.ncbi.nlm.nih.gov/35642131
https://pubmed.ncbi.nlm.nih.gov/35642131
Autor:
Robin Grotjahn, Simon Gückel, Alexei V. Arbuznikov, Matthias Haasler, Martin Kaupp, Toni M. Maier
Publikováno v:
Journal of chemical theory and computation. 16(9)
A new local hybrid functional, LH20t, with a position-dependent exact-exchange admixture governed by a simple local mixing function (g(r) = b·τW(r)/τ(r)), combined with gradient-corrected (PBE) exc...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6f1db42c6d9c33adaf0379f3d2210f75
https://pubmed.ncbi.nlm.nih.gov/32697913
https://pubmed.ncbi.nlm.nih.gov/32697913
Autor:
Samantha G. Eaves, Alexandre N. Sobolev, Paul J. Low, Simon Gückel, Parvin Safari, Martin Kaupp, Dmitry S. Yufit, Josef B. G. Gluyas
Publikováno v:
Chemistry – a European journal, 2019, Vol.25(37), pp.8837-8853 [Peer Reviewed Journal]
Climate warming is supposed to enlarge the area climatically suitable to the naturalization of alien garden plants in temperate regions. However, the effects of a changing climate on the spread of naturalized ornamentals have not been evaluated by sp
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::92eaa09d818a9c4c845e25a6d4f2387b
https://pubmed.ncbi.nlm.nih.gov/31050060
https://pubmed.ncbi.nlm.nih.gov/31050060
Publikováno v:
Chemistry - A European Journal. 22:16138-16146
The electronic characteristics of mixed-valence complexes are often inferred from the shape of the inter-valence charge transfer (IVCT) band, which usually falls in the near infrared (NIR) region, and relationships derived from Marcus-Hush theory. Th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d5ce39dbe7fefff9b1557a1c85f0b4f1
https://doi.org/10.1002/chem.201603236
https://doi.org/10.1002/chem.201603236
Autor:
Simon Gückel, Paul J. Low, Martin Kaupp, Qiang Zeng, František Hartl, Josef B. G. Gluyas, Kevin B. Vincent
Publikováno v:
Journal of Organometallic Chemistry. 821:40-47
Tetrakis(ferrocenylethynyl)ethene (1) has been prepared in four steps from ethynyl ferrocene (2). In a dichloromethane solution containing 10−1 M NBu4[PF6], only a single oxidation process is observed by cyclic voltammetry, corresponding to the ind
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::bf95046f6dd90cd3a54effdc1debdc52
https://doi.org/10.1016/j.jorganchem.2016.04.018
https://doi.org/10.1016/j.jorganchem.2016.04.018
Autor:
Mark W. Whiteley, Simon Gückel, Alexandre N. Sobolev, Claude Lapinte, Josef B. G. Gluyas, Martin Kaupp, Jean-François Halet, Sarah El-Tarhuni, Paul J. Low
Publikováno v:
Organometallics
Organometallics, 2018, 37 (9), pp.1432-1445. ⟨10.1021/acs.organomet.8b00099⟩
Organometallics, American Chemical Society, 2018, 37 (9), pp.1432-1445. ⟨10.1021/acs.organomet.8b00099⟩
Organometallics, 2018, 37 (9), pp.1432-1445. ⟨10.1021/acs.organomet.8b00099⟩
Organometallics, American Chemical Society, 2018, 37 (9), pp.1432-1445. ⟨10.1021/acs.organomet.8b00099⟩
International audience; The electronic structures of the prototypical bimetallic buta-1,3-diyn-1,4-diyl-bridged radical cation complexes [{M(dppe)Cp'}(2)(mu-C CC C)](+) (M= Fe, Cp' = Cp* (1a), Cp (1b); M = Ru, Cp' = Cp* (2a), Cp (2b)) have been (re)i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b912838c5bcd750170bda5e0426346e3
https://univ-rennes.hal.science/hal-01807083
https://univ-rennes.hal.science/hal-01807083
Autor:
Dmitry S. Yufit, Valentina Manici, Josef B. G. Gluyas, Andrew Beeby, Simon Gückel, Judith A. K. Howard, Martin Kaupp, Brian W. Skelton, Paul J. Low, Kevin B. Vincent
Publikováno v:
Journal of organic chemistry, 2015, Vol.80(22), pp.11501-11512 [Peer Reviewed Journal]
A series of cross-conjugated compounds based on an (E)-4,4′-(hexa-3-en-1,5-diyne-3,4-diyl)bis(N,N-bis(4-methoxyphenyl)aniline) skeleton (1–6) have been synthesized. The linear optical absorption properties can be tuned by modification of the subs
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3ff0e07a2bacc0802978a4766f0a6568
https://doi.org/10.1021/acs.joc.5b02240
https://doi.org/10.1021/acs.joc.5b02240
Autor:
Christoph Lambert, Kolja Theilacker, Simon Gückel, Martin Kaupp, Sascha Klawohn, Manuel Renz, Matthias Parthey
Publikováno v:
Journal of Computational Chemistry. 37:93-102
A series of paracyclophane (PC) bridged mixed-valence (MV) bis-triarylamine radical cations with different ([2.2], [3.3], [4.4]) linkers, with and without additional ethynyl spacers, have been studied by quantum-chemical calculations (BLYP35-D3/TZVP/
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8739ec0cb0a81150d226bbe26aeaac15
https://doi.org/10.1002/jcc.24038
https://doi.org/10.1002/jcc.24038