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http://hdl.handle.net/2445/154618
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DC Field | Value | Language |
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dc.contributor.author | Pineiro-Lopez, Lucia | - |
dc.contributor.author | Ortega-Villar, Norma | - |
dc.contributor.author | Carmen Munoz, M. | - |
dc.contributor.author | Molnar, Gabor | - |
dc.contributor.author | Cirera Fernández, Jordi | - |
dc.contributor.author | Moreno-Esparza, Rafael | - |
dc.contributor.author | Ugalde-Saldivar, Victor M. | - |
dc.contributor.author | Bousseksou, Azzedine | - |
dc.contributor.author | Ruiz Sabín, Eliseo | - |
dc.contributor.author | Real, Jose A. | - |
dc.date.accessioned | 2020-04-01T08:07:20Z | - |
dc.date.available | 2020-04-01T08:07:20Z | - |
dc.date.issued | 2016-08-26 | - |
dc.identifier.issn | 0947-6539 | - |
dc.identifier.uri | http://hdl.handle.net/2445/154618 | - |
dc.description.abstract | The highly stable nitrosyl iron(II) mononuclear complex [Fe(bztpen)(NO)](PF6)(2) (bztpen=N-benzyl-N,N',N'-tris(2-pyridylmethyl)ethylenediamine) displays an S=1/2 <-> S=3/2 spin crossover (SCO) behavior (T-1/2=370 K, Delta H= 12.48 kJmol(-1), Delta S=33 JK(-1) mol(-1)) stemming from strong magnetic coupling between the NO radical (S=1/2) and thermally interconverted (S=0 <-> S=2) ferrous spin states. The crystal structure of this robust complex has been investigated in the temperature range 120-420 K affording a detailed picture of how the electronic distribution of the t(2g)-e(g) orbitals modulates the structure of the {FeNO}(7) bond, providing valuable magneto-structural and spectroscopic correlations and DFT analysis. | - |
dc.format.extent | 11 p. | - |
dc.format.mimetype | application/pdf | - |
dc.language.iso | eng | - |
dc.publisher | Wiley-VCH | - |
dc.relation.isformatof | Versió postprint del document publicat a: https://doi.org/10.1002/chem.201601172 | - |
dc.relation.ispartof | Chemistry-A European Journal, 2016, vol. 22, num. 36, p. 12741-12751 | - |
dc.relation.uri | https://doi.org/10.1002/chem.201601172 | - |
dc.rights | (c) Wiley-VCH, 2016 | - |
dc.source | Articles publicats en revistes (Química Inorgànica i Orgànica) | - |
dc.subject.classification | Òxid nítric | - |
dc.subject.classification | Ferro | - |
dc.subject.classification | Estructura molecular | - |
dc.subject.other | Nitric oxide | - |
dc.subject.other | Iron | - |
dc.subject.other | Molecular structure | - |
dc.title | Electronic structure modulation in an exceptionally stable non-heme nitrosyl iron(II) spin-crossover complex | - |
dc.type | info:eu-repo/semantics/article | - |
dc.type | info:eu-repo/semantics/acceptedVersion | - |
dc.identifier.idgrec | 666997 | - |
dc.date.updated | 2020-04-01T08:07:21Z | - |
dc.rights.accessRights | info:eu-repo/semantics/openAccess | - |
Appears in Collections: | Articles publicats en revistes (Química Inorgànica i Orgànica) |
Files in This Item:
File | Description | Size | Format | |
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666997.pdf | 1.39 MB | Adobe PDF | View/Open |
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