Magnetic behavior of the novel pentagonal-bipyramidal erbium() complex (EtNH)[Er(HDAPS)Cl]: high-frequency EPR study and crystal-field analysis
We report the synthesis, crystal structure and magnetic properties of the new heptacoordinated mononuclear erbium( iii ) complex (Et 3 NH)[Er(H 2 DAPS)Cl 2 ] (H 4 DAPS = 2,6-diacetylpyridine bis-(salicylhydrazone)) ( 1 ). The coordination polyhedron around the Er( iii ) ion features a slightly disto...
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Veröffentlicht in: | Dalton transactions : an international journal of inorganic chemistry 2021-12, Vol.5 (48), p.18143-18154 |
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creator | Spillecke, Lena Koo, Changhyun Maximova, Olga Mironov, Vladimir S Kopotkov, Vycheslav A Korchagin, Denis V Vasiliev, Alexander N Yagubskii, Eduard B Klingeler, Rüdiger |
description | We report the synthesis, crystal structure and magnetic properties of the new heptacoordinated mononuclear erbium(
iii
) complex (Et
3
NH)[Er(H
2
DAPS)Cl
2
] (H
4
DAPS = 2,6-diacetylpyridine bis-(salicylhydrazone)) (
1
). The coordination polyhedron around the Er(
iii
) ion features a slightly distorted pentagonal bipyramid formed by the pentagonal N
3
O
2
chelate ring of the H
2
DAPS ligand in the equatorial plane and two apical chloride ligands. Detailed high-frequency/high-field electron paramagnetic resonance (HF-EPR) studies of
1
result in the precise determination of the crystal field (CF) splitting energies (0, 290 and 460 GHz) and effective
g
-values of the three lowest Kramers doublets (KDs) of the Er(
iii
) ion. The obtained HF-EPR data are in good agreement with the results from CF analysis for the Er(
iii
) ion based on the simulation of the dc magnetic data of
1
. The results from dynamic susceptibility measurements indicate that there is no slow relaxation of magnetisation behaviour. This observation is discussed in terms of the electronic structure of
1
obtained from experimental and theoretical results.
We precisely quantified the zero field splittings of the lowest Kramers doublets for a novel Er(
iii
) mononuclear complex by HF-EPR. |
doi_str_mv | 10.1039/d1dt03228c |
format | Article |
fullrecord | <record><control><sourceid>proquest_cross</sourceid><recordid>TN_cdi_crossref_primary_10_1039_D1DT03228C</recordid><sourceformat>XML</sourceformat><sourcesystem>PC</sourcesystem><sourcerecordid>2605597454</sourcerecordid><originalsourceid>FETCH-LOGICAL-c337t-850c3edfd3b44e1938c8bda403a6b44e038654f739a3a73d1020c44940b7e44b3</originalsourceid><addsrcrecordid>eNpd0U1v1DAQBmALUdFSuHAHWeKyixRwMs5Xb9Xulq1UoIJyQihy7MmuKycOtlORX9G_3LTbLhInWzOPXo30EvImZh9jBuUnFavAIEkK-YwcxTzPozIB_nz_T7JD8tL7a8aShKXJC3IIvEg5h-yI3H4Rmw6DlrTGrbjR1lHb0LBF2tkbNLTHLoiN7YSJat2PTrRaCUPR1XpoZ3Mqbdsb_Etnq_B1Pf-1crP18vTyx3xhfp_Qrd5so8bhnwE7OdLV5Xfqw6BGKjpFpRt9mGIbjUZNE2FGr_0rctAI4_H143tMfp6trhbr6OLb5_PF6UUkAfIQFSmTgKpRUHOOcQmFLGolOAOR3U8YFFnKmxxKASIHFbOESc5LzuocOa_hmMx2ub2z03k-VK32Eo0RHdrBV0nG0rTMecon-v4_em0HN937oMqsYCmDSX3YKems9w6bqne6FW6sYlbd11Qt4-XVQ02LCb97jBzqFtWePvUygbc74Lzcb__1DHdONpZN</addsrcrecordid><sourcetype>Aggregation Database</sourcetype><iscdi>true</iscdi><recordtype>article</recordtype><pqid>2609680503</pqid></control><display><type>article</type><title>Magnetic behavior of the novel pentagonal-bipyramidal erbium() complex (EtNH)[Er(HDAPS)Cl]: high-frequency EPR study and crystal-field analysis</title><source>Royal Society Of Chemistry Journals 2008-</source><source>Alma/SFX Local Collection</source><creator>Spillecke, Lena ; Koo, Changhyun ; Maximova, Olga ; Mironov, Vladimir S ; Kopotkov, Vycheslav A ; Korchagin, Denis V ; Vasiliev, Alexander N ; Yagubskii, Eduard B ; Klingeler, Rüdiger</creator><creatorcontrib>Spillecke, Lena ; Koo, Changhyun ; Maximova, Olga ; Mironov, Vladimir S ; Kopotkov, Vycheslav A ; Korchagin, Denis V ; Vasiliev, Alexander N ; Yagubskii, Eduard B ; Klingeler, Rüdiger</creatorcontrib><description>We report the synthesis, crystal structure and magnetic properties of the new heptacoordinated mononuclear erbium(
iii
) complex (Et
3
NH)[Er(H
2
DAPS)Cl
2
] (H
4
DAPS = 2,6-diacetylpyridine bis-(salicylhydrazone)) (
1
). The coordination polyhedron around the Er(
iii
) ion features a slightly distorted pentagonal bipyramid formed by the pentagonal N
3
O
2
chelate ring of the H
2
DAPS ligand in the equatorial plane and two apical chloride ligands. Detailed high-frequency/high-field electron paramagnetic resonance (HF-EPR) studies of
1
result in the precise determination of the crystal field (CF) splitting energies (0, 290 and 460 GHz) and effective
g
-values of the three lowest Kramers doublets (KDs) of the Er(
iii
) ion. The obtained HF-EPR data are in good agreement with the results from CF analysis for the Er(
iii
) ion based on the simulation of the dc magnetic data of
1
. The results from dynamic susceptibility measurements indicate that there is no slow relaxation of magnetisation behaviour. This observation is discussed in terms of the electronic structure of
1
obtained from experimental and theoretical results.
We precisely quantified the zero field splittings of the lowest Kramers doublets for a novel Er(
iii
) mononuclear complex by HF-EPR.</description><identifier>ISSN: 1477-9226</identifier><identifier>EISSN: 1477-9234</identifier><identifier>DOI: 10.1039/d1dt03228c</identifier><identifier>PMID: 34854436</identifier><language>eng</language><publisher>England: Royal Society of Chemistry</publisher><subject>Crystal structure ; Electron paramagnetic resonance ; Electronic structure ; Erbium ; Ligands ; Magnetic properties</subject><ispartof>Dalton transactions : an international journal of inorganic chemistry, 2021-12, Vol.5 (48), p.18143-18154</ispartof><rights>Copyright Royal Society of Chemistry 2021</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c337t-850c3edfd3b44e1938c8bda403a6b44e038654f739a3a73d1020c44940b7e44b3</citedby><cites>FETCH-LOGICAL-c337t-850c3edfd3b44e1938c8bda403a6b44e038654f739a3a73d1020c44940b7e44b3</cites><orcidid>0000-0002-0199-1382 ; 0000-0002-8816-9614 ; 0000-0003-0163-6783 ; 0000-0002-7654-232X ; 0000-0003-3558-6761</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><link.rule.ids>314,780,784,27924,27925</link.rule.ids><backlink>$$Uhttps://www.ncbi.nlm.nih.gov/pubmed/34854436$$D View this record in MEDLINE/PubMed$$Hfree_for_read</backlink></links><search><creatorcontrib>Spillecke, Lena</creatorcontrib><creatorcontrib>Koo, Changhyun</creatorcontrib><creatorcontrib>Maximova, Olga</creatorcontrib><creatorcontrib>Mironov, Vladimir S</creatorcontrib><creatorcontrib>Kopotkov, Vycheslav A</creatorcontrib><creatorcontrib>Korchagin, Denis V</creatorcontrib><creatorcontrib>Vasiliev, Alexander N</creatorcontrib><creatorcontrib>Yagubskii, Eduard B</creatorcontrib><creatorcontrib>Klingeler, Rüdiger</creatorcontrib><title>Magnetic behavior of the novel pentagonal-bipyramidal erbium() complex (EtNH)[Er(HDAPS)Cl]: high-frequency EPR study and crystal-field analysis</title><title>Dalton transactions : an international journal of inorganic chemistry</title><addtitle>Dalton Trans</addtitle><description>We report the synthesis, crystal structure and magnetic properties of the new heptacoordinated mononuclear erbium(
iii
) complex (Et
3
NH)[Er(H
2
DAPS)Cl
2
] (H
4
DAPS = 2,6-diacetylpyridine bis-(salicylhydrazone)) (
1
). The coordination polyhedron around the Er(
iii
) ion features a slightly distorted pentagonal bipyramid formed by the pentagonal N
3
O
2
chelate ring of the H
2
DAPS ligand in the equatorial plane and two apical chloride ligands. Detailed high-frequency/high-field electron paramagnetic resonance (HF-EPR) studies of
1
result in the precise determination of the crystal field (CF) splitting energies (0, 290 and 460 GHz) and effective
g
-values of the three lowest Kramers doublets (KDs) of the Er(
iii
) ion. The obtained HF-EPR data are in good agreement with the results from CF analysis for the Er(
iii
) ion based on the simulation of the dc magnetic data of
1
. The results from dynamic susceptibility measurements indicate that there is no slow relaxation of magnetisation behaviour. This observation is discussed in terms of the electronic structure of
1
obtained from experimental and theoretical results.
We precisely quantified the zero field splittings of the lowest Kramers doublets for a novel Er(
iii
) mononuclear complex by HF-EPR.</description><subject>Crystal structure</subject><subject>Electron paramagnetic resonance</subject><subject>Electronic structure</subject><subject>Erbium</subject><subject>Ligands</subject><subject>Magnetic properties</subject><issn>1477-9226</issn><issn>1477-9234</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2021</creationdate><recordtype>article</recordtype><recordid>eNpd0U1v1DAQBmALUdFSuHAHWeKyixRwMs5Xb9Xulq1UoIJyQihy7MmuKycOtlORX9G_3LTbLhInWzOPXo30EvImZh9jBuUnFavAIEkK-YwcxTzPozIB_nz_T7JD8tL7a8aShKXJC3IIvEg5h-yI3H4Rmw6DlrTGrbjR1lHb0LBF2tkbNLTHLoiN7YSJat2PTrRaCUPR1XpoZ3Mqbdsb_Etnq_B1Pf-1crP18vTyx3xhfp_Qrd5so8bhnwE7OdLV5Xfqw6BGKjpFpRt9mGIbjUZNE2FGr_0rctAI4_H143tMfp6trhbr6OLb5_PF6UUkAfIQFSmTgKpRUHOOcQmFLGolOAOR3U8YFFnKmxxKASIHFbOESc5LzuocOa_hmMx2ub2z03k-VK32Eo0RHdrBV0nG0rTMecon-v4_em0HN937oMqsYCmDSX3YKems9w6bqne6FW6sYlbd11Qt4-XVQ02LCb97jBzqFtWePvUygbc74Lzcb__1DHdONpZN</recordid><startdate>20211214</startdate><enddate>20211214</enddate><creator>Spillecke, Lena</creator><creator>Koo, Changhyun</creator><creator>Maximova, Olga</creator><creator>Mironov, Vladimir S</creator><creator>Kopotkov, Vycheslav A</creator><creator>Korchagin, Denis V</creator><creator>Vasiliev, Alexander N</creator><creator>Yagubskii, Eduard B</creator><creator>Klingeler, Rüdiger</creator><general>Royal Society of Chemistry</general><scope>NPM</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>7SR</scope><scope>7U5</scope><scope>8BQ</scope><scope>8FD</scope><scope>JG9</scope><scope>L7M</scope><scope>7X8</scope><orcidid>https://orcid.org/0000-0002-0199-1382</orcidid><orcidid>https://orcid.org/0000-0002-8816-9614</orcidid><orcidid>https://orcid.org/0000-0003-0163-6783</orcidid><orcidid>https://orcid.org/0000-0002-7654-232X</orcidid><orcidid>https://orcid.org/0000-0003-3558-6761</orcidid></search><sort><creationdate>20211214</creationdate><title>Magnetic behavior of the novel pentagonal-bipyramidal erbium() complex (EtNH)[Er(HDAPS)Cl]: high-frequency EPR study and crystal-field analysis</title><author>Spillecke, Lena ; Koo, Changhyun ; Maximova, Olga ; Mironov, Vladimir S ; Kopotkov, Vycheslav A ; Korchagin, Denis V ; Vasiliev, Alexander N ; Yagubskii, Eduard B ; Klingeler, Rüdiger</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c337t-850c3edfd3b44e1938c8bda403a6b44e038654f739a3a73d1020c44940b7e44b3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2021</creationdate><topic>Crystal structure</topic><topic>Electron paramagnetic resonance</topic><topic>Electronic structure</topic><topic>Erbium</topic><topic>Ligands</topic><topic>Magnetic properties</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Spillecke, Lena</creatorcontrib><creatorcontrib>Koo, Changhyun</creatorcontrib><creatorcontrib>Maximova, Olga</creatorcontrib><creatorcontrib>Mironov, Vladimir S</creatorcontrib><creatorcontrib>Kopotkov, Vycheslav A</creatorcontrib><creatorcontrib>Korchagin, Denis V</creatorcontrib><creatorcontrib>Vasiliev, Alexander N</creatorcontrib><creatorcontrib>Yagubskii, Eduard B</creatorcontrib><creatorcontrib>Klingeler, Rüdiger</creatorcontrib><collection>PubMed</collection><collection>CrossRef</collection><collection>Engineered Materials Abstracts</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Materials Research Database</collection><collection>Advanced Technologies Database with Aerospace</collection><collection>MEDLINE - Academic</collection><jtitle>Dalton transactions : an international journal of inorganic chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Spillecke, Lena</au><au>Koo, Changhyun</au><au>Maximova, Olga</au><au>Mironov, Vladimir S</au><au>Kopotkov, Vycheslav A</au><au>Korchagin, Denis V</au><au>Vasiliev, Alexander N</au><au>Yagubskii, Eduard B</au><au>Klingeler, Rüdiger</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Magnetic behavior of the novel pentagonal-bipyramidal erbium() complex (EtNH)[Er(HDAPS)Cl]: high-frequency EPR study and crystal-field analysis</atitle><jtitle>Dalton transactions : an international journal of inorganic chemistry</jtitle><addtitle>Dalton Trans</addtitle><date>2021-12-14</date><risdate>2021</risdate><volume>5</volume><issue>48</issue><spage>18143</spage><epage>18154</epage><pages>18143-18154</pages><issn>1477-9226</issn><eissn>1477-9234</eissn><abstract>We report the synthesis, crystal structure and magnetic properties of the new heptacoordinated mononuclear erbium(
iii
) complex (Et
3
NH)[Er(H
2
DAPS)Cl
2
] (H
4
DAPS = 2,6-diacetylpyridine bis-(salicylhydrazone)) (
1
). The coordination polyhedron around the Er(
iii
) ion features a slightly distorted pentagonal bipyramid formed by the pentagonal N
3
O
2
chelate ring of the H
2
DAPS ligand in the equatorial plane and two apical chloride ligands. Detailed high-frequency/high-field electron paramagnetic resonance (HF-EPR) studies of
1
result in the precise determination of the crystal field (CF) splitting energies (0, 290 and 460 GHz) and effective
g
-values of the three lowest Kramers doublets (KDs) of the Er(
iii
) ion. The obtained HF-EPR data are in good agreement with the results from CF analysis for the Er(
iii
) ion based on the simulation of the dc magnetic data of
1
. The results from dynamic susceptibility measurements indicate that there is no slow relaxation of magnetisation behaviour. This observation is discussed in terms of the electronic structure of
1
obtained from experimental and theoretical results.
We precisely quantified the zero field splittings of the lowest Kramers doublets for a novel Er(
iii
) mononuclear complex by HF-EPR.</abstract><cop>England</cop><pub>Royal Society of Chemistry</pub><pmid>34854436</pmid><doi>10.1039/d1dt03228c</doi><tpages>12</tpages><orcidid>https://orcid.org/0000-0002-0199-1382</orcidid><orcidid>https://orcid.org/0000-0002-8816-9614</orcidid><orcidid>https://orcid.org/0000-0003-0163-6783</orcidid><orcidid>https://orcid.org/0000-0002-7654-232X</orcidid><orcidid>https://orcid.org/0000-0003-3558-6761</orcidid></addata></record> |
fulltext | fulltext |
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ispartof | Dalton transactions : an international journal of inorganic chemistry, 2021-12, Vol.5 (48), p.18143-18154 |
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language | eng |
recordid | cdi_crossref_primary_10_1039_D1DT03228C |
source | Royal Society Of Chemistry Journals 2008-; Alma/SFX Local Collection |
subjects | Crystal structure Electron paramagnetic resonance Electronic structure Erbium Ligands Magnetic properties |
title | Magnetic behavior of the novel pentagonal-bipyramidal erbium() complex (EtNH)[Er(HDAPS)Cl]: high-frequency EPR study and crystal-field analysis |
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