2D copper(II) complex built from N-methyl-1,3-diamino-2-propanolate and azide ligands:: Structure, magnetic, and DFT studies
- Publikationstyp:
- Zeitschriftenaufsatz
- Metadaten:
-
- Autoren
- M Salah El Fallah
- Ramon Vicente
- Javier Tercero
- Christian Elpelt
- Eva Rentschler
- Xavier Solans
- Merce Font-Bardia
- Autoren-URL
- https://www.webofscience.com/api/gateway?GWVersion=2&SrcApp=fis-test-1&SrcAuth=WosAPI&KeyUT=WOS:000257642700030&DestLinkType=FullRecord&DestApp=WOS_CPL
- DOI
- 10.1021/ic8004807
- eISSN
- 1520-510X
- Externe Identifier
- Clarivate Analytics Document Solution ID: 326FC
- PubMed Identifier: 18570412
- ISSN
- 0020-1669
- Ausgabe der Veröffentlichung
- 14
- Zeitschrift
- INORGANIC CHEMISTRY
- Paginierung
- 6322 - 6328
- Datum der Veröffentlichung
- 2008
- Status
- Published
- Titel
- 2D copper(II) complex built from <i>N</i>-methyl-1,3-diamino-2-propanolate and azide ligands:: Structure, magnetic, and DFT studies
- Sub types
- Article
- Ausgabe der Zeitschrift
- 47
Datenquelle: Web of Science (Lite)
- Andere Metadatenquellen:
-
- Autoren
- M Salah El Fallah
- Ramon Vicente
- Javier Tercero
- Christian Elpelt
- Eva Rentschler
- Xavier Solans
- Mercè Font-Bardia
- DOI
- 10.1021/ic8004807
- eISSN
- 1520-510X
- ISSN
- 0020-1669
- Ausgabe der Veröffentlichung
- 14
- Zeitschrift
- Inorganic Chemistry
- Sprache
- en
- Online publication date
- 2008
- Paginierung
- 6322 - 6328
- Datum der Veröffentlichung
- 2008
- Status
- Published
- Herausgeber
- American Chemical Society (ACS)
- Herausgeber URL
- http://dx.doi.org/10.1021/ic8004807
- Datum der Datenerfassung
- 2023
- Titel
- 2D Copper(II) Complex Built from <i>N</i>-Methyl-1,3-diamino-2-propanolate and Azide Ligands: Structure, Magnetic, and DFT Studies
- Ausgabe der Zeitschrift
- 47
Datenquelle: Crossref
- Abstract
- The synthesis, structural characterization, and magnetic behavior of a new 2D copper(II) compound with formula {[Cu2(mu-O2CMe)(mu-MedapO)(mu1,1-N3)2]n (CH3OH)n} 1, in which MedapOH is N-methyl-1,3-diamino-2-propanol is reported herein. 1 crystallizes in the triclinic system, space group P1, with unit cell parameters a = 6.688(5) A, b = 10.591(6) A, c = 12.100(7) A, alpha = 113.01(3) degrees, beta = 105.08(4) degrees, gamma = 93.93(3) degrees, Z = 2. The structure of 1 consists of neutral alternate 1D chains formed by the sequence of [Cu(1)-(mu1,1-N3)2-Cu(1)-(MedapO/acetate)-Cu(2)-(mu1,1-N3)2-Cu2)]. Each dinuclear [Cu(1)-Cu(2)] unit interacts with similar dinuclear units of neighbor chains in basis to large Cu-N(azido) distances to give a 2D arrangement. The magnetic behavior of 1 has been checked giving a net ferromagnetic coupling. The fit of the chiM versus T data as dinuclear compound affords a J value of 53.0 cm(-1) as a consequence of the orbital countercomplementarity phenomenon. The exchange pathways have been justified by density functional calculations.
- Addresses
- Departament de Quimica Inorganica, Universitat de Barcelona, Marti i Franques, 1-11, 08028-Barcelona, Spain. salah.elfallah@qi.ub.es
- Autoren
- M Salah El Fallah
- Ramon Vicente
- Javier Tercero
- Christian Elpelt
- Eva Rentschler
- Xavier Solans
- Mercè Font-Bardia
- DOI
- 10.1021/ic8004807
- eISSN
- 1520-510X
- Externe Identifier
- PubMed Identifier: 18570412
- Open access
- false
- ISSN
- 0020-1669
- Ausgabe der Veröffentlichung
- 14
- Zeitschrift
- Inorganic chemistry
- Sprache
- eng
- Medium
- Print-Electronic
- Online publication date
- 2008
- Paginierung
- 6322 - 6328
- Datum der Veröffentlichung
- 2008
- Status
- Published
- Datum der Datenerfassung
- 2008
- Titel
- 2D copper(II) complex built from N-methyl-1,3-diamino-2-propanolate and azide ligands: structure, magnetic, and DFT studies.
- Sub types
- Journal Article
- Ausgabe der Zeitschrift
- 47
Datenquelle: Europe PubMed Central
- Abstract
- The synthesis, structural characterization, and magnetic behavior of a new 2D copper(II) compound with formula {[Cu2(mu-O2CMe)(mu-MedapO)(mu1,1-N3)2]n (CH3OH)n} 1, in which MedapOH is N-methyl-1,3-diamino-2-propanol is reported herein. 1 crystallizes in the triclinic system, space group P1, with unit cell parameters a = 6.688(5) A, b = 10.591(6) A, c = 12.100(7) A, alpha = 113.01(3) degrees, beta = 105.08(4) degrees, gamma = 93.93(3) degrees, Z = 2. The structure of 1 consists of neutral alternate 1D chains formed by the sequence of [Cu(1)-(mu1,1-N3)2-Cu(1)-(MedapO/acetate)-Cu(2)-(mu1,1-N3)2-Cu2)]. Each dinuclear [Cu(1)-Cu(2)] unit interacts with similar dinuclear units of neighbor chains in basis to large Cu-N(azido) distances to give a 2D arrangement. The magnetic behavior of 1 has been checked giving a net ferromagnetic coupling. The fit of the chiM versus T data as dinuclear compound affords a J value of 53.0 cm(-1) as a consequence of the orbital countercomplementarity phenomenon. The exchange pathways have been justified by density functional calculations.
- Autoren
- M Salah El Fallah
- Ramon Vicente
- Javier Tercero
- Christian Elpelt
- Eva Rentschler
- Xavier Solans
- Mercè Font-Bardia
- Autoren-URL
- https://www.ncbi.nlm.nih.gov/pubmed/18570412
- DOI
- 10.1021/ic8004807
- eISSN
- 1520-510X
- Ausgabe der Veröffentlichung
- 14
- Zeitschrift
- Inorg Chem
- Sprache
- eng
- Country
- United States
- Paginierung
- 6322 - 6328
- Datum der Veröffentlichung
- 2008
- Status
- Published
- Datum, an dem der Datensatz öffentlich gemacht wurde
- 2008
- Titel
- 2D copper(II) complex built from N-methyl-1,3-diamino-2-propanolate and azide ligands: structure, magnetic, and DFT studies.
- Sub types
- Journal Article
- Ausgabe der Zeitschrift
- 47
Datenquelle: PubMed
- Beziehungen:
- Eigentum von