Conţinutul numărului revistei |
Articolul precedent |
Articolul urmator |
![]() |
![]() ![]() |
![]() TURTA, Constantin, SPATARU, Tudor, VREZHMASHU, V.. The nature of the chemical bond in trinuclear oxo carboxylates containing {FeIII2MIIO} cores vs. their spectral properties. In: Revue Roumaine de Chimie, 2001, vol. 46, pp. 861-871. ISSN 0035-3930. |
EXPORT metadate: Google Scholar Crossref CERIF DataCite Dublin Core |
Revue Roumaine de Chimie | ||||||
Volumul 46 / 2001 / ISSN 0035-3930 | ||||||
|
||||||
Pag. 861-871 | ||||||
|
||||||
![]() |
||||||
Rezumat | ||||||
Quantum chemical analysis of the electronic structure and some spectral characteristics for iron mixed metal trinuclear oxo carboxylates [FeIII2MIIO(O2CCR)6L 3], where M=Mn, Fe, Co, and Ni; L=3-Cl-Py, Py or H2O and R=CH3 or CF3 were performed. The obtained values are presented in comparison with those for the [Fe3O(OAc)6(H2O)3]+ cation, and are in good agreement with experimental Mossbauer spectra. The analysis of the electronic structure permits to put into evidence general features observed also in IR and electronic spectra. |
||||||
|
Cerif XML Export
<?xml version='1.0' encoding='utf-8'?> <CERIF xmlns='urn:xmlns:org:eurocris:cerif-1.5-1' xsi:schemaLocation='urn:xmlns:org:eurocris:cerif-1.5-1 http://www.eurocris.org/Uploads/Web%20pages/CERIF-1.5/CERIF_1.5_1.xsd' xmlns:xsi='http://www.w3.org/2001/XMLSchema-instance' release='1.5' date='2012-10-07' sourceDatabase='Output Profile'> <cfResPubl> <cfResPublId>ibn-ResPubl-186423</cfResPublId> <cfResPublDate>2001-08-08</cfResPublDate> <cfStartPage>861</cfStartPage> <cfISSN>0035-3930</cfISSN> <cfURI>https://ibn.idsi.md/ro/vizualizare_articol/186423</cfURI> <cfTitle cfLangCode='EN' cfTrans='o'>The nature of the chemical bond in trinuclear oxo carboxylates containing {FeIII2MIIO} cores vs. their spectral properties</cfTitle> <cfAbstr cfLangCode='EN' cfTrans='o'><p>Quantum chemical analysis of the electronic structure and some spectral characteristics for iron mixed metal trinuclear oxo carboxylates [Fe<sup>III</sup><sub>2</sub>M<sup>II</sup>O(O<sub>2</sub>CCR)<sub>6</sub>L <sub>3</sub>], where M=Mn, Fe, Co, and Ni; L=3-Cl-Py, Py or H<sub>2</sub>O and R=CH<sub>3</sub> or CF<sub>3</sub> were performed. The obtained values are presented in comparison with those for the [Fe<sub>3</sub>O(OAc)<sub>6</sub>(H<sub>2</sub>O)<sub>3</sub>]<sup>+</sup> cation, and are in good agreement with experimental Mossbauer spectra. The analysis of the electronic structure permits to put into evidence general features observed also in IR and electronic spectra.</p></cfAbstr> <cfResPubl_Class> <cfClassId>eda2d9e9-34c5-11e1-b86c-0800200c9a66</cfClassId> <cfClassSchemeId>759af938-34ae-11e1-b86c-0800200c9a66</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> </cfResPubl_Class> <cfResPubl_Class> <cfClassId>e601872f-4b7e-4d88-929f-7df027b226c9</cfClassId> <cfClassSchemeId>40e90e2f-446d-460a-98e5-5dce57550c48</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> </cfResPubl_Class> <cfPers_ResPubl> <cfPersId>ibn-person-530</cfPersId> <cfClassId>49815870-1cfe-11e1-8bc2-0800200c9a66</cfClassId> <cfClassSchemeId>b7135ad0-1d00-11e1-8bc2-0800200c9a66</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> </cfPers_ResPubl> <cfPers_ResPubl> <cfPersId>ibn-person-19043</cfPersId> <cfClassId>49815870-1cfe-11e1-8bc2-0800200c9a66</cfClassId> <cfClassSchemeId>b7135ad0-1d00-11e1-8bc2-0800200c9a66</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> </cfPers_ResPubl> <cfPers_ResPubl> <cfPersId>ibn-person-111135</cfPersId> <cfClassId>49815870-1cfe-11e1-8bc2-0800200c9a66</cfClassId> <cfClassSchemeId>b7135ad0-1d00-11e1-8bc2-0800200c9a66</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> </cfPers_ResPubl> </cfResPubl> <cfPers> <cfPersId>ibn-Pers-530</cfPersId> <cfPersName_Pers> <cfPersNameId>ibn-PersName-530-3</cfPersNameId> <cfClassId>55f90543-d631-42eb-8d47-d8d9266cbb26</cfClassId> <cfClassSchemeId>7375609d-cfa6-45ce-a803-75de69abe21f</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> <cfFamilyNames>Turta</cfFamilyNames> <cfFirstNames>Constantin</cfFirstNames> <cfFamilyNames>Туртэ</cfFamilyNames> <cfFirstNames>Константин</cfFirstNames> </cfPersName_Pers> </cfPers> <cfPers> <cfPersId>ibn-Pers-19043</cfPersId> <cfPersName_Pers> <cfPersNameId>ibn-PersName-19043-3</cfPersNameId> <cfClassId>55f90543-d631-42eb-8d47-d8d9266cbb26</cfClassId> <cfClassSchemeId>7375609d-cfa6-45ce-a803-75de69abe21f</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> <cfFamilyNames>Spataru</cfFamilyNames> <cfFirstNames>Tudor</cfFirstNames> </cfPersName_Pers> </cfPers> <cfPers> <cfPersId>ibn-Pers-111135</cfPersId> <cfPersName_Pers> <cfPersNameId>ibn-PersName-111135-3</cfPersNameId> <cfClassId>55f90543-d631-42eb-8d47-d8d9266cbb26</cfClassId> <cfClassSchemeId>7375609d-cfa6-45ce-a803-75de69abe21f</cfClassSchemeId> <cfStartDate>2001-08-08T24:00:00</cfStartDate> <cfFamilyNames>Vrezhmashu</cfFamilyNames> <cfFirstNames>V.</cfFirstNames> </cfPersName_Pers> </cfPers> </CERIF>