Distinctive and regular features of the IR spectra of transition metal tris(acetylacetonates)
The frequencies for the IR spectra of M(Acac) 3 (M = Sc, Ti, V, Cr, Fe, Mn, and Co) were qualitatively calculated by the Hartree-Fock-Roothaan method with the MIDI basis set including p and d polarization functions. It was demonstrated that the coordination entity of the manganese complex is deforme...
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| Veröffentlicht in: | Russian journal of coordination chemistry 2008-07, Vol.34 (7), p.551-553 |
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| container_title | Russian journal of coordination chemistry |
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| creator | Slabzhennikov, S. N. Ryabchenko, O. B. Kuarton, L. A. |
| description | The frequencies for the IR spectra of M(Acac)
3
(M = Sc, Ti, V, Cr, Fe, Mn, and Co) were qualitatively calculated by the Hartree-Fock-Roothaan method with the MIDI basis set including
p
and
d
polarization functions. It was demonstrated that the coordination entity of the manganese complex is deformed more strongly than that of the vanadium complex. A correlation diagram for the IR bands in the 200–1600 cm
−1
range is presented for the complexes in the condensed state. A correlation was found between the experimental frequency of the M-O vibrations and the corresponding force constants. |
| doi_str_mv | 10.1134/S1070328408070130 |
| format | Article |
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3
(M = Sc, Ti, V, Cr, Fe, Mn, and Co) were qualitatively calculated by the Hartree-Fock-Roothaan method with the MIDI basis set including
p
and
d
polarization functions. It was demonstrated that the coordination entity of the manganese complex is deformed more strongly than that of the vanadium complex. A correlation diagram for the IR bands in the 200–1600 cm
−1
range is presented for the complexes in the condensed state. A correlation was found between the experimental frequency of the M-O vibrations and the corresponding force constants.</description><identifier>ISSN: 1070-3284</identifier><identifier>EISSN: 1608-3318</identifier><identifier>DOI: 10.1134/S1070328408070130</identifier><language>eng</language><publisher>Dordrecht: SP MAIK Nauka/Interperiodica</publisher><subject>Chemistry ; Chemistry and Materials Science ; Inorganic Chemistry ; Physical Chemistry</subject><ispartof>Russian journal of coordination chemistry, 2008-07, Vol.34 (7), p.551-553</ispartof><rights>MAIK Nauka 2008</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c288t-85be3ec513388325092413ef7cf63e347d956e68407bda461590808799b300a93</citedby><cites>FETCH-LOGICAL-c288t-85be3ec513388325092413ef7cf63e347d956e68407bda461590808799b300a93</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktopdf>$$Uhttps://link.springer.com/content/pdf/10.1134/S1070328408070130$$EPDF$$P50$$Gspringer$$H</linktopdf><linktohtml>$$Uhttps://link.springer.com/10.1134/S1070328408070130$$EHTML$$P50$$Gspringer$$H</linktohtml><link.rule.ids>314,776,780,27901,27902,41464,42533,51294</link.rule.ids></links><search><creatorcontrib>Slabzhennikov, S. N.</creatorcontrib><creatorcontrib>Ryabchenko, O. B.</creatorcontrib><creatorcontrib>Kuarton, L. A.</creatorcontrib><title>Distinctive and regular features of the IR spectra of transition metal tris(acetylacetonates)</title><title>Russian journal of coordination chemistry</title><addtitle>Russ J Coord Chem</addtitle><description>The frequencies for the IR spectra of M(Acac)
3
(M = Sc, Ti, V, Cr, Fe, Mn, and Co) were qualitatively calculated by the Hartree-Fock-Roothaan method with the MIDI basis set including
p
and
d
polarization functions. It was demonstrated that the coordination entity of the manganese complex is deformed more strongly than that of the vanadium complex. A correlation diagram for the IR bands in the 200–1600 cm
−1
range is presented for the complexes in the condensed state. A correlation was found between the experimental frequency of the M-O vibrations and the corresponding force constants.</description><subject>Chemistry</subject><subject>Chemistry and Materials Science</subject><subject>Inorganic Chemistry</subject><subject>Physical Chemistry</subject><issn>1070-3284</issn><issn>1608-3318</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2008</creationdate><recordtype>article</recordtype><recordid>eNp9UE1LAzEQDaJgrf4AbznqYXWysx_JUarVQkHw4yhLms7WlG22JKnQf2_WehO8zDzezBvmPcYuBdwIgcXtq4AaMJcFyAQEwhEbiQpkhijkccKJzYb5KTsLYQ0gAEo1Yh_3NkTrTLRfxLVbck-rXac9b0nHnafA-5bHT-KzFx62ZKLXP4zXLthoe8c3FHWXCBuutKG474baOx0pXJ-zk1Z3gS5--5i9Tx_eJk_Z_PlxNrmbZyaXMmayXBCSKQWilJiXoPJCILW1aSskLOqlKiuqkrl6sdRFJUqVbMpaqQUCaIVjJg53je9D8NQ2W2832u8bAc2QT_Mnn6TJD5qQdt2KfLPud96lN_8RfQMqgWbU</recordid><startdate>20080701</startdate><enddate>20080701</enddate><creator>Slabzhennikov, S. N.</creator><creator>Ryabchenko, O. B.</creator><creator>Kuarton, L. A.</creator><general>SP MAIK Nauka/Interperiodica</general><scope>AAYXX</scope><scope>CITATION</scope></search><sort><creationdate>20080701</creationdate><title>Distinctive and regular features of the IR spectra of transition metal tris(acetylacetonates)</title><author>Slabzhennikov, S. N. ; Ryabchenko, O. B. ; Kuarton, L. A.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c288t-85be3ec513388325092413ef7cf63e347d956e68407bda461590808799b300a93</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2008</creationdate><topic>Chemistry</topic><topic>Chemistry and Materials Science</topic><topic>Inorganic Chemistry</topic><topic>Physical Chemistry</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Slabzhennikov, S. N.</creatorcontrib><creatorcontrib>Ryabchenko, O. B.</creatorcontrib><creatorcontrib>Kuarton, L. A.</creatorcontrib><collection>CrossRef</collection><jtitle>Russian journal of coordination chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Slabzhennikov, S. N.</au><au>Ryabchenko, O. B.</au><au>Kuarton, L. A.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Distinctive and regular features of the IR spectra of transition metal tris(acetylacetonates)</atitle><jtitle>Russian journal of coordination chemistry</jtitle><stitle>Russ J Coord Chem</stitle><date>2008-07-01</date><risdate>2008</risdate><volume>34</volume><issue>7</issue><spage>551</spage><epage>553</epage><pages>551-553</pages><issn>1070-3284</issn><eissn>1608-3318</eissn><abstract>The frequencies for the IR spectra of M(Acac)
3
(M = Sc, Ti, V, Cr, Fe, Mn, and Co) were qualitatively calculated by the Hartree-Fock-Roothaan method with the MIDI basis set including
p
and
d
polarization functions. It was demonstrated that the coordination entity of the manganese complex is deformed more strongly than that of the vanadium complex. A correlation diagram for the IR bands in the 200–1600 cm
−1
range is presented for the complexes in the condensed state. A correlation was found between the experimental frequency of the M-O vibrations and the corresponding force constants.</abstract><cop>Dordrecht</cop><pub>SP MAIK Nauka/Interperiodica</pub><doi>10.1134/S1070328408070130</doi><tpages>3</tpages></addata></record> |
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| subjects | Chemistry Chemistry and Materials Science Inorganic Chemistry Physical Chemistry |
| title | Distinctive and regular features of the IR spectra of transition metal tris(acetylacetonates) |
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