Synthesis and Structure of the Mononuclear Zinc Complex with 4-Biphenylcarboxylate Anions and 1,10-Phenanthroline
A mononuclear complex [Zn(phbz) 2 (phen)] ( 1 , Hphbz = 4-biphenylcarboxylic acid, phen is 1,10-phenanthroline) is obtained, and its structure is determined by single crystal X-ray diffraction (XRD). It is additionally characterized by powder XRD, IR and NMR spectroscopy. The theoretic simulation (D...
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| Veröffentlicht in: | Journal of structural chemistry 2024, Vol.65 (1), p.63-74 |
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| container_title | Journal of structural chemistry |
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| creator | Samulionis, A. S. Melnikov, S. N. Pavlov, A. A. Starikova, A. A. Gogoleva, N. V. Nikolaevskii, S. A. Kiskin, M. A. Eremenko, I. L. |
| description | A mononuclear complex [Zn(phbz)
2
(phen)] (
1
, Hphbz = 4-biphenylcarboxylic acid, phen is 1,10-phenanthroline) is obtained, and its structure is determined by single crystal X-ray diffraction (XRD). It is additionally characterized by powder XRD, IR and NMR spectroscopy. The theoretic simulation (DFT B3LYP/Def2-TZVP) of the dimerization process of the complex shows that one of the reasons for the lack of experimental detection of dimeric structures of this type may be a low stabilization energy of the hypothetical binuclear compound [Zn
2
(phbz)
4
(phen)
2
]. |
| doi_str_mv | 10.1134/S0022476624010062 |
| format | Article |
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2
(phen)] (
1
, Hphbz = 4-biphenylcarboxylic acid, phen is 1,10-phenanthroline) is obtained, and its structure is determined by single crystal X-ray diffraction (XRD). It is additionally characterized by powder XRD, IR and NMR spectroscopy. The theoretic simulation (DFT B3LYP/Def2-TZVP) of the dimerization process of the complex shows that one of the reasons for the lack of experimental detection of dimeric structures of this type may be a low stabilization energy of the hypothetical binuclear compound [Zn
2
(phbz)
4
(phen)
2
].</description><identifier>ISSN: 0022-4766</identifier><identifier>EISSN: 1573-8779</identifier><identifier>DOI: 10.1134/S0022476624010062</identifier><language>eng</language><publisher>Moscow: Pleiades Publishing</publisher><subject>Atomic ; Atomic/Molecular Structure and Spectra ; Chemistry ; Chemistry and Materials Science ; Dimerization ; Infrared spectroscopy ; Inorganic Chemistry ; Molecular ; NMR spectroscopy ; Optical and Plasma Physics ; Physical Chemistry ; Single crystals ; Solid State Physics ; X-ray diffraction ; Zinc compounds</subject><ispartof>Journal of structural chemistry, 2024, Vol.65 (1), p.63-74</ispartof><rights>Pleiades Publishing, Ltd. 2024</rights><rights>Pleiades Publishing, Ltd. 2024.</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><cites>FETCH-LOGICAL-c268t-b97b636b990a550c3438ca53e89b12ebec78a19609a96ae5d400ddd00861be5a3</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/S0022476624010062$$EPDF$$P50$$Gspringer$$H</linktopdf><linktohtml>$$Uhttps://link.springer.com/10.1134/S0022476624010062$$EHTML$$P50$$Gspringer$$H</linktohtml><link.rule.ids>314,776,780,27903,27904,41467,42536,51298</link.rule.ids></links><search><creatorcontrib>Samulionis, A. S.</creatorcontrib><creatorcontrib>Melnikov, S. N.</creatorcontrib><creatorcontrib>Pavlov, A. A.</creatorcontrib><creatorcontrib>Starikova, A. A.</creatorcontrib><creatorcontrib>Gogoleva, N. V.</creatorcontrib><creatorcontrib>Nikolaevskii, S. A.</creatorcontrib><creatorcontrib>Kiskin, M. A.</creatorcontrib><creatorcontrib>Eremenko, I. L.</creatorcontrib><title>Synthesis and Structure of the Mononuclear Zinc Complex with 4-Biphenylcarboxylate Anions and 1,10-Phenanthroline</title><title>Journal of structural chemistry</title><addtitle>J Struct Chem</addtitle><description>A mononuclear complex [Zn(phbz)
2
(phen)] (
1
, Hphbz = 4-biphenylcarboxylic acid, phen is 1,10-phenanthroline) is obtained, and its structure is determined by single crystal X-ray diffraction (XRD). It is additionally characterized by powder XRD, IR and NMR spectroscopy. The theoretic simulation (DFT B3LYP/Def2-TZVP) of the dimerization process of the complex shows that one of the reasons for the lack of experimental detection of dimeric structures of this type may be a low stabilization energy of the hypothetical binuclear compound [Zn
2
(phbz)
4
(phen)
2
].</description><subject>Atomic</subject><subject>Atomic/Molecular Structure and Spectra</subject><subject>Chemistry</subject><subject>Chemistry and Materials Science</subject><subject>Dimerization</subject><subject>Infrared spectroscopy</subject><subject>Inorganic Chemistry</subject><subject>Molecular</subject><subject>NMR spectroscopy</subject><subject>Optical and Plasma Physics</subject><subject>Physical Chemistry</subject><subject>Single crystals</subject><subject>Solid State Physics</subject><subject>X-ray diffraction</subject><subject>Zinc compounds</subject><issn>0022-4766</issn><issn>1573-8779</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2024</creationdate><recordtype>article</recordtype><recordid>eNp1kE9LxDAUxIMouK5-AG8Br1ZfkjZtjuviP1hRWL14KWn61u3STWrS4vbb26WCB_H04M1vZmAIOWdwxZiIr5cAnMeplDwGBiD5AZmwJBVRlqbqkEz2crTXj8lJCBsAUJmSE_K57G27xlAFqm1Jl63vTNt5pG5Fhz99ctbZztSoPX2vrKFzt21q3NGvql3TOLqpmjXavjbaF27X17pFOrOVs2Meu2QQvQyEHlq8qyuLp-RopeuAZz93St7ubl_nD9Hi-f5xPltEhsusjQqVFlLIQinQSQJGxCIzOhGYqYJxLNCkmWZKgtJKakzKGKAsS4BMsgITLabkYsxtvPvsMLT5xnXeDpU5VzzmCqRgA8VGyngXgsdV3vhqq32fM8j3y-Z_lh08fPSEgbUf6H-T_zd9Aygleqc</recordid><startdate>2024</startdate><enddate>2024</enddate><creator>Samulionis, A. S.</creator><creator>Melnikov, S. N.</creator><creator>Pavlov, A. A.</creator><creator>Starikova, A. A.</creator><creator>Gogoleva, N. V.</creator><creator>Nikolaevskii, S. A.</creator><creator>Kiskin, M. A.</creator><creator>Eremenko, I. L.</creator><general>Pleiades Publishing</general><general>Springer Nature B.V</general><scope>AAYXX</scope><scope>CITATION</scope></search><sort><creationdate>2024</creationdate><title>Synthesis and Structure of the Mononuclear Zinc Complex with 4-Biphenylcarboxylate Anions and 1,10-Phenanthroline</title><author>Samulionis, A. S. ; Melnikov, S. N. ; Pavlov, A. A. ; Starikova, A. A. ; Gogoleva, N. V. ; Nikolaevskii, S. A. ; Kiskin, M. A. ; Eremenko, I. L.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c268t-b97b636b990a550c3438ca53e89b12ebec78a19609a96ae5d400ddd00861be5a3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2024</creationdate><topic>Atomic</topic><topic>Atomic/Molecular Structure and Spectra</topic><topic>Chemistry</topic><topic>Chemistry and Materials Science</topic><topic>Dimerization</topic><topic>Infrared spectroscopy</topic><topic>Inorganic Chemistry</topic><topic>Molecular</topic><topic>NMR spectroscopy</topic><topic>Optical and Plasma Physics</topic><topic>Physical Chemistry</topic><topic>Single crystals</topic><topic>Solid State Physics</topic><topic>X-ray diffraction</topic><topic>Zinc compounds</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Samulionis, A. S.</creatorcontrib><creatorcontrib>Melnikov, S. N.</creatorcontrib><creatorcontrib>Pavlov, A. A.</creatorcontrib><creatorcontrib>Starikova, A. A.</creatorcontrib><creatorcontrib>Gogoleva, N. V.</creatorcontrib><creatorcontrib>Nikolaevskii, S. A.</creatorcontrib><creatorcontrib>Kiskin, M. A.</creatorcontrib><creatorcontrib>Eremenko, I. L.</creatorcontrib><collection>CrossRef</collection><jtitle>Journal of structural chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Samulionis, A. S.</au><au>Melnikov, S. N.</au><au>Pavlov, A. A.</au><au>Starikova, A. A.</au><au>Gogoleva, N. V.</au><au>Nikolaevskii, S. A.</au><au>Kiskin, M. A.</au><au>Eremenko, I. L.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Synthesis and Structure of the Mononuclear Zinc Complex with 4-Biphenylcarboxylate Anions and 1,10-Phenanthroline</atitle><jtitle>Journal of structural chemistry</jtitle><stitle>J Struct Chem</stitle><date>2024</date><risdate>2024</risdate><volume>65</volume><issue>1</issue><spage>63</spage><epage>74</epage><pages>63-74</pages><issn>0022-4766</issn><eissn>1573-8779</eissn><abstract>A mononuclear complex [Zn(phbz)
2
(phen)] (
1
, Hphbz = 4-biphenylcarboxylic acid, phen is 1,10-phenanthroline) is obtained, and its structure is determined by single crystal X-ray diffraction (XRD). It is additionally characterized by powder XRD, IR and NMR spectroscopy. The theoretic simulation (DFT B3LYP/Def2-TZVP) of the dimerization process of the complex shows that one of the reasons for the lack of experimental detection of dimeric structures of this type may be a low stabilization energy of the hypothetical binuclear compound [Zn
2
(phbz)
4
(phen)
2
].</abstract><cop>Moscow</cop><pub>Pleiades Publishing</pub><doi>10.1134/S0022476624010062</doi><tpages>12</tpages></addata></record> |
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| language | eng |
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| source | Springer Nature - Complete Springer Journals |
| subjects | Atomic Atomic/Molecular Structure and Spectra Chemistry Chemistry and Materials Science Dimerization Infrared spectroscopy Inorganic Chemistry Molecular NMR spectroscopy Optical and Plasma Physics Physical Chemistry Single crystals Solid State Physics X-ray diffraction Zinc compounds |
| title | Synthesis and Structure of the Mononuclear Zinc Complex with 4-Biphenylcarboxylate Anions and 1,10-Phenanthroline |
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