Source:http://linkedlifedata.com/resource/pubmed/id/16126307
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| Predicate | Object |
|---|---|
| rdf:type | |
| lifeskim:mentions | |
| pubmed:issue |
12
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| pubmed:dateCreated |
2005-11-18
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| pubmed:abstractText |
Two cobalt and two Nickel complexes of bis[N-(2,6-diisopropylphenyl)imino]acenaphthene (Pr-BIAN) ligand, have been synthesized. These complexes, namely [Co(Pr-BIAN)Cl2] 1, [Co(OAc)2 (Pr-BIAN)2](ClO4) 2, [Ni(Pr-BIAN)(NO3)2] 3 and [Ni(Pr-BIAN)2](ClO4)2 4, were characterized by elemental analyses, molar conductance, spectral (IR, UV-Visible and NMR) and magnetic moment measurements. In these complexes the geometries about the metal center are significantly different. While for complexes 2 and 3 an octahedral structure is proposed, in complex 4, square-planar coordination with an almost perfect planar arrangement of two Pr-BIAN ligands around the nickel center is suggested. In 1, two imine nitrogen atoms of Pr-BIAN and two chloride atoms are coordinating in a tetrahedral fashion around the cobalt center. Molecular mechanics (MM+) and semiempirical molecular orbital calculations have been performed for the most biologically active complex 1 and its free ligand Pr-BIAN and compared with inactive ligand bis[N-(p-tolylphenyl)imino]acenaphthene 6, to get insight into their molecular structures and to learn more about their stable molecular conformations.
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| pubmed:language |
eng
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| pubmed:journal | |
| pubmed:citationSubset |
IM
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| pubmed:chemical |
http://linkedlifedata.com/resource/pubmed/chemical/Acenaphthenes,
http://linkedlifedata.com/resource/pubmed/chemical/Anti-Infective Agents,
http://linkedlifedata.com/resource/pubmed/chemical/Cobalt,
http://linkedlifedata.com/resource/pubmed/chemical/Ligands,
http://linkedlifedata.com/resource/pubmed/chemical/Nickel,
http://linkedlifedata.com/resource/pubmed/chemical/Organometallic Compounds
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| pubmed:status |
MEDLINE
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| pubmed:month |
Dec
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| pubmed:issn |
0223-5234
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| pubmed:author | |
| pubmed:issnType |
Print
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| pubmed:volume |
40
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| pubmed:owner |
NLM
|
| pubmed:authorsComplete |
Y
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| pubmed:pagination |
1214-21
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| pubmed:meshHeading |
pubmed-meshheading:16126307-Acenaphthenes,
pubmed-meshheading:16126307-Anti-Infective Agents,
pubmed-meshheading:16126307-Candida albicans,
pubmed-meshheading:16126307-Cobalt,
pubmed-meshheading:16126307-Crystallography, X-Ray,
pubmed-meshheading:16126307-Drug Design,
pubmed-meshheading:16126307-Escherichia coli,
pubmed-meshheading:16126307-Ligands,
pubmed-meshheading:16126307-Microbial Sensitivity Tests,
pubmed-meshheading:16126307-Models, Molecular,
pubmed-meshheading:16126307-Molecular Structure,
pubmed-meshheading:16126307-Nickel,
pubmed-meshheading:16126307-Organometallic Compounds,
pubmed-meshheading:16126307-Spectrophotometry, Infrared,
pubmed-meshheading:16126307-Spectrum Analysis,
pubmed-meshheading:16126307-Staphylococcus aureus,
pubmed-meshheading:16126307-Structure-Activity Relationship
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| pubmed:year |
2005
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| pubmed:articleTitle |
Synthesis, antimicrobial activity and molecular modeling of cobalt and nickel complexes containing the bulky ligand: bis[N-(2,6-diisopropylphenyl)imino] acenaphthene.
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| pubmed:affiliation |
Department of Chemistry, Faculty of Science, Mansoura University, Mansoura 35516, Egypt. usama@mans.edu.eg
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| pubmed:publicationType |
Journal Article
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