| DUBLIN | CORE | METADATA ITEM | METADATA FOR THIS DOCUMENT |
| 1 | Title | Title of Document | Quantum Chemical Studies on Molecular
Structures of Copper-Pyridine Complexes |
| 2 | Creator | Author's name, affiliation, country | K. P. SRIVASTAVA, S. K. SRIVATAW, V. K. SINGH and GAURAV SINHA
Department of Chemistry, Ganga Singh College
Jai Prakash University, Chapra-841301, India |
| 3 | Subject | Dicipline(s) | Chemical Science |
| 3 | Subject | Keywords | Copper, Pyridines, Quantum chemical calculations, Metal-ligand bonding |
| 4 | Description | Abstract | The Cu-pyridine and Cu-(pyridine)2 complexes were studied by quantum chemical calculations. Although pyridine provides both σ and π-bonding capabilities towards metal atoms and ions, the mono-ligand and di-ligand Cu-pyridine complexes are determined to be σ- structures. In the di-ligand complex, the two pyridine rings prefer the eclipsed to the staggered form. Due to an additional Cu-N σ-bond and stronger ligand π-electron donation, the di-ligand complex possesses a stronger metal ligand interaction than the mono-ligand complex. Upon ionization, the metal-ligand bonding in the di-ligand complex is more strongly enhanced compared to the mono-ligand complex. |
| 5 | Publishers | Organizing agency, location | WWW Publications, India |
| 6 | Contributor | Sponsor(s) | - |
| 7 | Date | Date (YYYY-MM-DD) | - |
| 8 | Type | Status & genre | Peer-reviewed Article |
| 8 | Type | Type | |
| 9 | Formate | File Formate | PDF |
| 10 | Identifier | Uniform Resource Identifier | Click Here |
| 10 | Identifier | Digital Object Identifier | |
| 11 | Source | Journal/conference title; vol., no. (Year) | Chemical Science Transactions, Volume 2 , Number (4), (2013) |
| 12 | Lanuguage | English=en | en |
| 13 | Relation | Supp.files | |
| 14 | Coverage | | - |
| 15 | Copyright | Copyright and permissions | |
