547 related articles for article (PubMed ID: 21627093)
1. A density functional theory and quantum theory of atoms-in-molecules analysis of the stability of Ni(II) complexes of some amino alcohol ligands.
Varadwaj PR; Cukrowski I; Perry CB; Marques HM
J Phys Chem A; 2011 Jun; 115(24):6629-40. PubMed ID: 21627093
[TBL] [Abstract][Full Text] [Related]
2. Amino-alcohol ligands: synthesis and structure of N,N'-bis(2-hydroxycyclopentyl)ethane-1,2-diamine and its salts, and an assessment of its fitness and that of related ligands for complexing metal ions.
de Sousa AS; Fernandes MA; Padayachy K; Marques HM
Inorg Chem; 2010 Sep; 49(17):8003-11. PubMed ID: 20684542
[TBL] [Abstract][Full Text] [Related]
3. The structure of N,N'-bis(2-hydroxyethyl)ethane-1,2-diamine and its complexes with Zn(II) and Cd(II).
de Sousa AS; Reisinger SA; Fernandes MA; Perry CB; Varadwaj PR; Marques HM
Dalton Trans; 2009 Dec; (46):10208-18. PubMed ID: 19921055
[TBL] [Abstract][Full Text] [Related]
4. Nickel(II) complexes of tripodal 4N ligands as catalysts for alkane oxidation using m-CPBA as oxidant: ligand stereoelectronic effects on catalysis.
Balamurugan M; Mayilmurugan R; Suresh E; Palaniandavar M
Dalton Trans; 2011 Oct; 40(37):9413-24. PubMed ID: 21850329
[TBL] [Abstract][Full Text] [Related]
5. DFT-UX3LYP studies on the coordination chemistry of Ni2+. Part 1: Six coordinate [Ni(NH3)n(H2O)(6-n)]2+ complexes.
Varadwaj PR; Cukrowski I; Marques HM
J Phys Chem A; 2008 Oct; 112(42):10657-66. PubMed ID: 18823109
[TBL] [Abstract][Full Text] [Related]
6. DFT-B3LYP, NPA-, and QTAIM-based study of the physical properties of [M(II)(H2O)2(15-crown-5)] (M = Mn, Fe, Co, Ni, Cu, Zn) complexes.
Varadwaj PR; Varadwaj A; Marques HM
J Phys Chem A; 2011 Jun; 115(22):5592-601. PubMed ID: 21568260
[TBL] [Abstract][Full Text] [Related]
7. The physical chemistry of coordinated aqua-, ammine-, and mixed-ligand Co2+ complexes: DFT studies on the structure, energetics, and topological properties of the electron density.
Varadwaj PR; Marques HM
Phys Chem Chem Phys; 2010 Mar; 12(9):2126-38. PubMed ID: 20165761
[TBL] [Abstract][Full Text] [Related]
8. Metal-ion selectivity produced by C-alkyl substituents on the bridges of chelating ligands: the importance of short H-H nonbonded van der Waals contacts in controlling metal-ion selectivity. A thermodynamic, molecular mechanics, and crystallographic study.
Hancock RD; de Sousa AS; Walton GB; Reibenspies JH
Inorg Chem; 2007 May; 46(11):4749-57. PubMed ID: 17447761
[TBL] [Abstract][Full Text] [Related]
9. Exploring the effects of H-bonding in synthetic analogues of nickel superoxide dismutase (Ni-SOD): experimental and theoretical implications for protection of the Ni-SCys bond.
Gale EM; Narendrapurapu BS; Simmonett AC; Schaefer HF; Harrop TC
Inorg Chem; 2010 Aug; 49(15):7080-96. PubMed ID: 20575514
[TBL] [Abstract][Full Text] [Related]
10. Tetrahedral and square planar Ni[(SPR(2))(2)N](2) complexes, R = Ph & (i)Pr revisited: experimental and theoretical analysis of interconversion pathways, structural preferences, and spin delocalization.
Maganas D; Grigoropoulos A; Staniland SS; Chatziefthimiou SD; Harrison A; Robertson N; Kyritsis P; Neese F
Inorg Chem; 2010 Jun; 49(11):5079-93. PubMed ID: 20462270
[TBL] [Abstract][Full Text] [Related]
11. Polynuclear nickel(II) complexes: a magnetostructural study of Ni(II)4, Ni(II)6, and Ni(II)9 species with oxime ligands.
Biswas B; Pieper U; Weyhermüller T; Chaudhuri P
Inorg Chem; 2009 Jul; 48(14):6781-93. PubMed ID: 19552389
[TBL] [Abstract][Full Text] [Related]
12. Complexation of metal ions, including alkali-earth and lanthanide(III) ions, in aqueous solution by the ligand 2,2',6',2''-terpyridyl.
Hamilton JM; Anhorn MJ; Oscarson KA; Reibenspies JH; Hancock RD
Inorg Chem; 2011 Apr; 50(7):2764-70. PubMed ID: 21366261
[TBL] [Abstract][Full Text] [Related]
13. A modular approach toward regulating the secondary coordination sphere of metal ions: differential dioxygen activation assisted by intramolecular hydrogen bonds.
Lucas RL; Zart MK; Mukherjee J; Sorrell TN; Powell DR; Borovik AS
J Am Chem Soc; 2006 Dec; 128(48):15476-89. PubMed ID: 17132015
[TBL] [Abstract][Full Text] [Related]
14. A density functional theory- and atoms in molecules-based study of NiNTA and NiNTPA complexes toward physical properties controlling their stability. A new method of computing a formation constant.
Cukrowski I; Govender KK
Inorg Chem; 2010 Aug; 49(15):6931-41. PubMed ID: 20604566
[TBL] [Abstract][Full Text] [Related]
15. Conformational analysis of 18-azacrown-6 and its bonding with late first transition series divalent metals: insight from DFT combined with NPA and QTAIM analyses.
Varadwaj PR; Varadwaj A; Peslherbe GH; Marques HM
J Phys Chem A; 2011 Nov; 115(45):13180-90. PubMed ID: 21961695
[TBL] [Abstract][Full Text] [Related]
16. Synthesis, structure, spectroscopy and redox chemistry of square-planar nickel(II) complexes with tetradentate o-phenylenedioxamidates and related ligands.
Ottenwaelder X; Aukauloo A; Journaux Y; Carrasco R; Cano J; Cervera B; Castro I; Curreli S; Muñoz MC; Roselló AL; Soto B; Ruiz-García R
Dalton Trans; 2005 Aug; (15):2516-26. PubMed ID: 16025171
[TBL] [Abstract][Full Text] [Related]
17. Ni(II)/H(2)O(2) reactivity in bis[(pyridin-2-yl)methyl]amine tridentate ligand system. aromatic hydroxylation reaction by bis(mu-oxo)dinickel(III) complex.
Kunishita A; Doi Y; Kubo M; Ogura T; Sugimoto H; Itoh S
Inorg Chem; 2009 Jun; 48(11):4997-5004. PubMed ID: 19374371
[TBL] [Abstract][Full Text] [Related]
18. Electronic structure control of the nucleophilicity of transition metal-thiolate complexes: an experimental and theoretical study.
Fox DC; Fiedler AT; Halfen HL; Brunold TC; Halfen JA
J Am Chem Soc; 2004 Jun; 126(24):7627-38. PubMed ID: 15198611
[TBL] [Abstract][Full Text] [Related]
19. Nickel and iron complexes with N,P,N-type ligands: synthesis, structure and catalytic oligomerization of ethylene.
Kermagoret A; Tomicki F; Braunstein P
Dalton Trans; 2008 Jun; (22):2945-55. PubMed ID: 18493630
[TBL] [Abstract][Full Text] [Related]
20. A structure-based analysis of the vibrational spectra of nitrosyl ligands in transition-metal coordination complexes and clusters.
De La Cruz C; Sheppard N
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Jan; 78(1):7-28. PubMed ID: 21123107
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
