Performance of the M06 family of exchange-correlation functionals for predicting magnetic coupling in organic and inorganic molecules
R Valero, R Costa, I de PR Moreira… - The Journal of chemical …, 2008 - pubs.aip.org
The performance of the M06 family of exchange-correlation potentials for describing the
electronic structure and the Heisenberg magnetic coupling constant (J) is investigated using …
electronic structure and the Heisenberg magnetic coupling constant (J) is investigated using …
Inverse coordination. Organic nitrogen heterocycles as coordination centers. A survey of molecular topologies and systematization. Part 2. Six-membered rings
I Haiduc - Journal of Coordination Chemistry, 2019 - Taylor & Francis
The review is a follow-up of a previous article (I. Haiduc, J. Coord. Chem.(2019). DOI:
10.1080/00958972.2019. 1641702), which introduced structures with five-membered …
10.1080/00958972.2019. 1641702), which introduced structures with five-membered …
Synthesis, crystal structures, and magnetic properties of three novel ferrocenecarboxylato-bridged lanthanide dimers
H Hou, G Li, L Li, Y Zhu, X Meng, Y Fan - Inorganic chemistry, 2003 - ACS Publications
Three novel ferrocenecarboxylato-bridged lanthanide dimers [Gd2 (μ2-OOCFc) 2 (OOCFc) 4
(MeOH) 2 (H2O) 2]⊙ 2MeOH⊙ 2H2O (1)(Fc=(η5-C5H5) Fe (η5-C5H4)),[Nd2 (μ2-OOCFc) 2 …
(MeOH) 2 (H2O) 2]⊙ 2MeOH⊙ 2H2O (1)(Fc=(η5-C5H5) Fe (η5-C5H4)),[Nd2 (μ2-OOCFc) 2 …
Redox-Induced Intramolecular C–C Coupling of Acyclic Bis(2-pyridylmethylene)ethylenediamine on a Ru(acac)2 Platform
The paper documents redox-triggered C–C coupling of acyclic N, N′-bis (2-
pyridylmethylene) ethylenediamine (BPE) to yield 2, 3-bis (2-pyridyl) pyrazine (DPP) upon …
pyridylmethylene) ethylenediamine (BPE) to yield 2, 3-bis (2-pyridyl) pyrazine (DPP) upon …
Electrocatalytic CO2 Reduction with a Binuclear Bis‐Terpyridine Pyrazole‐Bridged Cobalt Complex**
A Bohn, JJ Moreno, P Thuéry, M Robert… - … A European Journal, 2023 - Wiley Online Library
A pyrazole‐based ligand substituted with terpyridine groups at the 3 and 5 positions has
been synthesized to form the dinuclear cobalt complex 1, that electrocatalytically reduces …
been synthesized to form the dinuclear cobalt complex 1, that electrocatalytically reduces …
Supramolecular networks in copper (II) malonate complexes
FS Delgado, F Lahoz, F Lloret, M Julve… - Crystal Growth and …, 2008 - ACS Publications
Six new copper (II)-malonate containing complexes [Cu (dpydiol)(mal)(H2O)]· 2H2O
(1)(dpydiol= bis (2-pyridyl) methanediol),[Cu (dpa)(mal)(H2O)]· H2O (2)(dpa= 2, 2 …
(1)(dpydiol= bis (2-pyridyl) methanediol),[Cu (dpa)(mal)(H2O)]· H2O (2)(dpa= 2, 2 …
Novel Manganese (II) Sulfonate− Phosphonates with Dinuclear, Tetranuclear, and Hexanuclear Clusters
ZY Du, AV Prosvirin, JG Mao - Inorganic chemistry, 2007 - ACS Publications
Hydrothermal reactions of manganese (II) salts with m-sulfophenylphosphonic acid (m-
HO3S− Ph− PO3H2, H3L) and 1, 10-phenanthroline (phen) led to six novel manganese (II) …
HO3S− Ph− PO3H2, H3L) and 1, 10-phenanthroline (phen) led to six novel manganese (II) …
Sodium-mediated manganation: direct mono-and dimanganation of benzene and synthesis of a transition-metal inverse-crown complex
LM Carrella, W Clegg, DV Graham… - Angewandte …, 2007 - strathprints.strath.ac.uk
Inside out approach: Twofold deprotonation of benzene by a sodium monoalkyl bisamido
manganate (II) reagent derived from BuNa, 2, 2, 6, 6-tetramethylpiperidine, and Mn …
manganate (II) reagent derived from BuNa, 2, 2, 6, 6-tetramethylpiperidine, and Mn …
Ferromagnetic coupling by the spin-polarization mechanism in a trinuclear VIV triplesalen complex
H Theil, CGF von Richthofen, A Stammler… - Inorganica Chimica …, 2008 - Elsevier
The first trinuclear vanadium complex [Formula: see text](1) of a triple tetradentate
triplesalen ligand has been synthesized and characterized. The triplesalen ligand [Formula …
triplesalen ligand has been synthesized and characterized. The triplesalen ligand [Formula …
High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(ii), Co(ii); H2mal …
FS Delgado, J Sanchiz, C Ruiz-Pérez, F Lloret… - …, 2003 - pubs.rsc.org
Four novel coordination polymers [M2 (mal) 2 (pym)(H2O)] n? nH2O, M~ Zn (1), Co (2) and
[M2 (mal) 2 (pyz)(H2O)] n? nH2O, M~ Zn (3), Co (4)(H2mal~ malonic acid, pym~ pyrimidine …
[M2 (mal) 2 (pyz)(H2O)] n? nH2O, M~ Zn (3), Co (4)(H2mal~ malonic acid, pym~ pyrimidine …