distorted octahedral coordination environment
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IUCrData ◽  
2021 ◽  
Vol 6 (2) ◽  
Author(s):  
Kwang Ha

In the title complex, [NiCl2(C5H5N)(C24H16N6)], the NiII ion is six-coordinated in a distorted octahedral coordination environment defined by three N atoms of the tridentate 2,3,5,6-tetra-2-pyridylpyrazine ligand, one N atom of the pyridine ligand and two Cl− anions, with the latter being mutually trans. The complex is disposed about a twofold rotation axis along the a axis. The complex molecules are connected in the crystal via C—H...Cl, C—H...N and π–π [closest inter-centroid separation = 3.7446 (14) Å between pyridyl rings].


IUCrData ◽  
2021 ◽  
Vol 6 (1) ◽  
Author(s):  
Kwang Ha

In the title compound, [Ni2Cl4(C18H12N6)2], the NiII ions are hexa-coordinated in a distorted octahedral coordination environment defined by three N atoms of the tridentate 2,4,6-tri-2-pyridyl-1,3,5-triazine ligand and three Cl− anions in a meridional geometry. The two NiII ions are bridged by two Cl anionic ligands, thereby forming a dinuclear complex. A crystallographic centre of inversion is located at the centroid of the Ni2Cl2 ring.


IUCrData ◽  
2020 ◽  
Vol 5 (1) ◽  
Author(s):  
Niels Ole Giltzau ◽  
Martin Köckerling

The title compound, [Co(C18H37N2)2(NCS)4], consists of a cobalt(II) ion positioned on the origin of the triclinic unit cell. It is coordinated by the N atoms of two trans-oriented 1-dodecyl-4-aza-1-azoniabicyclo[2.2.2]octane (DABCO+) cations, which carry n-dodecyl chains at the non-coordinating N atoms. The distorted octahedral coordination environment of the CoII ion is completed through four N atoms of isothiocyanate ions, which are arranged within the equatorial plane. Non-classical hydrogen bonding of the types C—H...N and C—H...S between the filamentous molecules lead to the formation of layers parallel to (001).


2019 ◽  
Vol 74 (6) ◽  
pp. 527-531
Author(s):  
Zhe Qian ◽  
Ai-Quan Jia ◽  
Feng Hu ◽  
Cai-Xia Zhang ◽  
Qian-Feng Zhang

AbstractA self-assembly reaction of Cd(NO3)2 · 4H2O, 3-ferrocenyl-5-(2-pyridyl)-pyrazole (Hfcpp), [Ag(SePh)]n, and Et3N in a mixed acetone-water solvent resulted in the formation of a heterometallic complex [Cd2{Ag(SePh)}2 (μ3-OH2)2(μ2,η3-fcpp)4] · 2C3H6O (1) with a phenylselenolate ligand. The two cadmium and two silver centers are linked by four [μ2,η3-fcpp]− ligands and two μ3-OH2 water molecules. Each Cd atom is in a slightly distorted octahedral coordination environment, while each Ag atom shows a distorted tetrahedral coordination geometry, which is composed of two pyrazolyl nitrogen atoms, one selenium atom, and one oxygen atom.


IUCrData ◽  
2018 ◽  
Vol 3 (9) ◽  
Author(s):  
M. Manjunathan ◽  
K. Anbalagan ◽  
K. Sambathkumar ◽  
E. Govindan

In the title compound, [CoBr(C2H8N2)2(C4H11N)]Br2, the cobalt(III) ion has a distorted octahedral coordination environment and is ligated by three N atoms and a bromine ion in the equatorial plane, and by two N atoms occupying the axial positions. In the crystal, the complex cation and the two Br− counter-anions are linked by N—H...Br hydrogen bonds, forming a supramolecular framework.


2018 ◽  
Vol 74 (9) ◽  
pp. 1206-1210 ◽  
Author(s):  
Ki-Min Park ◽  
Suk-Hee Moon ◽  
Youngjin Kang

In the solvated title compound, [Ir(C12H11N2)2(C11H19O2)]·CH3CO2C2H5, the IrIII ion adopts a distorted octahedral coordination environment resulting from its coordination by two C,N-chelating 2,6-dimethyl-3-(pyridin-2-yl)pyridin-4-yl ligands and one O,O′-chelating 2,2,6,6-tetramethylheptane-3,5-dionate ligand. The C,N-chelating ligands are perpendicular to each other [dihedral angle between the least-squares planes = 87.86 (5)°] and are arranged in a cis-C,C′ and trans-N,N′ fashion. In the crystal, pairwise C—H...π interactions between inversion-related IrIII complexes are present, forming a dimeric structure. The title complex shows bright bluish–green emission with good quantum efficiency in solution at room temperature.


IUCrData ◽  
2018 ◽  
Vol 3 (7) ◽  
Author(s):  
M. Manjunathan ◽  
S. Manimaran ◽  
K. Anbalagan ◽  
K. Sambathkumar ◽  
E. Govindan

In the title compound, [CoBr(C2H8N2)2(C4H11N)]Br2, the cobalt(III) ion has a distorted octahedral coordination environment and is surrounded by four N atoms in the equatorial plane made up of three N atoms from the two ethylenediamine ligands and the remaining N from the n-butyl substituent, with the other N atom from the ethylenediamine ligand and the Br atom occupying the axial positions. In the crystal, the complex cation and the two counter-anions are linked via N—H...Br and C—H...Br hydrogen bonds, forming a three-dimensional network. The crystal studied was refined as a two-component inversion twin.


2018 ◽  
Vol 74 (8) ◽  
pp. 1107-1110
Author(s):  
Nirmal K. Shee ◽  
Chang Seop Hong ◽  
Woo Ram Lee ◽  
Hee-Joon Kim

The asymmetric unit of the solvated title complex, [Ir(C11H8N)2(C15H14NO3)]·2CH2Cl2, consists of two complex molecules together with four dichloromethane solvent molecules, one of which is disordered. In each complex molecule, the IrIII ion has a distorted octahedral coordination environment defined by two 2-phenylpyridine ligands, through two phenyl C and two pyridine N atoms, and by one N,O-bidentate 2-[(2,4-dimethoxyphenylimino)methyl]phenolate anion. The IrIII ions lie almost in the equatorial planes with deviations of 0.0396 (17) and 0.0237 (17) Å, respectively, for the two complex molecules. In both complex molecules, the two 2-phenylpyridine ligands are nearly perpendicular to each other [dihedral angles between the least-squares-planes of 89.91 (11) and 85.13 (11)°]. In the crystal, intermolecular C—H...O interactions as well as intermolecular C—H...π interactions are present, leading to a three-dimensional network structure. One of the four dichlormethane solvent molecules shows disorder over two sets of sites [occupancy ratio 0.79 (2):0.21 (2)].


IUCrData ◽  
2018 ◽  
Vol 3 (6) ◽  
Author(s):  
S. Manimaran ◽  
M. Manjunathan ◽  
E. Govindan ◽  
K. Sambathkumar ◽  
K. Anbalagan

In the title complex, [CoBr(C2H7N)(C2H8N2)2]Br2, the CoIII centre has a distorted octahedral coordination environment, and is surrounded by four N atoms in the equatorial plane, with an additional N atom and the Br atom occupying the axial positions. The complex is isostructural with the Cl compound for which the X-ray structure has also been reported [Anbalagan, Mahalakshmi & Ganeshraja (2011). J. Mol. Struct. 1005, 45–52]. In the crystal, the complex cation and the two counter-anions are linked via N—H...Br hydrogen bonds, forming a three-dimensional network.


IUCrData ◽  
2018 ◽  
Vol 3 (6) ◽  
Author(s):  
S. Manimaran ◽  
E. Govindan ◽  
M. Manjunathan ◽  
K. Sambathkumar ◽  
K. Anbalagan

In the title compound, [CoBr(CH5N)(C2H8N2)2]Br2, the cobalt(III) ion has a distorted octahedral coordination environment and is ligated by four N atoms in the equatorial plane, with an additional N atom and a Br− ion occupying the axial positions. In the crystal, the complex cation and the two counter-anions are linked via N—H...Br and C—H...Br hydrogen bonds, forming a supramolecular framework.


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