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Acetonitrile-bis-(2-methyl-1,10-phenanthroline)copper(II) tetra-fluoridoborate.

Watton SP - Acta Crystallogr Sect E Struct Rep Online (2010)

Bottom Line: In the title compound, [Cu(CH(3)CN)(C(13)H(10)N(2))(2)](BF(4))(2), the fivefold-coordinate Cu(II) atom is located on a twofold rotation axis, imposing twofold symmetry to the complete cation.The structure exhibits disorder of the anion, which was successfully refined using a two-site model with 0.810 (3):0.190 (3) occupancy.The methyl group of the acetonitrile ligand is likewise disordered, here about the twofold rotation axis in a 1:1 ratio.

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Affiliation: Department of Chemistry and Biochemistry, Central Connecticut State University, 1615 Stanley Street, New Britain, CT 06050, USA.

ABSTRACT
In the title compound, [Cu(CH(3)CN)(C(13)H(10)N(2))(2)](BF(4))(2), the fivefold-coordinate Cu(II) atom is located on a twofold rotation axis, imposing twofold symmetry to the complete cation. The structure exhibits disorder of the anion, which was successfully refined using a two-site model with 0.810 (3):0.190 (3) occupancy. The methyl group of the acetonitrile ligand is likewise disordered, here about the twofold rotation axis in a 1:1 ratio.

No MeSH data available.


ORTEP plot indicating atom labeling scheme. Labels with an "a" suffix indicate symmetry equivalents of the corresponding atom numbers. Displacement ellipsoids are shown at the 50% probability level and H atoms have been omitted for clarity. The model for anion disorder is indicated and "b" suffixes correspond to lower-occupancy (19%) positions.
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Fap1: ORTEP plot indicating atom labeling scheme. Labels with an "a" suffix indicate symmetry equivalents of the corresponding atom numbers. Displacement ellipsoids are shown at the 50% probability level and H atoms have been omitted for clarity. The model for anion disorder is indicated and "b" suffixes correspond to lower-occupancy (19%) positions.


Acetonitrile-bis-(2-methyl-1,10-phenanthroline)copper(II) tetra-fluoridoborate.

Watton SP - Acta Crystallogr Sect E Struct Rep Online (2010)

ORTEP plot indicating atom labeling scheme. Labels with an "a" suffix indicate symmetry equivalents of the corresponding atom numbers. Displacement ellipsoids are shown at the 50% probability level and H atoms have been omitted for clarity. The model for anion disorder is indicated and "b" suffixes correspond to lower-occupancy (19%) positions.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3009216&req=5

Fap1: ORTEP plot indicating atom labeling scheme. Labels with an "a" suffix indicate symmetry equivalents of the corresponding atom numbers. Displacement ellipsoids are shown at the 50% probability level and H atoms have been omitted for clarity. The model for anion disorder is indicated and "b" suffixes correspond to lower-occupancy (19%) positions.
Bottom Line: In the title compound, [Cu(CH(3)CN)(C(13)H(10)N(2))(2)](BF(4))(2), the fivefold-coordinate Cu(II) atom is located on a twofold rotation axis, imposing twofold symmetry to the complete cation.The structure exhibits disorder of the anion, which was successfully refined using a two-site model with 0.810 (3):0.190 (3) occupancy.The methyl group of the acetonitrile ligand is likewise disordered, here about the twofold rotation axis in a 1:1 ratio.

View Article: PubMed Central - HTML - PubMed

Affiliation: Department of Chemistry and Biochemistry, Central Connecticut State University, 1615 Stanley Street, New Britain, CT 06050, USA.

ABSTRACT
In the title compound, [Cu(CH(3)CN)(C(13)H(10)N(2))(2)](BF(4))(2), the fivefold-coordinate Cu(II) atom is located on a twofold rotation axis, imposing twofold symmetry to the complete cation. The structure exhibits disorder of the anion, which was successfully refined using a two-site model with 0.810 (3):0.190 (3) occupancy. The methyl group of the acetonitrile ligand is likewise disordered, here about the twofold rotation axis in a 1:1 ratio.

No MeSH data available.