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1,2,4,5-Tetra-fluoro-3,6-diiodo-benzene-2,3-bis-(pyridin-2-yl)pyrazine (1/1).

Arman HD, Kaulgud T, Tiekink ER - Acta Crystallogr Sect E Struct Rep Online (2010)

Bottom Line: The components of the title 1:1 co-crystal, C(14)H(10)N(4)·C(6)F(4)I(2), are connected via an N⋯I [2.959 (4) Å] halogen bond, in which the N atom is part of the relatively electron-rich pyrazine ring.The C(6)F(4)I(2) mol-ecule is almost planar [r.m.s. deviation = 0.038 Å] but there are significant twists in the pyrazine derivative, as seen in the dihedral angles [31.3 (2) and 54.6 (2)°] formed between the pendant pyridyl rings and the central pyrazine ring.The bimolecular aggregates are sustained in the crystal by C-H⋯F and π-π inter-actions [ring centroid(pyrid-yl)-ring centroid(benzene) = 3.678 (3) Å].

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ABSTRACT
The components of the title 1:1 co-crystal, C(14)H(10)N(4)·C(6)F(4)I(2), are connected via an N⋯I [2.959 (4) Å] halogen bond, in which the N atom is part of the relatively electron-rich pyrazine ring. The C(6)F(4)I(2) mol-ecule is almost planar [r.m.s. deviation = 0.038 Å] but there are significant twists in the pyrazine derivative, as seen in the dihedral angles [31.3 (2) and 54.6 (2)°] formed between the pendant pyridyl rings and the central pyrazine ring. The bimolecular aggregates are sustained in the crystal by C-H⋯F and π-π inter-actions [ring centroid(pyrid-yl)-ring centroid(benzene) = 3.678 (3) Å].

No MeSH data available.


A view in projection down the a axis showing the unit-cell contents. The N···I, C—H···F and π···π interactions are shown as blue, orange and purple dashed lines, respectively.
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Fap3: A view in projection down the a axis showing the unit-cell contents. The N···I, C—H···F and π···π interactions are shown as blue, orange and purple dashed lines, respectively.


1,2,4,5-Tetra-fluoro-3,6-diiodo-benzene-2,3-bis-(pyridin-2-yl)pyrazine (1/1).

Arman HD, Kaulgud T, Tiekink ER - Acta Crystallogr Sect E Struct Rep Online (2010)

A view in projection down the a axis showing the unit-cell contents. The N···I, C—H···F and π···π interactions are shown as blue, orange and purple dashed lines, respectively.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3009248&req=5

Fap3: A view in projection down the a axis showing the unit-cell contents. The N···I, C—H···F and π···π interactions are shown as blue, orange and purple dashed lines, respectively.
Bottom Line: The components of the title 1:1 co-crystal, C(14)H(10)N(4)·C(6)F(4)I(2), are connected via an N⋯I [2.959 (4) Å] halogen bond, in which the N atom is part of the relatively electron-rich pyrazine ring.The C(6)F(4)I(2) mol-ecule is almost planar [r.m.s. deviation = 0.038 Å] but there are significant twists in the pyrazine derivative, as seen in the dihedral angles [31.3 (2) and 54.6 (2)°] formed between the pendant pyridyl rings and the central pyrazine ring.The bimolecular aggregates are sustained in the crystal by C-H⋯F and π-π inter-actions [ring centroid(pyrid-yl)-ring centroid(benzene) = 3.678 (3) Å].

View Article: PubMed Central - HTML - PubMed

ABSTRACT
The components of the title 1:1 co-crystal, C(14)H(10)N(4)·C(6)F(4)I(2), are connected via an N⋯I [2.959 (4) Å] halogen bond, in which the N atom is part of the relatively electron-rich pyrazine ring. The C(6)F(4)I(2) mol-ecule is almost planar [r.m.s. deviation = 0.038 Å] but there are significant twists in the pyrazine derivative, as seen in the dihedral angles [31.3 (2) and 54.6 (2)°] formed between the pendant pyridyl rings and the central pyrazine ring. The bimolecular aggregates are sustained in the crystal by C-H⋯F and π-π inter-actions [ring centroid(pyrid-yl)-ring centroid(benzene) = 3.678 (3) Å].

No MeSH data available.