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Crystal structure of 2,3'-bi-pyridine-2',6'-dicarbo-nitrile.

ABSTRACT: The title compound, C₁₂H₆N₄, crystallizes with four independent mol-ecules (A, B, C and D) in the asymmetric unit. The dihedral angles between the two pyridine rings in each mol-ecule are 25.25?(8)° in A, 5.51?(9)° in B, 11.11?(9)° in C and 16.24?(8)° in D. In the crystal, mol-ecules A and B are linked by C-H?N hydrogen bonds to form layers extending parallel to the ab plane, while mol-ecules C and D are linked by C-H?N hydrogen bonds forming -C-D-C-D- chains propagating along the b-axis direction. The layers and the chains are stacked alternately along the c axis through offset ?-? and C?N?? [N-to-pyridine-centroid distance = 3.882?(2)?Å] inter-actions, resulting in the formation of a supra-molecular framework.

SUBMITTER: Jung S

PROVIDER: S-EPMC6127714 | biostudies-literature | 2018 Sep

REPOSITORIES: biostudies-literature

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Crystal structure of 2,3'-bi-pyridine-2',6'-dicarbo-nitrile.

Jung Seoulgi S Park Ki-Min KM Kim Jinho J Kang Youngjin Y

Acta crystallographica. Section E, Crystallographic communications 20180821 Pt 9

The title compound, C12H6N4, crystallizes with four independent mol-ecules (A, B, C and D) in the asymmetric unit. The dihedral angles between the two pyridine rings in each mol-ecule are 25.25 (8)° in A, 5.51 (9)° in B, 11.11 (9)° in C and 16.24 (8)° in D. In the crystal, mol-ecules A and B are linked by C-H⋯N hydrogen bonds to form layers extending parallel to the ab plane, while mol-e ...[more]

PMID: 30225115

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