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5-(4-Chloro-phen-yl)-1H-tetra-zole.

ABSTRACT: The two independent mol-ecules of the title compound, C(7)H(5)ClN(4), both lie on a twofold rotation axis that passes through the centroids of the five- and six-membered rings and the attached Cl C atom. One molecule is nearly planar [dihedral angle between rings = 0.22?(6)°], whereas the other is significantly twisted [dihedral angle = 17.38?(6)°]. In the crystal, adjacent mol-ecules are linked by N-H?N hydrogen bonds into a chain structure.

SUBMITTER: Xu L

PROVIDER: S-EPMC2983818 | biostudies-other | 2010

REPOSITORIES: biostudies-other

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5-(4-Chloro-phen-yl)-1H-tetra-zole.

Xu Liang L Gu Li-Yan LY Zhao Dan-Yu DY Wang Bing B Kang Ting-Guo TG

Acta crystallographica. Section E, Structure reports online 20100303 Pt 4

The two independent mol-ecules of the title compound, C(7)H(5)ClN(4), both lie on a twofold rotation axis that passes through the centroids of the five- and six-membered rings and the attached Cl C atom. One molecule is nearly planar [dihedral angle between rings = 0.22 (6)°], whereas the other is significantly twisted [dihedral angle = 17.38 (6)°]. In the crystal, adjacent mol-ecules are linked by N-H⋯N hydrogen bonds into a chain structure. ...[more]

PMID: 21580587

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1-(4-Chloro-phen-yl)-1H-1,2,3,4-tetra-zole.

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