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2-Chloro-5-(2-iodo-benzene-sulfonamido)-benzoic acid.


ABSTRACT: In the mol-ecule of the title compound, C(13)H(9)ClINO(4)S, the coordination around the S atom is distorted tetra-hedral. The aromatic rings are oriented at a dihedral angle of 74.46?(9)°. Intra-molecular C-H?O hydrogen bonds result in the formation of two five- and one six-membered rings, which adopt planar, envelope and twisted conformations, respectively. In the crystal structure, inter-molecular N-H?O and O-H?O hydrogen bonds link the mol-ecules to form R(2) (2)(8) ring motifs, which are further linked by C-H?O hydrogen bonds. ?-? contacts between the benzene rings [centroid-centroid distances = 3.709?(3) and 3.772?(3)?Å] may further stabilize the structure. The I atom is disordered over two positions, refined with occupancies of ca 0.75 and 0.25.

SUBMITTER: Arshad MN 

PROVIDER: S-EPMC2968399 | biostudies-other | 2009

REPOSITORIES: biostudies-other

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2-Chloro-5-(2-iodo-benzene-sulfonamido)-benzoic acid.

Arshad Muhammad Nadeem MN   Tahir M Nawaz MN   Khan Islam Ullah IU   Siddiqui Waseeq Ahmad WA   Shafiq Muhammad M  

Acta crystallographica. Section E, Structure reports online 20090110 Pt 2


In the mol-ecule of the title compound, C(13)H(9)ClINO(4)S, the coordination around the S atom is distorted tetra-hedral. The aromatic rings are oriented at a dihedral angle of 74.46 (9)°. Intra-molecular C-H⋯O hydrogen bonds result in the formation of two five- and one six-membered rings, which adopt planar, envelope and twisted conformations, respectively. In the crystal structure, inter-molecular N-H⋯O and O-H⋯O hydrogen bonds link the mol-ecules to form R(2) (2)(8) ring motifs, which are fur  ...[more]

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