4-Chloro-phenyl 4-chloro-benzoate

B. Thimme Gowda, Sabine Foro, K. S. Babitha, Hartmut Fuess

Research output: Contribution to journalArticle

Abstract

The structure of the title compound (4CP4CBA), C13H8Cl2O2, resembles those of 4-methyl-phenyl 4-chloro-benzoate (4MP4CBA), 4-chloro-phenyl 4-methyl-benzoate (4CP4MBA) and 4-methyl-phenyl 4-methyl-benzoate (4MP4MBA), with similar bond parameters. The dihedral angle between the two benzene rings in 4CP4CBA is 47.98 (7)°, compared with 51.86 (4)° in 4MP4CBA, 63.89 (8)° in 4CP4MBA and 63.57 (5)° in 4MP4MBA. In the crystal structure, mol-ecules are linked into helical chains running along the b axis by C - H - O hydrogen bonds.

Original languageEnglish
JournalActa Crystallographica Section E: Structure Reports Online
Volume64
Issue number8
DOIs
Publication statusPublished - 2008

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Benzoates
Dihedral angle
dihedral angle
Benzene
Hydrogen bonds
Crystal structure
benzene
hydrogen bonds
crystal structure
rings
methyl benzoate

All Science Journal Classification (ASJC) codes

  • Chemistry(all)
  • Materials Science(all)
  • Condensed Matter Physics

Cite this

Gowda, B. Thimme ; Foro, Sabine ; Babitha, K. S. ; Fuess, Hartmut. / 4-Chloro-phenyl 4-chloro-benzoate. In: Acta Crystallographica Section E: Structure Reports Online. 2008 ; Vol. 64, No. 8.
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4-Chloro-phenyl 4-chloro-benzoate. / Gowda, B. Thimme; Foro, Sabine; Babitha, K. S.; Fuess, Hartmut.

In: Acta Crystallographica Section E: Structure Reports Online, Vol. 64, No. 8, 2008.

Research output: Contribution to journalArticle

TY - JOUR

T1 - 4-Chloro-phenyl 4-chloro-benzoate

AU - Gowda, B. Thimme

AU - Foro, Sabine

AU - Babitha, K. S.

AU - Fuess, Hartmut

PY - 2008

Y1 - 2008

N2 - The structure of the title compound (4CP4CBA), C13H8Cl2O2, resembles those of 4-methyl-phenyl 4-chloro-benzoate (4MP4CBA), 4-chloro-phenyl 4-methyl-benzoate (4CP4MBA) and 4-methyl-phenyl 4-methyl-benzoate (4MP4MBA), with similar bond parameters. The dihedral angle between the two benzene rings in 4CP4CBA is 47.98 (7)°, compared with 51.86 (4)° in 4MP4CBA, 63.89 (8)° in 4CP4MBA and 63.57 (5)° in 4MP4MBA. In the crystal structure, mol-ecules are linked into helical chains running along the b axis by C - H - O hydrogen bonds.

AB - The structure of the title compound (4CP4CBA), C13H8Cl2O2, resembles those of 4-methyl-phenyl 4-chloro-benzoate (4MP4CBA), 4-chloro-phenyl 4-methyl-benzoate (4CP4MBA) and 4-methyl-phenyl 4-methyl-benzoate (4MP4MBA), with similar bond parameters. The dihedral angle between the two benzene rings in 4CP4CBA is 47.98 (7)°, compared with 51.86 (4)° in 4MP4CBA, 63.89 (8)° in 4CP4MBA and 63.57 (5)° in 4MP4MBA. In the crystal structure, mol-ecules are linked into helical chains running along the b axis by C - H - O hydrogen bonds.

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