The structure of the title compound, C~23~H~27~N~2~O~4~ ^+^·C~8~H~3~Cl~2~O~4~ ^−^, a 1:1 proton-transfer compound of brucine with 4,5-dichlorophthalic acid, has been determined at 130 K. The brucinium cations and the hydrogen phthalate anions associate through single N—H...O~carboxylate~ hydrogen bo
3-(Trifluoromethyl)anilinium 2-carboxy-4,5-dichlorobenzoate
✍ Scribed by Odabaşoğlu, Mustafa ;Büyükgüngör, Orhan
- Publisher
- International Union of Crystallography
- Year
- 2007
- Tongue
- English
- Weight
- 1001 KB
- Volume
- 63
- Category
- Article
- ISSN
- 1600-5368
No coin nor oath required. For personal study only.
✦ Synopsis
The crystal structure of the title compound, C~7~H~7~F~3~N^+^·C~8~H~3~Cl~2~O~4~
^−^, is stabilized by five N—H...O, one O—H...O, two C—H...O and three C—H...X (X = F, Cl) hydrogen bonds. Intramolecular O—H...O and C—H...X hydrogen bonds generate edge-fused [S(7)R
~4~
^4^(24)S(7)R
~2~
^2^(10)S(7)R
~4~
^4^(24)S(7)] motifs. The cations and anions are linked to each other by C—H...O hydrogen bonds, forming a chain along the c axis. This chain and the other hydrogen bonds form [R
~3~
^2^(6)R
~1~
^2^(4)S(7)R
~1~
^2^(4)R
~4~
^4^(18)R
~5~
^5^(24)R
~4~
^4^(18)R
~1~
^2^(4)R
~1~
^2^(4)S(7)R
~1~
^2^(4)R
~3~
^2^(6)] motifs. The dihedral angle between the planes of the aromatic rings in the cation and anion is 34.86 (1)°.
📜 SIMILAR VOLUMES
## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF.
Tetralone 1 Pentanoic acid, 3-carboxy 1 Furandione The synthesis of 3-carboxy-4-(trifluoromethyl)tetralone'~2~, a model compound which is important for the preparation of perfluoroalkyl-substituted tetracyclines, is an offshoot of an attempted synthesis of the hydroxytetralone 2. Some of the results