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Abstract:

The crystal structure of the dimeric title compound, C19H 22O5H, is dominated by a head-to-head hydrogen-bonding inter-action between centrosymmetrically related carboxyl groups in each monomer. The result is a dimeric axis of unusual length (ca 34 Å), but still shorter than what could be expected for a fully extended chain, owing to two turning points in the oligo-eth-oxy ends. This allows for an explanation of the structure of the smectic mesophase exhibited by this compound and at the same time fully validates former geometric estimations based on PM3 calculations. © 2009 International Union of Crystallography.

Registro:

Documento: Artículo
Título:4'-[2-(2-Ethoxy-ethoxy)eth-oxy]-bi-phenyl-4-carboxylic acid: Correlation between its crystalline and smectic phases
Autor:Montani, R.S.; Garay, R.O.; Cukiernik, F.D.; Garland, M.T.; Baggio, R.
Filiación:INQUISUR, Departamento de Química, Universidad Nacional Del sur, Bahía Blanca, Argentina
Departamento de Química Inorgánica, Analítica y Química Física, Facultad de Ciencias Exactas y Naturales, UBA, Buenos Aires, Argentina
Departamento de Física, Facultad de Ciencias Físicas y Matemáticas and CIMAT, Universidad de Chile, Santiago de Chile, Chile
Departamento de Física, Centro Atómico Constituyentes, Comisión Nacional de Energía Atómica, Buenos Aires, Argentina
Palabras clave:Carboxylic acids; Hydrogen; Organic acids; Carboxyl groups; Hydrogen bondings; Pm3 calculations; Smectic mesophase; Smectic phasis; Title compounds; Turning points; Crystal structure
Año:2009
Volumen:65
Número:3
Página de inicio:o81
Página de fin:o84
DOI: http://dx.doi.org/10.1107/S0108270109001991
Título revista:Acta Crystallographica Section C: Crystal Structure Communications
Título revista abreviado:Acta Crystallogr Sect C Cryst Struct Commun
ISSN:01082701
CODEN:ACSCE
PDF:https://bibliotecadigital.exactas.uba.ar/download/paper/paper_01082701_v65_n3_po81_Montani.pdf
Registro:https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_01082701_v65_n3_po81_Montani

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Citas:

---------- APA ----------
Montani, R.S., Garay, R.O., Cukiernik, F.D., Garland, M.T. & Baggio, R. (2009) . 4'-[2-(2-Ethoxy-ethoxy)eth-oxy]-bi-phenyl-4-carboxylic acid: Correlation between its crystalline and smectic phases. Acta Crystallographica Section C: Crystal Structure Communications, 65(3), o81-o84.
http://dx.doi.org/10.1107/S0108270109001991
---------- CHICAGO ----------
Montani, R.S., Garay, R.O., Cukiernik, F.D., Garland, M.T., Baggio, R. "4'-[2-(2-Ethoxy-ethoxy)eth-oxy]-bi-phenyl-4-carboxylic acid: Correlation between its crystalline and smectic phases" . Acta Crystallographica Section C: Crystal Structure Communications 65, no. 3 (2009) : o81-o84.
http://dx.doi.org/10.1107/S0108270109001991
---------- MLA ----------
Montani, R.S., Garay, R.O., Cukiernik, F.D., Garland, M.T., Baggio, R. "4'-[2-(2-Ethoxy-ethoxy)eth-oxy]-bi-phenyl-4-carboxylic acid: Correlation between its crystalline and smectic phases" . Acta Crystallographica Section C: Crystal Structure Communications, vol. 65, no. 3, 2009, pp. o81-o84.
http://dx.doi.org/10.1107/S0108270109001991
---------- VANCOUVER ----------
Montani, R.S., Garay, R.O., Cukiernik, F.D., Garland, M.T., Baggio, R. 4'-[2-(2-Ethoxy-ethoxy)eth-oxy]-bi-phenyl-4-carboxylic acid: Correlation between its crystalline and smectic phases. Acta Crystallogr Sect C Cryst Struct Commun. 2009;65(3):o81-o84.
http://dx.doi.org/10.1107/S0108270109001991