2,3-Dimethoxy-10-oxostrychnidinium 3-carboxybenzoate trihydrate: The 1:1 proton-transfer compound of brucine with isophthalic acid

Graham Smith; Urs D. Wermuth; David J. Young; Jonathan M. White

doi:10.1107/S1600536806010026

2,3-Dimethoxy-10-oxostrychnidinium 3-carboxybenzoate trihydrate: The 1:1 proton-transfer compound of brucine with isophthalic acid

Graham Smith, Urs D. Wermuth, David J. Young, Jonathan M. White

Research output: Contribution to journal › Article

Abstract

The structure of the title, compound C₂₃H₂₇N ₂O₄₊-C₈H₅O₄^-3H²O, has been determined at 130 K. The hydrogen isophthalate anions and the water molecules (one of which is disordered over two approximately equal sites) associate through extensive hydrogen-bonded interactions, including those with the common undulating brucinium cation layer substructures, forming a three-dimensional framework structure.

Original language	English
Pages (from-to)	o1553-o1555
Number of pages	3
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	E62
Issue number	Part 4
DOIs	https://doi.org/10.1107/S1600536806010026
Publication status	Published - 1 Apr 2006
Externally published	Yes

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abstract = "The structure of the title, compound C23H27N 2O4+-C8H5O4-3H2O, has been determined at 130 K. The hydrogen isophthalate anions and the water molecules (one of which is disordered over two approximately equal sites) associate through extensive hydrogen-bonded interactions, including those with the common undulating brucinium cation layer substructures, forming a three-dimensional framework structure.",

author = "Graham Smith and Wermuth, {Urs D.} and Young, {David J.} and White, {Jonathan M.}",

year = "2006",

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language = "English",

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T2 - The 1:1 proton-transfer compound of brucine with isophthalic acid

AU - Smith, Graham

AU - Wermuth, Urs D.

AU - Young, David J.

AU - White, Jonathan M.

PY - 2006/4/1

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N2 - The structure of the title, compound C23H27N 2O4+-C8H5O4-3H2O, has been determined at 130 K. The hydrogen isophthalate anions and the water molecules (one of which is disordered over two approximately equal sites) associate through extensive hydrogen-bonded interactions, including those with the common undulating brucinium cation layer substructures, forming a three-dimensional framework structure.

AB - The structure of the title, compound C23H27N 2O4+-C8H5O4-3H2O, has been determined at 130 K. The hydrogen isophthalate anions and the water molecules (one of which is disordered over two approximately equal sites) associate through extensive hydrogen-bonded interactions, including those with the common undulating brucinium cation layer substructures, forming a three-dimensional framework structure.

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DO - 10.1107/S1600536806010026

M3 - Article

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VL - E62

SP - o1553-o1555

JO - Acta Crystallographica Section E: Crystallographic Communications

JF - Acta Crystallographica Section E: Crystallographic Communications

SN - 1600-5368

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ER -