Bis-(2-hydroxyethyl)ammonium 2-bromophenolate

Kamentheren Padayachy; Manuel A. Fernandes; Helder M. Marques; Andreas Lemmerer; Alvaro S.De Sousa

doi:10.1107/S1600536812033752

Bis-(2-hydroxyethyl)ammonium 2-bromophenolate

Kamentheren Padayachy, Manuel A. Fernandes, Helder M. Marques, Andreas Lemmerer, Alvaro S.De Sousa

Research output: Contribution to journal › Article › peer-review

4 Scopus citations

Abstract

In the crystal structure of the 1:1 title salt, C₄H ₁₂NO₂ ⁺·C₆H ₄BrO^-, hydrogen-bonding interactions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C - O and C - N bonds of the 2-hydroxyethyl fragments also facilitates O - H⋯O interactions of bis-(2-hydroxyethyl)ammonium cation chains to phenolate O atoms. The resulting double-ion chains along [100] are further linked by N - H⋯O interactions, forming chains parallel to [110].

Original language	English
Pages (from-to)	o2610
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	68
Issue number	9
DOIs	https://doi.org/10.1107/S1600536812033752
State	Published - 1 Sep 2012
Externally published	Yes

ASJC Scopus subject areas

General Chemistry
General Materials Science
Condensed Matter Physics

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title = "Bis-(2-hydroxyethyl)ammonium 2-bromophenolate",

abstract = "In the crystal structure of the 1:1 title salt, C4H 12NO2 +·C6H 4BrO-, hydrogen-bonding interactions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C - O and C - N bonds of the 2-hydroxyethyl fragments also facilitates O - H⋯O interactions of bis-(2-hydroxyethyl)ammonium cation chains to phenolate O atoms. The resulting double-ion chains along [100] are further linked by N - H⋯O interactions, forming chains parallel to [110].",

author = "Kamentheren Padayachy and Fernandes, \{Manuel A.\} and Marques, \{Helder M.\} and Andreas Lemmerer and Sousa, \{Alvaro S.De\}",

year = "2012",

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T1 - Bis-(2-hydroxyethyl)ammonium 2-bromophenolate

AU - Padayachy, Kamentheren

AU - Fernandes, Manuel A.

AU - Marques, Helder M.

AU - Lemmerer, Andreas

AU - Sousa, Alvaro S.De

PY - 2012/9/1

Y1 - 2012/9/1

N2 - In the crystal structure of the 1:1 title salt, C4H 12NO2 +·C6H 4BrO-, hydrogen-bonding interactions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C - O and C - N bonds of the 2-hydroxyethyl fragments also facilitates O - H⋯O interactions of bis-(2-hydroxyethyl)ammonium cation chains to phenolate O atoms. The resulting double-ion chains along [100] are further linked by N - H⋯O interactions, forming chains parallel to [110].

AB - In the crystal structure of the 1:1 title salt, C4H 12NO2 +·C6H 4BrO-, hydrogen-bonding interactions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C - O and C - N bonds of the 2-hydroxyethyl fragments also facilitates O - H⋯O interactions of bis-(2-hydroxyethyl)ammonium cation chains to phenolate O atoms. The resulting double-ion chains along [100] are further linked by N - H⋯O interactions, forming chains parallel to [110].

UR - https://www.scopus.com/pages/publications/84865714694

U2 - 10.1107/S1600536812033752

DO - 10.1107/S1600536812033752

M3 - Article

AN - SCOPUS:84865714694

SN - 1600-5368

VL - 68

SP - o2610

JO - Acta Crystallographica Section E: Structure Reports Online

JF - Acta Crystallographica Section E: Structure Reports Online

IS - 9

ER -

Bis-(2-hydroxyethyl)ammonium 2-bromophenolate

Abstract

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