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Updated: Jun 1, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
Published on: April 12, 2019
Hydrogen bonding in 2-carboxy-anilinium dihydrogen phosphite at 100 K
Nourredine Benali-Cherif1, Fatima Allouche, Amani Direm
1Laboratoire des Structures, Propriétés et Interactions Inter Atomiques (LASPI A), Centre Universitaire de Khenchela, 40000 Khenchela, Algeria.
Abstract:
The title compound, C(7)H(8)NO(2) (+)·H(2)PO(3) (-), is formed from alternating layers of organic cations and inorganic anions stacked along the a-axis direction. They are associated via O-H⋯O, N-H⋯O and C-H⋯O hydrogen bonding, giving rise to two different R(2) (2)(8) graph-set motifs and generating a three-dimensional network.
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