AI Article Synopsis
- The compound CHNO ·Br·CHNO is a bromide salt made from a 50:50 mixture of two related organic molecules: one is a tri-ethyl-azaniumyl-carboxylic acid, and the other is its zwitterionic form.
- These two molecules are connected by a hydrogen bond involving a partially occupied bridging hydrogen atom from the carboxylic acid group.
- The tetra-lkyl-ammonium group has a nearly perfect tetrahedral shape, with specific bond lengths consistent with established values, and features an orientation where the carbonyl oxygen forms intra-molecular hydrogen bonds.
Article Abstract
The title compound, CHNO ·Br·CHNO, crystallizes as the bromide salt of a 50:50 mixture of (tri-ethyl-azaniumyl)-carb-oxy-lic acid and the zwitterionic (tri-ethyl-azaniumyl)-carboxyl-ate. The two organic entities are linked by a half-occupied bridging carb-oxy-lic acid hydrogen atom that is hydrogen-bonded to the carboxyl-ate group of the second mol-ecule. The tetra-lkyl-ammonium group adopts a nearly perfect tetra-hedral shape around the nitro-gen atom with bond lengths that agree with known values. The carb-oxy-lic acid/carboxyl-ate group is oriented to one of the ethyl groups on the ammonium group, and the carbonyl oxygen atom is engaged in intra-molecular C-H⋯O hydrogen bonds.
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| http://www.ncbi.nlm.nih.gov/pmc/articles/PMC10483553 | PMC |
| http://dx.doi.org/10.1107/S2056989023006850 | DOI Listing |
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