期刊
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS
卷 62, 期 -, 页码 926-930出版社
INT UNION CRYSTALLOGRAPHY
DOI: 10.1107/S0108768106025821
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资金
- Engineering and Physical Sciences Research Council [GR/S24114/01] Funding Source: researchfish
The structures of both known forms of the polymorphic material ortho-acetamidobenzamide, C9H10N2O2, have been determined by low-temperature neutron single-crystal diffraction. Neutron diffraction allows the full description of the H-atom positions in this molecular material, which is vital in benchmarking related crystal-structure predictions. Significant conformational differences are indicated by a number of the torsion angles involving H atoms when compared with previous X-ray studies. A comprehensive description of the hydrogen-bonding scheme in both polymorphs is given.
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