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Published on: November 15, 2017
2-[(Diphenyl-phosphor-yl)(hy-droxy)meth-yl]-5-meth-oxy-phenol
Yutian Shao1, Chao Yang, Wujiong Xia
1State Key Laboratory of Urban Water Resource and Environment (SKLUWRE) & Academy of Fundamental and Interdisciplinary Sciences, Harbin Institute of Technology, Harbin, Heilongjiang 150090, People's Republic of China.
This study details the molecular structure of a novel organophosphorus compound, C(20)H(19)O(4)P. The research reveals specific dihedral angles and crystal packing involving hydrogen bonds, forming supramolecular sheets.
Area of Science:
- Crystallography
- Organophosphorus Chemistry
- Supramolecular Chemistry
Background:
- Understanding the three-dimensional structure of organophosphorus compounds is crucial for predicting their chemical properties and potential applications.
- Crystal engineering and supramolecular chemistry explore how molecules self-assemble through non-covalent interactions, influencing material properties.
Purpose of the Study:
- To elucidate the crystal structure and molecular geometry of the title compound, C(20)H(19)O(4)P.
- To investigate the intermolecular interactions, specifically hydrogen bonding, that govern the compound's solid-state assembly.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the precise atomic arrangement and bond parameters.
- Analysis of the crystal structure revealed key dihedral angles between aromatic rings and identified hydrogen bonding motifs.
Main Results:
- The title compound, C(20)H(19)O(4)P, exhibits a specific molecular conformation with dihedral angles between phenyl rings at 73.3(4)°, and between the benzene and phenyl rings at 43.0(3)° and 54.3(1)°.
- Observed O-H⋯O hydrogen bonds and weaker interactions lead to the formation of a supramolecular sheet structure parallel to the (010) crystallographic plane.
Conclusions:
- The detailed structural analysis provides fundamental insights into the solid-state behavior of this organophosphorus compound.
- The identified supramolecular architecture highlights the role of hydrogen bonding in organizing molecules in the crystal lattice, relevant for materials science.
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