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Updated: Jun 1, 2026
08:47
Synthesis and Bioconjugation of Thiol-Reactive Reagents for the Creation of Site-Selectively Modified Immunoconjugates
Published on: March 6, 2019
3-(2-Thioxo-1,3-dithiol-4-ylsulfan-yl)-propane-nitrile
Summary
This study details the crystal structure of a novel sulfur-rich organic compound, C(6)H(5)NS(4). The research reveals its planar molecular structure and the formation of 2D layers through specific intermolecular interactions.
Area of Science:
- Crystallography
- Materials Science
- Organic Chemistry
Background:
- Understanding the structural properties of novel organic compounds is crucial for materials science.
- Sulfur-rich molecules offer unique electronic and structural characteristics.
Purpose of the Study:
- To elucidate the crystal structure of the title compound, C(6)H(5)NS(4).
- To analyze the molecular geometry and intermolecular interactions within the crystal lattice.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the atomic arrangement.
- Analysis of bond lengths, bond angles, and intermolecular contacts was performed.
Main Results:
- The compound features a planar 2-thioxo-1,3-dithiol-4-ylsulfanyl core with a cyano-ethyl-sulfanyl substituent.
- Intermolecular C-H⋯S hydrogen bonds and S⋯N interactions were identified.
- These interactions facilitate the formation of two-dimensional layers in the bc plane.
Conclusions:
- The crystal structure of C(6)H(5)NS(4) has been successfully determined.
- The observed intermolecular interactions dictate the compound's layered structure.
- This structural insight is valuable for designing novel sulfur-containing materials.
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