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Synthesize of an Azo Compound: Investigation its Optical Nonlinear Properties and DFT Study
Sadiq M H Ismael1, Numan S Hashim2, F A Al-Saymari2
1Department of Chemistry, College of Education for Pure Sciences, University of Basrah, Basrah, 61001, Iraq.
This study synthesized novel azo compounds from sulfamerazine, confirming their structure with spectroscopy and DFT. The compounds exhibit significant optical nonlinear properties, including optical limiting, making them promising for optical applications.
Area of Science:
- Materials Science
- Organic Chemistry
- Nonlinear Optics
Background:
- Sulfamerazine is a sulfonamide antibiotic with potential for chemical modification.
- Azo compounds are known for their diverse optical and electronic properties.
- Investigating optical nonlinearities is crucial for developing advanced optical materials.
Purpose of the Study:
- To synthesize and characterize novel azo compounds derived from sulfamerazine.
- To investigate the optical nonlinear (ONL) properties of these synthesized azo compounds.
- To evaluate their potential for applications in optical limiting.
Main Methods:
- Diazonium reaction of sulfamerazine followed by structural confirmation using mass spectrometry, infrared spectroscopy, and NMR.
- Density Functional Theory (DFT) and DT-DFT calculations for sample geometry.
- Z-scan technique combined with diffraction patterns and optical limiting measurements using a 532 nm laser.
Main Results:
- Successful synthesis and structural elucidation of novel azo compounds.
- Quantification of optical nonlinear properties: nonlinear refractive index (n2) up to 2 × 10⁻⁷ cm²/W and nonlinear absorption coefficient (β) up to 1.24 × 10⁻³ cm/W.
- Demonstration of optical limiting (OL) with a threshold (TH) as low as 15.5 mW.
Conclusions:
- The synthesized sulfamerazine-based azo compounds possess significant optical nonlinearities.
- These materials show promise for applications requiring optical limiting functionalities.
- The study provides a foundation for further development of azo compounds in nonlinear optics.
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