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Authors
R., Saswathy
Ali, Mohamad Akbar
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Funding
Funding for this research was provided by:
Khalifa University of Science, Technology and Research (Faculty Startup Grant # 8474000461)
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Article History
Received: 5 March 2025
Accepted: 31 July 2025
First Online: 7 August 2025
Declarations
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: The authors declare no competing interests.
: The supporting information contains the cartesian coordinates of all the optimized geometries and their vibrational modes; this includes information regarding the HMB@[6]host and comparison with other studies. The thermodynamic properties, ESP analysis findings, and λmax are tabulated. Additionally, the geometrical parameters of the hosts and the complexes are tabulated for clarity. The SI also includes images of complexes’ reduced density gradients, their band gaps in eV, and their UV spectrum.
