Publications by authors named "D Halder"

-(tetra-aryl) picket calix[4]pyrrole 1 featuring -fluorophenyl groups at all four -positions in a -configuration has been synthesized and characterized unambiguously using single-crystal X-ray diffraction analysis. This pre-organized system possesses a deep binding pocket created by the four aryl groups so that anions can be accommodated through anion-π interactions and four-point N-H⋯anion hydrogen bonds. Single-crystal X-ray diffraction analysis of the CsF and TEAF (TEA = tetraethylammonium) complexes of receptor 1 unequivocally confirms the formation of 1 : 1 complexes, revealing the binding modes in the solid state.

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Article Synopsis
  • Boron neutron capture therapy is a promising cancer treatment that relies on non-toxic drugs with high boron content, with a focus on the metallacarborane cobaltabis(dicarbollide) ([COSAN]).
  • The interaction between [COSAN] and DNA, the target for biological damage, is not well understood, with conflicting results in existing research.
  • This study clarifies the strength, mechanism, and time scale of the DNA/[COSAN] interaction through advanced simulations, revealing that the interaction significantly varies with the ionic strength of the medium, with weak binding observed primarily under high NaCl concentration conditions.
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Synthetic textile dye malachite green (MG) and heavy metals present in industrial wastewater are hazardous to the ecosystem. Bioremediation of dyes and heavy metals using dry-biomasses has advantages over chemical methods. This study screened an acclimatized, heavy metal-resistant, and dye-degrading Gram positive Bacillus licheniformis AG3 strain from the textile wastewater near Kolkata, West Bengal.

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The first example of N-confused strapped calix[4]pyrrole 5 is presented. The structural integrity of 5 and its regular isomer 4 was unambiguously confirmed by single crystal X-ray diffraction analysis. Anion binding studies using H NMR titration carried out in CDCl revealed a small but detectable tendency of 5 to interact with an anion.

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We investigate Dy-based coordination polymer CHDyNO (Dy-CP) exhibiting single-ion magnet (SIM) properties, , quantum tunnelling of magnetization (QTM), magnetic anisotropy, magnetic relaxation, and effective energy barrier (). To elucidate the underlying mechanisms, crystal field parameters (CFPs) for Dy ions were modelled using the radial effective charge model (RECM) and superposition model (SPM), and the computational packages SIMPRE and SPECTRE. The modelled CFPs enable the prediction of the energy levels and associated wave functions, which successfully explain the field-induced Dy-CP SIM properties.

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