Novel Br⋅⋅⋅π(Chelate) Interaction in a 1D Coordination Polymer Revealing Aromaticity | Zendy

Dutta Basudeb | Zendy; Pratik Saied Md | Zendy; Jana Srikanta | Zendy; Sinha Chittaranjan | Zendy; Datta Ayan | Zendy; Mir Mohammad Hedayetullah | Zendy

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Novel Br⋅⋅⋅π(Chelate) Interaction in a 1D Coordination Polymer Revealing Aromaticity

Author(s) -

Dutta Basudeb,

Pratik Saied Md,

Jana Srikanta,

Sinha Chittaranjan,

Datta Ayan,

Mir Mohammad Hedayetullah

Publication year - 2018

Publication title -

chemistryselect

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.437

H-Index - 34

ISSN - 2365-6549

DOI - 10.1002/slct.201800738

Subject(s) - aromaticity , ring (chemistry) , chelation , ligand (biochemistry) , chemistry , crystallography , polymer , metal , pi interaction , molecule , inorganic chemistry , organic chemistry , receptor , biochemistry

A one‐dimensional coordination polymer (1D CP) [Cu(nip)(4‐brpy) 2 ] (1) containing 16‐member metal‐ligand chelate ring exhibits unprecedented Br⋅⋅⋅π(chelate) interaction. The nucleus‐independent chemical shifts (NICS) calculation reveals that the chelate ring has aromaticity and strong interaction energy (‐24.8 kcal/mol) which plays important role in molecular self‐assembly in the crystal structure.

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