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Computational insight into the halogen bonded self-assembly of hexa-coordinated metalloporphyrins
| Content Provider | Scilit |
|---|---|
| Author | Rani, Jyoti Grover, Vratta Dhamija, Swati Titi, Hatem M. Patra, Ranjan |
| Copyright Year | 2020 |
| Description | We demonstrate herein a computational study probing the influence of metalloporphyrin ring current directionality on intermolecular halogen bonding (XB) during supramolecular self-assembly. The results demonstrate that porphyrin ring current can activate or deactivate halogen bonding interactions, an essential superamolecular driving force. |
| Related Links | https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/60c7478f337d6c5382e2738f/original/computational-insight-into-the-halogen-bonded-self-assembly-of-hexa-coordinated-metalloporphyrins.pdf |
| DOI | 10.26434/chemrxiv.8866397 |
| Language | English |
| Publisher | American Chemical Society (ACS) |
| Publisher Date | 2020-01-20 |
| Access Restriction | Open |
| Subject Keyword | Halogen Bonding |
| Content Type | Text |