0000000001321000

AUTHOR

Eric Clot

showing 2 related works from this author

Supramolecular Chirogenesis in Bis-Porphyrin: Crystallographic Structure and CD Spectra for a Complex with a Chiral Guanidine Derivative

2021

The complexation of (3aR,7aR)-N-(3,5-bis(trifluoromethyl)phenyl)octahydro-2H-benzo[d]imidazol-2-imine (BTI), as a guest, to ethane-bridged bis(zinc octaethylporphyrin), bis(ZnOEP), as a host, has been studied by means of ultraviolet-visible (UV-Vis) and circular dichroism (CD) absorption spectroscopies, single crystal X-ray diffraction, and computational simulation. The formation of 1:2 host-guest complex was established by X-ray diffraction and UV-Vis titration studies. Two guest BTI molecules are located at the opposite sides of two porphyrin subunits of bis(ZnOEP) host, which is resting in the anti-conformation. The complexation of BTI molecules proceed via coordination of the imine nitr…

Circular dichroismPhysics and Astronomy (miscellaneous)General MathematicsImineSupramolecular chemistrychiralityCrystal structurehost-guest binding010402 general chemistryguanidine01 natural sciencesDFTsupramolecular chemistrykemialliset sidoksetchemistry.chemical_compoundsupramolekulaarinen kemiaComputer Science (miscellaneous)Molecule[CHIM]Chemical SciencesGuanidine010405 organic chemistrylcsh:Mathematicstiheysfunktionaaliteoriahost–guest bindinglcsh:QA1-939Porphyrin0104 chemical sciencescircular dichroismCrystallographyTD-DFT simulationchemistryChemistry (miscellaneous)Chirality (chemistry)porphyrin
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CCDC 2051302: Experimental Crystal Structure Determination

2021

Related Article: Irina Osadchuk, Nele Konrad, Khai-Nghi Truong, Kari Rissanen, Eric Clot, Riina Aav, Dzmitry Kananovich, Victor Borovkov|2021|Symmetry|13|275|doi:10.3390/sym13020275

Space GroupCrystallography{mu-237812131718-octaethyl-5-[2-(237812131718-octaethylporphyrin-5-yl)ethyl]porphyrinato}-bis{N-[35-bis(trifluoromethyl)phenyl]octahydro-2H-benzimidazol-2-imine}-di-zinc(ii)Crystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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