Synthesis and crystal structure of 5,17-diamino-11- <i>tert</i> -butyl-25,26,27,28-tetrapropoxy-23-[(triphenylmethyl)amino]calix[4]arene dichloromethane monosolvate

The title compound crystallizes as a di-chloro-methane monosolvate, C<sub>63</sub>H<sub>73</sub>N<sub>3</sub>O<sub>4</sub>·CH<sub>2</sub>Cl<sub>2</sub>. The main mol-ecule represents a calix[4]arene and possesses a pinched cone shape, with the two distal <i>para</i>-amino groups at the wide rim of the macrocycle being brought into close proximity due to steric repulsion between the bulky trityl-amino and <i>tert</i>-butyl groups attached to the other two distal positions of the wide rim. In the crystal, the calixarene mol-ecules are assembled by numerous C-H⋯π and van der Waals inter-actions, while the solvent mol-ecules reside in the cavities forming C-H⋯π and Cl⋯π contacts with the phenyl rings of the trityl group.

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Publication Details

Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2025-12-04
DOI
https://doi.org/10.1107/s2056989025010886
Primary Topic
Supramolecular Chemistry and Complexes
Type
article
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article

Synthesis and crystal structure of 5,17-diamino-11- tert -butyl-25,26,27,28-tetrapropoxy-23-[(triphenylmethyl)amino]calix[4]arene dichloromethane monosolvate

Acta Crystallographica Section E Crystallographic Communications
Supramolecular Chemistry and Complexes
article

Synthesis and crystal structure of 5,17-diamino-11- tert -butyl-25,26,27,28-tetrapropoxy-23-[(triphenylmethyl)amino]calix[4]arene dichloromethane monosolvate

article en

Abstract

The title compound crystallizes as a di-chloro-methane monosolvate, C<sub>63</sub>H<sub>73</sub>N<sub>3</sub>O<sub>4</sub>·CH<sub>2</sub>Cl<sub>2</sub>. The main mol-ecule represents a calix[4]arene and possesses a pinched cone shape, with the two distal <i>para</i>-amino groups at the wide rim of the macrocycle being brought into close proximity due to steric repulsion between the bulky trityl-amino and <i>tert</i>-butyl groups attached to the other two distal positions of the wide rim. In the crystal, the calixarene mol-ecules are assembled by numerous C-H⋯π and van der Waals inter-actions, while the solvent mol-ecules reside in the cavities forming C-H⋯π and Cl⋯π contacts with the phenyl rings of the trityl group.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 82(1)
Lomonosov Moscow State University (RU), NS Kurnakova Institute of General and Inorganic Chemistry (RU)
Openalex Percentile: Top 43%
Supramolecular Chemistry and Complexes
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Synthesis and crystal structure of 5,17-diamino-11- <i>tert</i> -butyl-25,26,27,28-tetrapropoxy-23-[(triphenylmethyl)amino]calix[4]arene dichloromethane monosolvate · Acta Crystallographica Section E Crystallographic Communications (2025) | TGRS Research Map | TGRS