Crystal structure of 5,15-bis(4-methylphenyl)-10,20-bis(4-nitrophenyl)porphyrin nitrobenzene disolvate

The whole molecule of the title porphyrin, C46H32N6O4·2C6H5NO2, which crystallized as a nitrobenzene disolvate, is generated by inversion symmetry. The porphyrin macrocycle is almost planar, the maximum deviation from the mean plane of the non-hydrogen atoms is 0.097 (2) Å. The aryl rings at the mes...

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Bibliographic Details
Main Authors: Bakhytzhan Baptayev, Salimgerey Adilov
Format: Article
Language:English
Published: International Union of Crystallography 2018-01-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989017017868
Description
Summary:The whole molecule of the title porphyrin, C46H32N6O4·2C6H5NO2, which crystallized as a nitrobenzene disolvate, is generated by inversion symmetry. The porphyrin macrocycle is almost planar, the maximum deviation from the mean plane of the non-hydrogen atoms is 0.097 (2) Å. The aryl rings at the meso positions are inclined to this mean plane by 74.84 (6)° for the nitrophenyl rings and 73.37 (7)° for the tolyl rings. In the crystal, the porphyrin molecules are linked by C—H...O hydrogen bonds, forming chains along [100]. The solvent molecules are also linked by C—H...O hydrogen bonds, forming chains along [100]. Interdigitation of the p-tolyl groups along the c axis creates rectangular channels in which the solvent molecules are located.
ISSN:2056-9890