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Three isostructural solvates of a tetrahydrofurochromenone derivative
Author(s) -
Sridhar Balasubramanian,
Nanubolu Jagadeesh Babu,
Ravikumar Krishnan,
Karthik Govindaraju,
Reddy Basi Venkata Subba
Publication year - 2017
Publication title -
acta crystallographica section c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.304
H-Index - 17
ISSN - 2053-2296
DOI - 10.1107/s2053229617005940
Subject(s) - isostructural , derivative (finance) , chemistry , materials science , crystallography , business , crystal structure , finance
Isostructurality is more likely to occur in multicomponent systems. In this context, three closely related solvates were crystallized, namely, benzene (C 27 H 21 BrO 6 ·C 6 H 6 ), toluene (C 27 H 21 BrO 6 ·C 7 H 8 ) and xylene (C 27 H 21 BrO 6 ·C 8 H 10 ) with methyl 3a‐acetyl‐3‐(4‐bromophenyl)‐4‐oxo‐1‐phenyl‐3,3a,4,9b‐tetrahydro‐1 H ‐furo[3,4‐ c ]chromene‐1‐carboxylate, and their crystal structures determined. All three structures belong to the same space group ( P ) and display similar unit‐cell dimensions and conformations, as well as isostructural crystal packings. The isostructurality is confirmed by unit‐cell and isostructural similarity indices. In each solvate, weak C—H…O and C—H…π interactions extend the molecules into two‐dimensional networks, which are further linked by C—H…Br and Br…Br interactions into three‐dimensional networks. The conformation of the core molecule is predominantly responsible for governing the isostructurality.