In the crystal structure of the title compound, C13H10ClNO3S, the conformation of the of the N—H bond in the C—SO2—NH—C(O) segment is anti to the C=O bond. The dihedral angle between the two benzene rings is 73.3 (1)°. In the crystal, inversion dimers linked by pairs of N—H⋯O hydrogen bonds occur.
In the crystal structure of the title compound, C13H10ClNO3S, the conformation of the N—H bond in the C—SO2—NH—C(O) segment is anti to the C=O bond. The dihedral angle between the two aromatic rings is 68.6 (1)°. The molecule is twisted at the S atom with a dihedral angle of 75.7 (1)° between the sulfonyl benzene ring and the —SO2—NH—C—O segment; the dihedral angle between the latter and the benzoyl ring is 8.3 (2)°. In the crystal, molecules are linked by N—H⋯O(S) hydrogen bonds.
A novel pillared-bilayer gadolinium-organic framework, {[Gd 2 (dhbdc)(dhbdcH 2 )(H 2 O) 5 ] 3 2H 2 O)} n (1), (dhbdcH 4 = 2.5-dihydroxyterephthalic acid), has been synthesized using hydrothermal technique and structurally characterized. 2D pillaredbilayer networks are interdigitated and H-bonded, forming a 3D supramolecular framework with two different channels along the c-axis. Framework exhibits stepwise release of the guest and coordinated water molecules and reversible single-crystal-to-single-crystal structural transformation upon removal and reintroduction of the guest water molecules. Partially dehydrated frameworks, {[Gd 2 (dhbdc)(dhbdcH 2 )(H 2 O) 5 ]} n (1 0 ) and {[Gd 2 (dhbdc)(dhbdcH 2 )(H 2 O) 4 ]} n (1 00 ) show different sorption capacity of N 2 realized by structural contraction in 1 00 . Framework 1 00 reveals strong hydrophilic character compare to 1 0 and both the frameworks 1 0 and 1 00 do not uptake other organic vapors like MeOH, CH 3 CN, and EtOH, suggesting size dependence in sorption properties.
The asymmetric unit of the title compound, C15H15NO3S, contains two independent molecules. The conformations of the N—C bonds in the C—SO2—NH—C(O) segments have gauche torsions with respect to the SO bonds. Further, the molecules are twisted at the S atoms with torsion angles of −53.1 (2) and 61.2 (2)° in the two molecules. The dihedral angles between the sulfonyl benzene rings and the —SO2—NH—C—O segments are 86.0 (1) and 87.9 (1)°. Furthermore, the dihedral angles between the sulfonyl and the benzoyl benzene rings are 88.1 (1) and 83.5 (1)° in the two molecules. In the crystal, molecules are linked by N—H⋯O(S) hydrogen bonds.
Key indicators: single-crystal X-ray study; T = 296 K; mean (C-C) = 0.006 Å; disorder in main residue; R factor = 0.104; wR factor = 0.316; data-to-parameter ratio = 12.2.The title compound, C 31 H 27 F 3 O 7 , is a liquid crystal and exhibits enantiotropic SmA and nematic phase transitions. In the crystal, the the 2H-chromene ring system makes dihedral angles of 54.46 (17) and 7.79 (16) , respectively, with the central benzene ring and 4-(heptyloxy)benzene ring. The three F atoms of the -CF 3 group are disordered over two sets of sites, with an occupancy ratio of 0.62 (3):0.38 (3). The crystal structre features two pairs of C-HÁ Á ÁO hydrogen bonds, which form inversion dimers and generate R 2 2 (10) and R 2 2 (30) ring patterns. C-HÁ Á ÁO interactions along [100] and C-HÁ Á Á interactions futher consolidate the packing, leading to a three-dimensional network.
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