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4-{4-[(E)-(2-Hydroxyhenyl)iminomethyl]phenoxy}Benzene-1,2-Dicarbonitrile
(2012)
The asymmetric unit of the title compound, C21H13N3O2, contains two independent molecules with a similar structure. In one molecule, the central benzene ring is oriented with respect to the terminal benzene rings at ...
4-[2-(2,2-Dimethyl-4,6-Dioxo-1,3-Dioxan-5-YlIdene)Hydrazin-1-Yl]Benzonitrile
(2010)
In the title compound, C13H11N3O4, the dioxane ring adopts an envelope conformation with the C atom bonded to the dimethyl group in the flap position [deviation = 0.613 (1) Å]. The nitrile group and the attached benzene ...
4-{[4-(Dimethylamino)Benzyildene]amino}Benzenesulfonamide
(2014)
The title Schiff base compound, C15H17N3O2S, is non-planar with a dihedral angle of 69.88 (4)° between the planes of the benzene rings. In the crystal, pairs of N—H⋯N hydrogen bonds, between the sulfonamide nitrogen-H ...
4-Methyl-N-(4-MethylPhenylSulfonYl)-N-PhenylBenzeneSulfonamide
(2014)
The whole molecule of the title compound, C20H19NO4S2, is generated by twofold rotational symmetry. The N atom is located on the twofold rotation axis and has a trigonal-planar geometry. It is bonded by two S atoms of two ...
5-(3,6-Dibromo-9H-carbazol-9-yl)pentanenitrile
(2011)
In the title compound, C17H14Br2N2, the carbazole skeleton is nearly planar [maximum deviation = 0.055 (2) Å]. In the crystal, aromatic π–π stacking is observed between parallel carbazole ring systems of adjacent molecules, ...
4-(Furan-2-YlmethOxy)Benzene-1,2-Dicarbonitrile
(2012)
In the title compound, C13H8N2O2, prepared from furfuryl alcohol and 4-nitrophthalonitrile in the presence of potassium carbonate in dimethylformamide, the furan and benzene rings are oriented at a dihedral angle of ...
Crystal Structure and Hirshfeld Surface Analysis of AquaBis(Nicotinamide-Κn 1)Bis(2,4,6-TriMethylBenzoato-Κ2 O,O′)Cadmium(II)
(2018)
The CdII cation, located on a twofold rotation axis, is coordinated by two 2,4,6-trimethylbenzoate anions, two nicotinamide ligands and a water molecule in a distorted pentagonal–bipyramidal geometry., The asymmetric ...
Crystal Structure And Hirshfeld Surface Analysis Of AquaBis(Nicotinamide-Κn 1)Bis(2,4,6-TriMethylBenzoato-Κo)Zinc
(2017)
In the title Zn complex, the ZnII cation is five-coordinated in a distorted trigonal–bipyramidal geometry. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the ...
Crystal Structure And Hirshfeld Surface Analysis Of 1-[(1-Butyl-1H-1,2,3-Triazol-4-Yl)MethYl]-3-MethylQuinoxalin-2(1H)-One
(2018)
The title compound is built up from a planar quinoxalinone ring system linked through a methylene bridge to a 1,2,3-triazole ring, which is inclined by 67.09 (4)° to the quinoxalinone ring plane., The title compound, ...
Crystal Structure And Hirshfeld Surface Analysis Of (E)-4-{[2-(4-HyDroxyBenzoYl)Hydrazin-1-YlIdene]MethYl}Pyridin-1-Ium Nitrate
(2018)
The title aroyl hydrazone Schiff base salt, consists of one molecular cation in the keto tautomeric form, adopting an E configuration with respect to the azomethine bond, and one nitrate anion., The asymmetric unit of the ...
Crystal Structure And Hirshfeld Surface Analysis Of 1-{[2-Oxo-3-(Prop-1-En-2-Yl)-2,3-DiHydro-1H-1,3-BenzoDiazol-1-Yl]MethYl}-3-(Prop-1-En-2-Yl)-2,3-DiHydro-1H-1,3-BenzoDiazol-2-One
(2018)
In the title compound, the benzodiazolone moieties are planar to within 0.017 (1) and 0.026 (1) Å, and oriented at a dihedral angle of 57.35 (3)°. In the crystal, two sets of intermolecular C—H⋯O hydrogen bonds generate ...
Crystal Structure And Hirshfeld Surface Analysis Of (4Z)-1-Butyl-4-(2-OxoPropylIdene)-2,3,4,5-TetraHydro-1H-1,5-Benzodiazepin-2-One
(2018)
The asymmetric unit of the title compound consists of two independent molecules differing slightly in the conformations of the seven-membered rings and the butyl substituents., The asymmetric unit of the title compound, ...
Crystal Structure And Hirshfeld Surface Analysis Of AquaBis(Nicotinamide-Κn)Bis(4-Sulfamoylbenzoato-Κo 1)Copper(Ii)
(2018)
The CuII cation, located on a twofold rotation axis, is coordinated by two 4-sulfamoylbenzoate anions, two nicotinamide (NA) molecules and one water molecule in a slightly distorted square-pyramidal geometry., In the ...
Crystal Structure and Hirshfeld Surface Analysis of 5-Methyl-1,2,4-Triazolo[1,5-A]Pyrimidine
(2018)
The nine-membered ring system of the title compound is essentially planar. In the crystal, molecules are linked via C—HTrz⋯NTrz and C—HPyrm⋯NTrz (Trz = triazole and Pyrm = pyrimidine) hydrogen bonds together with weaker ...
Crystal Structure Of 4-({5-[(E)-(3,5-DiFluoroPhenYl)DiazenYl]-2-HyDroxyBenzylIdene}Amino)-2,2,6,6-TetraMethylPiperidin-1-OxYl
(2015)
The asymmetric unit of the title compound contains two crystallographically independent molecules with the similar conformation, the piperidine rings in both molecules adopt a similar distorted chair conformation and ...
Crystal Structure Of 4-(3,4-DiCyanoPhenOxy)-N-[3-(DiMethylAmino)PropYl]Benzamide MonoHydrate: A PhenOxyPhthaloNitrile Derivative
(2015)
In the title compound, the planes of the phenoxy and phthalonitrile rings are oriented at a dihedral angle of 60.39 (5)°. In the crystal, molecules are linked by O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds, forming slabs ...
Crystal Structure Of 6,6,12,12-TetraChloroTriCyclo[8.2.0.04,7]Dodecane-5,11-Dione
(2015)
The asymmetric unit contains two independent molecules, each consisting of an eight-membered ring with two four-membered rings fused on either side., The asymmetric unit of the title compound, C12H12Cl4O2, contains two ...
DiaquaBis(N,N′-DiethylNicotinamide-Κn1)Bis(4-EthylBenzoato-Κo)Copper(Ii)
(2011)
The title CuII complex, [Cu(C9H9O2)2(C10H14N2O)2(H2O)2], contains two 4-ethylbenzoate (PEB) ligands, two monodentate diethylnicotinamide (DENA) ligands and two water molecules. The four O atoms in the equatorial plane ...
DiaquaBis(N,N′-DiethylNicotinamide-Κn1)Bis(4-FluoroBenzoato-Κo)Copper(Ii)
(2011)
The asymmetric unit of the title mononuclear CuII complex, [Cu(C7H4FO2)2(C10H14N2O)2(H2O)2], contains one-half of the molecule. The CuII ion is located on an inversion centre, and is coordinated by two N atoms from two ...
DiaquaBis(4-MethylBenzoato-Κo)Bis(Nicotinamide-Κn 1)Nickel(Ii)
(2010)
The title NiII complex, [Ni(C8H7O2)2(C6H6N2O)2(H2O)2], is centrosymmetric with the Ni atom located on an inversion center. The molecule contains two 4-methylbenzoate (PMB) and two nicotinamide (NA) ligands and two ...