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SYNTHESIS, CRYSTAL STRUCTURE, AND DFT STUDY OF 1-(2-BROMOBENZYL)-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (6)

1-(2-Bromobenzyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is an organic intermediate with both pyrazole heterocycle and borate fun......

SYNTHESIS, X-RAY CRYSTAL STRUCTURES, AND ANTIBACTERIAL ACTIVITY OF ZINC(II) AND COPPER(II) COMPLEXES DERIVED FROM N,N '-BIS(5-METHYLSALICYLIDENE)-1,3-PROPANEDIAMINE

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

New phenolate and azide bridged tetranuclear zinc(II) complex [Zn4Br2L2(mu(1,1)-N-3)(2)] (1) and new mononuclear copper(II) complex [CuL] (2), where L......

SYNTHESIS, CHARACTERIZATION, CRYSTAL STRUCTURE, AND DFT STUDY OF 3-BROMO-N- (3-FLUOROPHENYL)BENZENESULFONAMIDE

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

Sulfonamides are used as antibacterial drugs for decades. 3-bromo-N-(3-fluorophenyl) benzenesulfonamide is synthesized by the amidation reaction. The ......

ASYMMETRIC MONO(IMINE)PYRROLE NICKEL PMMA CATALYSTS: SYNTHESIS, CRYSTAL STRUCTURE, AND DFT CALCULATION

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

A series of asymmetric mono(imine)pyrroles (L1-L5) is synthesized using 2-acetylpyrrole and a series of dimethylanilines which have two methyl groups ......

A 3D SUPRAMOLECULAR POLYMER INVOLVING HYDROGEN BONDS BASED ON NICKEL(II), 1,3-BENZENEDICARBOXYLIC ACID, AND A NITROGEN-CONTAINING LIGAND

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

The [Ni(1,3-bdc)(L)(H2O)(2)](n)center dot 2nH(2)O (1) coordination polymer (1,3-H(2)bdc = 1,3-benzenedicarboxylic acid, L = 4,4 '-N,N '-bis(3-pyridylf......

INSIGHT INTO FLUORESCENT PROPERTIES, DFT AND HIRSHFELD ANALYSES OF A NEWLY SYNTHESIZED AND STRUCTURALLY NOVEL TRINUCLEAR COPPER(II) SALAMO-BASED COMPLEX INVOLVING PHENOXO-O BRIDGED COORDINATION

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (3)

A novel trinuclear Cu(II) (Cu2+:(L)(3-) = 3:2) complex derived from a newly designed pentadentate salamo-based ligand (H3L), namely [Cu-3(L)(2)(CH3OH)......

TWO MIXED-LIGAND Cu(II) COORDINATION POLYMERS: PROTECTIVE EFFECT ON SEPSIS BY REDUCING AN EXCESSIVE INFLAMMATORY RESPONSE

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (5)

By the reaction of a rigid pi-conjugated H4L linker (5,5 '-(1,3,6,8-tetraoxobenzo[lmn][3],[8]phenanthroline-2-7-diyl)bis-1,3-benzenedicarboxylic acid)......

A NOVEL TETRANUCLEAR NICKEL(II) SALAMO-BASED COMPLEX ADOPTING TWO OPEN CUBIC STRUCTURES: SYNTHESIS, CHRACTERIZATION, DFT CALCULATION, HIRSHFELD ANALYSIS, AND FLUORESCENT PROPERTIES

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (6)

A novel tetranuclear Ni(II) complex [Ni-4(L)(2)(N-3)(4)Cl(MeOH)(3)]center dot CH3COCH3 is synthesized via a symmetrical salamo-based ligand H2L, NiCl2......

SYNTHESIS, CRYSTAL STRUCTURE, AND BIOLOGICAL ACTIVITY OF NOVEL CURCUMIN ANALOGUES DERIVED FROM CINNAMALDEHYDE

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

A series of novel trienone curcumin analogues 1, based on Claisen-Schmidt condensations of cinnamaldehyde, arylaldehyde, and acetone, is prepared and ......

CONSTRUCTION OF A COBALT COORDINATION POLYMER BASED ON A LINEAR LIGAND WITH FLEXIBLE BRANCHED CHAINS

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (6)

A cobalt coordination polymer based on a linear ligand with flexible branched chains 4,4 '-(2,5-dibutoxy-1,4-phenylene)dipyridine (BPDP), namely, {[Co......

THEORETICAL STUDY OF THE STRUCTURES AND ELECTRONIC CHARACTERISTICS OF InxO (x=2, 3) AND In4O0/-1

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

The clusters InxO (x = 2, 3) and In4O0/-1 arestudied using density functional theory (B3PW91). The global minima contain linear di-coordinated, T-shap......

A NEW La(III) COMPLEX CONSTRUCTED BY A LONG FLEXIBLE LIGAND: CRYSTAL STRUCTURE, DNA BINDING, AND MOLECULAR DOCKING STUDIES

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (7)

A new lanthanum complex with 2,5-bis((3-carboxylphenyl)amino)terephthalic acid is synthesized by a solvent thermal reaction. The La(III) complex monom......

A FIRST-PRINCIPLES INVESTIGATION OF HETEROSTRUCTURES CONSISTING OF HALIDE PEROVSKITE CsPbI3 AND LEAD CHALCOGENIDE FOR OPTOELECTRONIC APPLICATIONS

期刊: JOURNAL OF STRUCTURAL CHEMISTRY, 2021; 62 (5)

The heterostructure consisting of lead chalcogenide and halide perovskite materials are recently identified as excellent candidates for optoelectronic......

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