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Synthesis, crystal structure, spectroscopic features and Hirshfeld surfaces of 2-methyl-3-[(2-methylphenyl)carbamoyl]phenyl acetate
(Int Union Crystallography, 2019)
The title compound, C17H17NO3, was synthesized, characterized by IR spectroscopy and its crystal structure was determined from single-crystal diffraction data. The asymmetric unit contains two molecules, which adopt different ...
Crystal structure and Hirshfeld surface analysis of 2,2 '{(1 E,1 ' E)-[ethane-1,2-diyibis(azanylyunene)]-bis(methanylylidene)}bis[4-(traluorometnoxy)-phenol]copper(II) hydroquinone hermsoiyate
(Int Union Crystallography, 2019)
In the title complex, [Cu(C18H12F6N2O4)]center dot 0.5C(6)H(6)O(2), the Cu-II ion has a square-planar coordination geometry, being ligated by two N and two O atoms of the tetradentate open-chain Schiff base ligand ...
Crystal structure of 2,3-dimethoxy-N-(4-nitrophenyl)benzamide
(Int Union Crystallography, 2018)
In the title compound, C15H14N2O5, the benzene rings are nearly coplanar, making a dihedral angle of 4.89 (8)degrees. An intramolecular N-H center dot center dot center dot O hydrogen bond occurs between the imino and ...
Crystal structure and Hirshfeld surface analysis of (E)-N-[(2-ethoxynaphthalen-1-yl)methylidene]-5,6,7,8-tetrahydronapntnalen-1-amine
(Int Union Crystallography, 2018)
In the title Schiff base compound, C23H23NO, the two ring systems are twisted by 51.40 (11)degrees relative to each other. In the crystal, the molecules are connected by weak C-H center dot center dot center dot pi ...
Crystal structure and Hirshfeld surface analysis of a copper(II) complex with ethylenediamine and non-coordinated benzoate
(Int Union Crystallography, 2020)
In the title compound, diaquabis(ethylenediamine-kappa N-2,N')copper(II) bis(2-nitrobenzoate), [Cu(C2H8N2)(2)(H2O)(2)](C7H4NO4)(2), two diaquabis(ethylenediamine)copper(II) cations and four nitrobenzoate anions are present ...
Crystal structure and Hirshfeld surface analysis and of 2-ammoniumylmethyl-1H-benzimidazol-3-ium chloride mononydrate
(Int Union Crystallography, 2018)
The asymmetric unit of the title compound, C8H11N32+ center dot 2Cl(- )center dot H2O, contains three organic cations, six chloride anions and three water molecules of crystallization, which are connected by extensive ...
Crystal structure and Hirshfeld surface analysis of (E)-2,4-di-tert-butyl-6-[(3-chloro-4-methylpnenyl-imino)methyl] phenol
(Int Union Crystallography, 2018)
The title Schiff base compound, C22H28ClNO, shows mirror symmetry with all its non-H atoms, except the tert-butyl groups, located on the mirror plane. There is an intramolecular O-H center dot center dot center dot N ...
Structural features of 7-methoxy-5-methy1-2-(pyridin-3-y1)-11,12-dihydro-5,11-methano[1,2,4]triazolo[1,5-c][1,3,5]benzoxadiazocine: Experimental and theoretical (HF and DFT) studies, surface properties (MEP, Hirshfeld)
(Elsevier Science Bv, 2018)
The molecular structure of 7-methoxy-5-methyl-2-(pyridin-3-yl)-11,12-dihydro-5,11-methano[1,2,4]triazolo[1,5-c][1,3,5]benzoxadiazocine that formulated as (C18H17N5O2) was determined by single-crystal X- ray diffraction and ...
Synthesis, crystallographic structure, DFT calculations and Hirshfeld surface analysis of a fumarate bridged Co(II) coordination polymer
(Elsevier Science Bv, 2018)
A 1-D coordination polymer catena [mu-fumaratobis (nicotinamide-kappa N)diaquacobalt (II)], (C16H18CoN4O8)(n), [Co(fum) (nia)(2)(H2O)(2)] or [CO(mu-C4H2O4) (C6H6N2O)(2)H2O)(2)](n) was synthesized and structurally characterized. ...
Synthesis, crystallographic structure, theoretical calculations, spectral and thermal properties of trans-diaquabis(trans-4-aminoantipyrine) cobalt(II) acesulfamate
(Elsevier Science Bv, 2019)
A new acesulfame derivative compound, trans-diaquabis(trans-4-aminoantipyrine)cobalt(II) acesulfamate that formulated as (C30H38CoN8O12S2) was synthesized and characterized by X-ray diffraction method, FT-IR, UV-Vis ...
