[PDF] Top 20 Crystal structure and Hirshfeld surface analysis of the new cyclodiphosphazane [EtNP(S)NMe2]2
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Crystal structure and Hirshfeld surface analysis of the new cyclodiphosphazane [EtNP(S)NMe2]2
... the crystal, the molecule sits on an inversion centre such that the P and N atoms form a centrosymmetric cyclic P 2 N 2 ...The crystal packing ... See full document
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Crystal Structure and Hirshfeld Surface Analysis of (E) 1 (2,3 Dichlorobenzylidene) 2 Phenylhydrazine
... The crystal structure of the title compound was determined and analyzed by single crystal X-ray diffraction ...and crystal structure of the title compound is stabilized by the van der ... See full document
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S Benzyl 3 [1 (6 methylpyridin 2 yl)ethylidene]dithiocarbazate: crystal structure and Hirshfeld surface analysis
... the crystal structure and Hirshfeld surface analysis of a potentially tridentate Schiff base derived from the condensation of S-benzyldithiocarbazate with ... See full document
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Crystal structure and Hirshfeld surface analysis of 3,6 bis(pyrimidin 2 yl) 1,4 dihydro 1,2,4,5 tetrazine dihydrate
... the crystal, N—H O, N—H N, O—H O hydrogen bonds and aromatic – stacking interactions link the components into a three-dimensional supramolecular ...network. Hirshfeld surface analysis was used ... See full document
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Crystal structure and Hirshfeld surface analysis of new polymorph of racemic 2 phenylbutyramide
... in structure to the original form I (Wheatley, 1964) and was widely discussed (Bond et ...diffraction analysis and crystal structure prediction algorithms (Shtukenberg et ...three ... See full document
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Crystal structure and Hirshfeld surface analysis of a copper(II) complex with ethylenediamine and non coordinated benzoate
... of new transition- metal complexes because they can stabilize them and addi- tionally display different coordination modes such as mono- dendate, bidendate, bridging (syn–syn, syn–anti or anti–anti mode) and ... See full document
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Crystal structure and Hirshfeld surface analysis of pulcherrin J
... The crystal structure of pulcherrin J shows it to be composed of a central core of three trans-fused cyclohexane rings and a near planar five-membered furan ring, along with an axially oriented cinnamate ... See full document
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Crystal structure and Hirshfeld surface analysis of 2 (1H indol 3 yl)ethanaminium acetate hemihydrate
... namely 2-(1H-indol-3-yl)ethanaminium acetate hemihydrate, was synthesized and its crystal structure and Hirshfeld surface analysis are reported ... See full document
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Crystal structure and Hirshfeld surface analysis of N,N′ bis(3 tert butyl 2 hydroxy 5 methylbenzylidene)ethane 1,2 diamine
... Geometry . All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, ... See full document
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Bis[S benzyl 3 (furan 2 ylmethylidene)dithiocarbazato κ2N3,S]copper(II): crystal structure and Hirshfeld surface analysis
... from S-benzyldithiocarbazate and 2-hy- droxy-5-(phenyldiazenyl)benzaldehyde against a human cervical cancer line (HeLa) (Kongot et ...single crystal X-ray diffraction analysis and a detailed ... See full document
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Crystal structure and Hirshfeld surface analysis of N [(2 hydroxynaphthalen 1 yl)(3 methylphenyl)methyl]acetamide
... Geometry . All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, ... See full document
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fac Acetonitriletricarbonyl(dimethylcarbamodithioato κ2S,S′)rhenium(I): crystal structure and Hirshfeld surface analysis
... long attracted the attention of coordination chemists owing to their high affinity for heavy-atom centres drawn from trans- ition metals, main group elements as well as lanthanides and actinides. The motivation for their ... See full document
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Crystal structure and Hirshfeld surface analysis of 4 allyl 2 methoxy 6 nitrophenol
... an S(6) motif. The crystal cohesion is ensured by intermolecular C—H O hydrogen bonds in addition to – stacking interactions between the aromatic rings [centroid–centroid distances = ...The Hirshfeld ... See full document
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Crystal structure and Hirshfeld surface analysis of N,N′ bis(2 nitrophenyl)glutaramide
... Then 2- nitroaniline ...with 2 N HCl, then with water, collected by filtration, dried and recrystallized from dimethyl formamide (melting point: 503– 504 ... See full document
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Crystal structure and Hirshfeld surface analysis of (benzenecarbothioamide κS)bromidobis(triphenylphosphane κP)silver(I)
... one S atom of a benzenecarbothioamide ligand, two P atoms of two triphenylphosphane molecules and one bromide ...the crystal structure, inversion dimers linked by pairs of N—H Br and C—H Br hydrogen ... See full document
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Crystal structure and Hirshfeld surface analysis of (succinato κO)[N,N,N′,N′ tetrakis(2 hydroxyethyl)ethylenediamine κ5O,N,N′,O′,O′′]nickel(II) tetrahydrate
... Geometry . All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, ... See full document
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Crystal structure and Hirshfeld surface analysis of 2 aminopyridinium hydrogen phthalate
... solve structure: SHELXT2014 (Sheldrick, 2015a); program(s) used to refine structure: SHELXL2014 (Sheldrick, 2015b); molecular graphics: Mercury (Macrae et ... See full document
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N [2 (Trifluoromethyl)phenyl]maleamic acid: crystal structure and Hirshfeld surface analysis
... N-(2-aminophenyl)maleamic acid (Santos-Sa´nchez et al., 2007). Compound (I) differs from related structures in the conformation of its carboxylic acid group. In (I), the –COOH group adopts syn conformation (i.e. ... See full document
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Hirshfeld surface analysis and crystal structure of N (2 methoxyphenyl)acetamide
... reaction of (4-{2-benzyloxy-5-[(E)-(3-chloro-4-methylphenyl)diazenyl]benzyl- idene}-2-phenyloxazol-5(4H)-one) with 2-methoxyaniline in the presence of acetic acid as solvent. The amide group is not ... See full document
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Crystal structure and Hirshfeld surface analysis of 2 amino 4 methoxy 6 methylpyrimidinium 2 hydroxybenzoate
... The title compound was synthesized by mixing hot methanolic solutions (20 ml) of 2-amino-4-methoxy-6-methylpyrimidine (0.139 mg) and 2-hydroxybenzoic acid (0.156 mg) in a 1:1 molar ratio. The mixed ... See full document
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