[PDF] Top 20 Crystal structure and Hirshfeld surface analysis of (2E) 3 (3 chlorophenyl) 1 (3,4 dimethoxyphenyl)prop 2 en 1 one
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Crystal structure and Hirshfeld surface analysis of (2E) 3 (3 chlorophenyl) 1 (3,4 dimethoxyphenyl)prop 2 en 1 one
... The overall two-dimensional fingerprint plot for the title compound and those delineated into H H, C H/H C, H O/O H, Cl H/H Cl and Cl C/C Cl contacts are illustrated in Fig. 5; the percentage contributions from the ... See full document
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Crystal structure and Hirshfeld surface analysis of (2E) 3 (4 chloro 3 fluorophenyl) 1 (3,4 dimethoxyphenyl)prop 2 en 1 one
... 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 (2E) 3 (3 bromo 4 fluorophenyl) 1 (3,4 dimethoxyphenyl)prop 2 en 1 one
... overall crystal packing, which is reflected as widely scattered points of high density due to the large hydrogen content of the ...the crystal, shown as a pair of characteristic wings the fingerprint plot, ... See full document
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(2E) 3 (2 Chloro 7 methylquinolin 3 yl) 1 (6 chloro 2 methyl 4 phenylquinolin 3 yl)prop 2 en 1 one ethanol monosolvate
... of 3-acetyl-6-chloro-2-methyl-4-phenylquinoline (300 mg, ...and 2-chloro-7-methylquinoline-3- carbaldehyde (200 mg, ... See full document
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(2E) 3 (2 Chlorobenzo[h]quinolin 3 yl) 1 (2 methyl 4 phenylquinolin 3 yl)prop 2 en 1 one
... solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: ORTEP-3 for Windows (Farrugia, 2012) and DIAMOND (Bran- denburg, ... See full document
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(2E) 3 [4 (Benzyloxy)phenyl] 1 (pyridin 3 yl)prop 2 en 1 one
... The crystal structures of some chalcones derived from acetyl pyridine ...2005), ... See full document
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(E) 1 (Anthracen 9 yl) 3 (2 chloro 6 fluorophenyl)prop 2 en 1 one: crystal structure and Hirshfeld surface analysis
... print plot. The presence of – interactions is shown as C C contacts, which contribute 8.9% of the Hirshfeld surfaces. The presence of these interactions can also be shown by the Hirshfeld surfaces mapped by ... See full document
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Crystal structure of (2E) 3 [4 (dimethylamino)phenyl] 1 (thiophen 2 yl)prop 2 en 1 one
... supramolecular analysis between the neuraminidase enzyme, whose inhibition is believed to be a key point to block the influenza viral infection (Kinger et ...mol 1 , gradient normal = ... See full document
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(2E) 3 (6 Chloro 2 methoxyquinolin 3 yl) 1 (2 methyl 4 phenylquinolin 3 yl)prop 2 en 1 one acetone monosolvate
... Geometry . All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell s.u.'s are taken into account individually in the estimation of s.u.'s in ... See full document
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Crystal structure and Hirshfeld surface analysis of (2E) 3 (2,4 dichlorophenyl) 1 (2,5 dichlorothiophen 3 yl)prop 2 en 1 one
... (2E)- 1-(5-chlorothiophen-2-yl)-3-(4-ethylphenyl)prop-2-en-1-one [(I); Naik et ...ethylphenyl)prop- ... See full document
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Crystal structure and Hirshfeld surface analysis of (E) 3 (3 iodophenyl) 1 (4 iodophenyl)prop 2 en 1 one
... 2017). Hirshfeld surfaces [Fig. 4(a) and (c)] highlight the relationship between the contact distance and the van der Waals radii (Venkatesan et ...The Hirshfeld surface mapped over the ... See full document
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Crystal structure of (2E) 1 (1 benzofuran 2 yl) 3 (2 bromophenyl)prop 2 en 1 one monohydrate
... In the title compound, Fig. 1, the benzofuran and bromophenyl groups are linked by a prop-2-en-1-one group. The benzofuran and bromophenyl rings are slightly non-planar with a ... See full document
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Crystal structure of (2E) 1 (4 hydroxy 1 methyl 2 oxo 1,2 dihydroquinolin 3 yl) 3 (4 hydroxy 3 methoxyphenyl)prop 2 en 1 one
... solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: OLEX2 (Dolomanov et ... See full document
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Crystal structure and Hirshfeld surface analysis of (E) 3 (2 chloro 6 fluorophenyl) 1 (3 fluoro 4 methoxyphenyl)prop 2 en 1 one
... Hirshfeld surfaces of 27.5%. The contribution from the O H/H O contacts, corresponding to C—H O inter- actions, is represented by a pair of sharp spikes characteristic of a strong hydrogen-bond interaction having ... See full document
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Crystal structure of (2E) 1 (5 bromothiophen 2 yl) 3 (2 chlorophenyl)prop 2 en 1 one
... A mixture of 2-acetyl-5-bromothiophene (0.01 mol) and 2-chlorobenzaldehyde (0.01 mol) were stirred in ethanol (30 ml) and then an aqueous solution of potassium hydroxide (40%,15 ml) was added. The mixture ... See full document
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(2E) 3 (Biphenyl 4 yl) 1 (4 methoxyphenyl)prop 2 en 1 one
... For a structurally simple group of compounds, chalcones have displayed an impressive array of biological activities, among which antimalarial (Liu et al., 2003), antiprotozoal (Nielson et al., 1998), nitric oxide ... See full document
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The crystal structures of two chalcones: (2E) 1 (5 chlorothiophen 2 yl) 3 (2 methylphenyl)prop 2 en 1 one and (2E) 1 (anthracen 9 yl) 3 [4 (propan 2 yl)phenyl]prop 2 en 1 one
... the crystal of compound (I), molecule related by a c-glide plane are linked by a single C—H O hydrogen bond (Table 1) to form a C(5) chain running parallel to the [001] direction ...the crystal of ... See full document
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The crystal structures of two chalcones: (2E) 1 (5 chlorothiophen 2 yl) 3 (2 methylphenyl)prop 2 en 1 one and (2E) 1 (anthracen 9 yl) 3 [4 (propan 2 yl)phenyl]prop 2 en 1 one
... the crystal of compound (I), molecule related by a c-glide plane are linked by a single C—H O hydrogen bond (Table 1) to form a C(5) chain running parallel to the [001] direction ...the crystal of ... See full document
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(2E) 1 (6 Chloro 2 methyl 4 phenylquinolin 3 yl) 3 (4 chlorophenyl)prop 2 en 1 one
... Geometry . All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell s.u.'s are taken into account individually in the estimation of s.u.'s in ... See full document
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Crystal structure and Hirshfeld surface analysis of (2E) 1 (3 bromophenyl) 3 (4 fluorophenyl)prop 2 en 1 one
... The title compound was synthesized as per the procedure reported earlier (Kumar et al., 2013a,b). 1-(3-Bromophen- yl)ethanone (0.01 mol) and 4-fluorobenzaldehyde (0.01 mol) were dissolved in ... See full document
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