182 research outputs found
1,3-Diphenyl-8-trifluoromethyl-1H-pyrazolo[3,4-b]quinoline
The 1H-pyrazolo[3,4-b]quinoline (PQ) core of the title molecule, C23H14F3N3, is aromatic and essentially planar (r.m.s. deviation = 0.015 Å) and the two phenyl substituents at positions 1 and 3 are twisted relative to this fragment by 29.74 (7) and 25.63 (7)°, respectively. In the crystal, molecules are arranged along the b axis into stacks via [pi]-[pi] interactions, with an interplanar distance of the PQ core of 3.489 (4) Å
3-Methyl-1,4-diphenyl-1H-pyrazolo[3,4-b]quinoline
In the title molecule, C23H17N3, the phenyl substituents at positions 1 and 4 are twisted relative to the central core by 27.09 (5) and 66.62 (4)°, respectively. In the crystal, molecules are assembled into centrosymmetric dimers via π–π stacking interactions between the 1H-pyrazolo[3,4-b]quinoline units, with an interplanar distance of 3.601 (2) Å and by weak intermolecular C—H⋯N interactions
(2Z)-2-Anilino-2-[oxido(phenyl)iminio]-N-(2-pyridyl)acetamide methanol 0.425-solvate
The title compound, C19H16N4O2·0.425CH4O, crystallizes with two formula units per asymmetric unit. Researching its crystal structure constitutes part of a study of the nature of interactions between the N+—O− group and the vicinal NH group. The nitrone group and methanol solvent molecules are linked via four N—H⋯O and one O—H⋯O hydrogen bonds, with donor–acceptor distances of 2.603 (3)–2.730 (3) and 2.770 (3) Å, respectively. The crystal structure also involves two intermolecular N—H⋯N hydrogen bonds
Lattice deformation of blue halite from Zechstein evaporite basin : Kłodawa Salt Mine, Central Poland
Outcrops of natural blue and purple halite crystals
have been found in K
ł
odawa (Poland) salt deposit originating
from the Permian (Zechstein) salt formation within tectonic
zones. Field works carried out on various levels of K
ł
odawa
Salt Mine indicated differencesbothinintensity ofthe hue and
in the size of the outcrops. Their occurrence was connected
with the presence of epigenetic sediments rich in potassium.
For the samples of blue ha
lite, an optical anisotropy
(birefringence) was observed for both standard mineralogical
thin sections and thick plates, indicating a deviation from
cubic symmetry. The blue colouration of the halites, described
by ultraviolet
–
visible spectroscopy, is due to the presence of
colour centres. The colour centres have been recently identi-
fied as: F, R
1
(F
3
), R
2
(F
3
), M and
plasmons
(Wese
ł
ucha-
Birczy
ń
ska et al., Vib Spectrosc 60:124
–
128,
2012
). The trace
amount of impurities detected in the blue halites by means of
scanning electron microscopy
–
energy dispersive X-ray spec-
troscopy and micro-X-ray fluorescence techniques were con-
nected mainly with solid inclusions such as K
x
Na
(1
−
x
)
Cl,
KMgCl
3
·6H
2
O, KCl, orthorhombic sulphur, quartz and some
other phases like pyrite. Crystallographic data obtained by X- ray diffraction experiments for the single crystals of the halite
from K
ł
odawa with different saturation of blue or purple
colours, as well as for natural colourless halite, revealed
lowering of space-group symmetry to monoclinic, orthorhom-
bic, trigonal, tetragonal or even triclinic systems while the
space group typical for pure NaCl is
Fm
-3
m
Spectroscopic properties of halite from Kłodawa salt mine, central Poland
The dynamics of colour centre transformation was investigated in blue halite single crystals from Kłodawa Salt Mine, Central Poland, using UV-vis spectroscopy. The following colour centres were considered: F, R_{1}, R_{2}, as well as plasmons and M centres. The R_{2} centres predominated in navy blue (A) and pale blue (B) halites. Other relatively large populations were plasmons found in all examined samples. In purple (C) halite samples the plasmon population is the highest one among others and R_{1} centres appeared to be equally significant, whereas M centres were almost absent. For A and C samples unidentified bands were observed at 26,500 to 26,200 cm^{-1}, respectively. The bleaching process of the blue halites was investigated using temperature dependent UV-vis and micro-Raman spectroscopies. In micro-Raman 300-100 cm^{-1} region three very intense sharp bands were attributed to the colour centres and colloidal Na precipitation in A and B halites. The one broad band in the range 3,500 to 500 cm^{-1}, which was characteristic even for the colourless sample D but absent in the spectra of colourless NaCl obtained after recrystallization of sample A, requires further study
6-Fluoro-1,3,4-triphenyl-1H-pyrazolo[3,4-b]quinoline benzene hemisolvate
In the title compound, C28H18FN3·0.5C6H6, the 1H-pyrazolo[3,4-b]quinoline core is almost planar (r.m.s = 0.0371 Å, maximum deviation = 0.0571 Å) and aromatic. The solvent benzene molecules are located around inversion centres. In the crystal, molecules related by centres of symmetry form dimers, with distances of 3.932 (3) Å between best planes through the fused core due to π⋯π stacking. The phenyl substituents at positions 1, 3 and 4, are twisted away from the core, making dihedral angles of 29.66 (7), 44.59 (7) and 67.94 (6)°, respectively
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