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Artículo
Lattice-Energy Calculations on Phenothiazine and Phenoselenazine Modifications
(International Union of Crystallography, 1983)
Lattice-energy calculations in the atom-atom potential approach have been performed for observed and isostructurally derived hypothetical forms of phenothiazine and phenoselenazine compounds. Energy minimizations with ...
Artículo
The Crystal and Molecular Structure of 1-p-Chlorophenyl-4-(tt-a-erythrofuranosyl)-4-imidazoline-2-thione
(International Union of Crystallography, 1974)
The title compound, CISOsN2C~sH~3, the definitive formula of which has been established by X-ray structural analysis, is orthorhombic, space group P2~2121 with a= 7.806 (5), b= 29.417 (13) and c= 5-921 (5) A, Z--4. The ...
Artículo
Structure of l'-(p-Bromophenyl)-3'-ethyl- 1',3t,4',5 t -tetrahydro- 1,2-¢~• deoxy-D-glyeero-Dgu/ a-heptofuranoso[ 1,2-d]imidazole-2'-thione,* C16H21BrN2OsS
(International Union of Crystallography, 1984)
M r = 433.3, monoclinic, P21, a = 6.924 (3), b=8.661 (1), c=15.039(3)A, #=96.92(3) ° , v= 895.3 (4) A a, Z= 2, D, = 1.598 (5), Dx= 1.607 Mg m -a, Mo Ka, 2 = 0.7107/k, # = 2.42 mm -1, F(000) = 444, T = 300 K, R = 0.039 ...
Artículo
Lattice Dynamical Calculation of First-Order Thermal Diffuse Scattering in Phenothiazine
(International Union of Crystallography, 1985)
A computer program has been developed to calculate first-order thermal diffuse scattering (TDS) intensity from eigenvectors and eigenvalues of the dynamical matrix obtained within the harmonic approximation with an ...
Artículo
Structure of 1,3-Dihydro-4-[(2R)-2,5-dihydro-2-furyl]-3-phenyl-l-(p-tolyl)-2H-imidazole- 2-thione, C20HlsN2OS
(International Union of Crystallography, 1985)
Mr=334.4, orthorhombic, P212~2 ~, a= 9.366(4), b=20.616(5), c=9.137(4)A, V= 1764 (1) A 3, Z = 4, D x = 1.26 Mg m -3, 2(Mo Ka) = 0.7107 A, g = 0.18 mm -~, F(000) = 704, T= 300 K, final R--0.056 (wR =0.052) for 1979 ...
Artículo
The Crystal and Molecular Structure of 2-Formylpyridine Selenosemicarbazone
(International Union of Crystallography, 1972)
The structure of 2-formylpyridine selenosemicarbazone, SeN4CTH8, has been determined from threedimensional X-ray photographic data. The crystals are monoclinic, space group P2t/e, with unit-cell dimensions a=9.320, b=6-524 ...
Artículo
X-Ray Structure of 8alpha-Acetoxy-1,3,4,10-Tetrahydro-1alpha,10alpha-Epoxyachillin
(International Union of Crystallography, 1986)
(5aI-I,6/~-I, 11 aH)-8a-Acetoxy- 1,5-dihydro-2- oxo-lct,10ct-epoxyguaian-6,12-olide, C~7H2206, Mr= 322.3, orthorhombic P2~212~, a= 14.964(6), b= 17.057(4), c=6.218(4)A, V=1587(1)A 3, Z=4, D,n=l.349(5), D x=l.349Mgm -3, ...
Artículo
The Crystal and Molecular Structure of 4-Formylimidazoline-2-thione
(International Union of Crystallography, 1977)
The title compound is monoclinic, space group P2 Jc, with a = 4.020 (4), b = 21.491(3), c = 7-410 (4) ,4,, fl = 124.1 (5) °, Z = 4. The structure was solved by Patterson-function and heavy-atom methods from diffractometer X-ray ...
Artículo
Estructura de dislocaciones en ZRO2 totalmente estabilizado deformado a alta temperatura
(1989)
Se ha estudiado por microscopía electrónica de transmisión la microestructura de deformación a altas temperaturas (1.300-1.550°C) de monocristales de Zr02-Y203 totalmente estabilizados. La variación observada en la ...
Artículo
First- and Second-Order Thermal Diffuse Scattering (TDS) Intensity in Molecular Crystals: Influence on Crystal Structure Parameters
(International Union of Crystallography, 1985)
First- and second-order thermal diffuse scattering (TDS) intensities are calculated in the long-wave approximation allowing for dispersion (LWD) in monoclinic phenothiazine from polarization vectors and lattice-mode ...