ORTEP-3 for Windows - a version of ORTEP-III with a Graphical User Interface (GUI)
01 Oct 1997-Journal of Applied Crystallography (International Union of Crystallography)-Vol. 30, Iss: 5, pp 565-565
TL;DR: L Lists of software presented and~or reviewed in the Journal of Applied Crystallography are available on the World Wide Web at the above address, together with information about the availability of the software where this is known.
Abstract: Computer Program Abstracts The category Computer Program Abstracts provides a rapid means of communicating up-to-date information concerning both new programs or systems and significant updates to existing ones. Following normal submission, a Computer Program Abstract will be reviewed by one or two members of the IUCr Commission on Crystallographic Computing. It should not exceed 500 words in length and should follow the standard format given on page 189 of the June 1985 issue of the Journal [J. Appl. CrysL (1985). 18, 189190] and on the World Wide Web at http://www.iucr. ac. uk/journals/jac/software/. Lists of software presented and~or reviewed in the Journal of Applied Crystallography are available on the World Wide Web at the above address, together with information about the availability of the software where this is known. J. App/. CrysL (1997). 30, 565 ORTEP-3 for Windows a version of ORTEP-III with a Graphical User Interface (GUI)
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TL;DR: Subcutaneous administration of the 5-trifluoromethyl-4,5-dihydro-1H-pyrazoles decreased pain-related behavior during neurogenic and inflammatory phases of the formalin test in mice, and the more active analgesic compounds significantly decreased carrageenan-induced paw edema in mice.
78 citations
TL;DR: In this paper, the synthesis and characterisation of four monomeric cis-dioxomolybdenum(VI) complexes involving Schiff base ligands is described, which act as inhibitors in the oxidation of aldehydes by oxygen.
78 citations
TL;DR: According to X-ray diffraction and magnetic measurements, the Co complexes 3a-e proved to be tetrahedral, which is the preferred geometry for Co(II) compounds, however, a square planar geometry is observed in the case of 3f, as determined by several characterization techniques.
Abstract: A series of 2-iminopyrrole ligand precursors with increasing bulkiness [HNC4H3C(R)N-2,6-R‘2C6H3] (R = R‘ = H, 1a; R = Me, R‘= H, 1b; R = H, R‘ = Me, 1c; R = R‘ = Me, 1d; R = H, R‘ = iPr, 1e; R = Me, R‘ = iPr, 1f) were synthesized and deprotonated with NaH to give the corresponding iminopyrrolyl sodium salts 2a−f. A set of homoleptic bis-ligand Co(II) complexes of the type [Co(κ2N,N‘-NC4H3C(R)N-2,6-R‘2C6H3)2] (R = R‘= H, 3a; R = Me, R‘= H, 3b; R = H, R‘ = Me, 3c; R = R‘ = Me, 3d; R = H, R‘ = iPr, 3e; R = Me, R‘ = iPr, 3f) was prepared by reaction of CoCl2 with the corresponding iminopyrrolyl sodium salts 2a−f. The new complexes were characterized by elemental analysis, magnetic susceptibility measurements, in powder and in solution, UV/vis/NIR, and, in some cases, X-ray crystallography. According to X-ray diffraction and magnetic measurements, the Co complexes 3a−e proved to be tetrahedral, which is the preferred geometry for Co(II) compounds. However, a square planar geometry is observed in the case of 3f...
78 citations
TL;DR: The present work reports on the synthesis, anti-Trypanosoma cruzi activities and docking studies of a novel series of 2-(pyridin-2-yl)-1,3-thiazoles derived from 2-pyridine thiosemicarbazone, which are potent cruzain inhibitors and showed excellent inhibition on the trypomastigote form of the parasite.
78 citations
TL;DR: According to these results and in order to fulfill environmental regulations, the toxicity of the compounds studied herein can be modulated through the proper selection of the disubstituted tin(IV) moiety.
Abstract: The one pot reaction of salicylaldehyde 1, β-amino alcohols 2a−2c, and di-n-butyltinIV oxide 3a or diphenyltinIV oxide 3b produced five diorganotinIV compounds, 4a−4c, 5a, and 5c, in good yields. All compounds were characterized by IR, 1H, 13C, and 119Sn NMR spectroscopy, and elemental analysis; furthermore, compounds 4b, 4c, 5a, and 5c were characterized by X-ray diffraction analysis. After the structural characterization, all of the compounds were tested in vitro against Bacillus subtilis (Gram-positive, strain ATCC 6633), Escherichia coli (Gram-negative, strain DH5α), Pseudomonas aeruginosa (Gram-negative, strain BH3), Desulfovibrio longus (strain DSM 6739), and Desulfomicrobium aspheronum (strain DSM 5918) to assess their antimicrobial activity. Compounds 4 and 5 demonstrated a wide range of bactericidal activities against the tested aerobic (one Gram-positive and two Gram-negative subtypes) and anaerobic bacteria (two sulfate-reducing bacteria, SRB). Compound 5 had better bactericidal performances th...
78 citations