Does Z' equal 1 or 2? Enhanced powder NMR crystallography verification of a disordered room temperature crystal structure of a p38 inhibitor for chronic obstructive pulmonary disease
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Metergoline is a dopamine agonist and serotonin antagonist used both in human and veterinary medicine. In addition to the previously known crystalline form, a new polymorph, which crystallizes from aqueous solution, was found. Since it was initially imposs ...
We report a method that combines measured solid-state NMR chemical shifts and first principles calculations to resolve the crystal structure of a powdered crystalline solid to within 0.13 A of the known structure. The validity of this process is confirmed ...
Reactions of the dinuclear ruthenium complex [(p-cymene)Ru(mu-Cl)3RuCl(C2H4)(PCy3)] with phenylacetylene or tert-butylacetylene gave the vinylidene complexes [(p-cymene)Ru(mu-Cl)3RuCl(=C=CHR)(PCy3)] (R = tBu, Ph), which were characterized crystallographica ...
The betain-like carbodiphosphorane CS2 adduct S2CC(PPh3)2 (1) reacts with Ag(I) salts which contain weakly coordinating anions such as [BF4]- or [Al{OC(CF3)3}4]- to produce the cluster compounds [Ag6{S2CC(PPh3)2}4][BF4]6 (2) and [Ag4{S2CC(PPh3)2}4][Al{OC(C ...
BACKGROUND: APOBEC3G (apolipoprotein B mRNA-editing enzyme, catalytic polypeptide-like 3G) has antiretroviral activity associated with the hypermutation of viral DNA through cytosine deamination. APOBEC3G has two cytosine deaminase (CDA) domains; the catal ...
The synthesis and characterization of a series of cobalt(III) complexes of the general type Co(N2O2)(L-2) are described. The N2O2 Schiff base ligands used are Me-salpn (H2Me-salpn = N,N'-bis(methylsalicylidene)-1,3-propylenediamine) (1-3) and Me-salbn ...
A C-13 CPMAS NMR experiment at high field (11.7 T) has produced significantly improved dispersion for the a form of testosterone, allowing revisions and extensions to be made to the assignments. Correlations shown by an INADEQUATE two-dimensional spectrum, ...
