Transition, crystallographic table

The crystallographic transition at the Curie temperature is first order with the values given in Table 116 being obtained for the enthalpy of transition ... 

Table 4. Site occnpancy and crystallographic transition temperatnres. a) Distribntion of A1 ions in mordenites [97A1].

Relative differences between S 2p3/2 and O 1 s ionization potentials show a characteristic separation for oxygen-bound and sulphur-bound sulphoxides. It is clearly shown in Table 20 that sulphur-bound complexes have (O 1 s-S 2p3/2) relative shifts of 365.0 eV, while oxygen-bound complexes have relative shifts of 365.8 eV. Infrared and X-ray crystallographic results also show that most neutral platinum and palladium dialkyl sulphoxide complexes contain metal-sulphur rather than metal-oxygen bonds, while first-row transition metals favour oxygen-bonded sulphoxide. 

The conversion of the kinetic data into AAG -values (Table 4.2) assumes that the rate-limiting step is the same in wild type and variant. It also assumes that the mutation does not cause structural rearrangements. Only in very few cases have the kinetic studies on the transition state stabilization by the oxyanion hole contributions been complemented by protein crystallographic studies of the liganded wild-type and mutated variant. One such example, discussed in more detail below, concerns the studies on the Ser42Ala variant of cutinase, in which case it was found that the structural changes are minimal [19]. 

A second strategy to control facial selectivity involves the use of chiral sultams and lactams as auxiliaries for the dipolarophile (120-123). Cycloaddition of 132 with a variety of substituted nitronates provides up to 9 1 selectivity of the major diastereomer (Table 2.38). However, substitution at the a-position of the dipolarophile leads to a reduction in stereoselectivity (entry 5). Assuming an s-cis conformation of the dipolarophile, it is proposed that the major isomer arises from an endo approach of the nitronate to the Re face of the dipolarophile (Fig. 2.13). This is supported by X-ray crystallographic analysis of one of the cycloadducts, which resides in a conformation similar to the proposed transition state. However, this analysis assumes that the silyl nitronate is only reacting through the... 

ASOa-perovskites of Table 6 extends from Dza through Can to Ci. Distinct band-splittings are not observed, however, 13) (Fig. 2). As is demonstrated for the YCra Ali-a 03-system, the Oo-transition is situated at 13600 to 13700 cm i independent of the Cr3+ concentration (Fig. 2) leading to a B55 of 705 cm (Table 3), which is more than 5% lower than for the corundum and spinel compounds discussed. This is in agreement with the possibility of relatively strong Ji-bonds in the perovskite structure, which could be inferred from spectroscopic and crystallographic results 3) as well as from NMR-data and MO-calculations 33) for Ni2+,... 

Although the number of tetrafluorides reported is as large as the number of di- and trifluorides (see Table III), this group of compounds is the least well characterized structurally of the transition metal fluorides. The synthesis of most of the expected tetrafluorides has been reported, with examples from titanium to manganese in the first, from zirconium to palladium (except for technetium) in the second, and from hafnium to platinum (except for tantalum) in the third series. Many of them have been little studied and, in general, they have not proved amenable to crystallographic structural analysis. 

TABLE 1 Crystallographic data for ternary rare-earth transition metal-plumbides. If listed in the literature, standard deviations are given in parentheses... 

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