Molecular structure and conformation of 2,3-dichloro-1-propene as determined by gas-phase electron diffraction

The molecular structure and conformation of 2,3-dichloro-1-propene have been determined by gas-phase electron diffraction at nozzle temperatures of 24, 90 and 273°C. The molecules exist as a mixture of two conformers with the chlorine atoms anti (torsion angle ∠φ = 0°) or gauche (∠φ = 109°) to each other and with the anti form the more stable. The composition (mole fraction) of the vapor with uncertainties estimated at 2σ was found to be 0.55 (0.08), 0.49 (0.08) and 0.41 (0.10) at 24, 90 and 273°, respectively. These values correspond to an energy difference with estimated standard deviation ΔE° = E°_g-E°_a = 0.7 ± 0.3 kcal mol^?1 and an entropy difference ΔS° = S°_g-S°_a = 0.6 ± 0.9 cal mol^?1 K^?1. Some of the diffraction results, together with spectroscopic observations, permit the evaluation of an approximate torsional potential function of the form 2V = V₁ (1 - cos φ) + V₂ (1 - cos 2φ) + V₃ (1 - cos 3φ); the results are V₁ = 4.4 ± 0.5, V₂ = ?2.9 ± 0.5 and V₃ = 4.8 ± 0.2, all in kcal mol^?1. The results at 24°C for the distance (r_a) and angle (∠_α) parameters, with estimated uncertainties of 2σ, are: r(C_sp²-H) = 1.098(0.020)Å, r(C_sp³-H) = 1.103(0.020)Å, r(CC) = 1.334(0.009)Å, r(C-C) = 1.504(0.013)Å, r(C_sp²-Cl) = 1.752(0.021)Å, r(C_sp³-Cl) = 1.776(0.020)Å, ∠C-CC = 127.6(1.1)°, ∠C_sp³-C_sp²-Cl = 110.2(1.0), ∠C_sp²-C_sp³-Cl = 113.1(1.2)°, ∠H-C_sp³-H = 109.5° (assumed), ∠CC-H = 120.0° (assumed) and ∠φ = 108.9(3.4)°.     

Infinite-dimensional Log-Determinant divergences between positive definite Hilbert–Schmidt operators

Positivity - The current work generalizes the author’s previous work on the infinite-dimensional Alpha Log-Determinant (Log-Det) divergences and Alpha-Beta Log-Det divergences, defined on the...     

New Approach to Calculating the Double Coaxial Resonator with a Shortening Capacitance

Russian Physics Journal - The double coaxial resonator with a shortening capacitance is calculated by the partial volume method. The double resonator is represented by two single coaxial resonators...     

On σ(·, W)-Holomorphic Functions and Theorems of Vitali-Type

The aim of this paper is to give some criterions for holomorphy of F-valued σ(F, W)-holomorphic functions which are bounded on bounded sets in a domain D of Fréchet spaces E (resp. ${\mathbb{C}^n}$ ) where ${W \subset F'}$ defines the topology of Fréchet space F. Base on these results we consider the problem on holomorphic extension of F-valued σ(F, W)-holomorphic functions from non-rare subsets of D and from subsets of D which determines uniform convergence in H(D). As an application of the above, some theorems of Vitali-type for a locally bounded sequence ${\{f_i\}_{i \in \mathbb{N}}}$ of Fréchet-valued holomorphic functions are also proved.     

Function algebras on disks II

This work is a continuation of [7]. In that paper, a sufficient condition was given on a real analytic fmlction g defined near 0 in C so that the algebra generated by z² and g² is dense in the space of continuous functions on D for all disks D close enough to the origin in C. By using the same methods and some ideas taken from the first named author's thesis we deal with the case where g is only of class C¹ near 0.     

A Strong Law for Mixing Random Variables

A sharp almost sure bound is derived for limit points of average sum of weakly dependent random variables, which ensures strong laws of large numbers for and -mixing random variables, without assumptions on rate of tending to zero of and -mixing parameters _n and _n.     

Syntomic regulators and special values of p-adic L-functions

In this paper p-adic analogs of the Lichtenbaum Conjectures are proven for abelian number fields F and odd prime numbers p, which generalize Leopoldt's p-adic class number formula, and express special values of p-adic L-functions in terms of orders of K-groups and higher p-adic regulators. The approach uses syntomic regulator maps, which are the p-adic equivalent of the Beilinson regulator maps. They can be compared with étale regulators via the Fontaine-Messing map, and computations of Bloch-Kato in the case that p is unramified in F lead to results about generalized Coates-Wiles homomorphisms and cyclotomic characters. Oblatum 14-V-96 & 9-X-97