Search Results - "Henn, Julian"
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High Yield Access to Silylene RSiCl (R = PhC(NtBu)2) and Its Reactivity toward Alkyne: Synthesis of Stable Disilacyclobutene
Published in Journal of the American Chemical Society (27-01-2010)“…Two new approaches for synthesizing RSiCl, (R = PhC(NtBu)2) are reported by the reaction of RSiHCl2 with bis-trimethyl silyl lithium amide and N-heterocyclic…”
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Electron-Density Investigation of Metal-Metal Bonding in the Dinuclear "Borylene" Complex [{Cp(CO)₂Mn}₂(μ-BtBu)]
Published in Angewandte Chemie (International ed.) (26-05-2008)“…Close but not bonded are the two manganese atoms in the title borylene complex. The charge‐density study demonstrates that the μ‐bridging BR ligand forms…”
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3
Consecutive Donor-Base Exchange in Anthracenyllithium Compounds
Published in Angewandte Chemie (International ed.) (10-09-2010)“…Selective and consecutive donor‐base addition and exchange in the same organolithium complex was monitored by structural determination, although it is feasible…”
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Di(benzothiazol-2-yl)phosphanide as a Janus-Head Ligand to Caesium
Published in Chemistry : a European journal (01-01-2007)“…Starting from tris(benzothiazol‐2‐yl)phosphane (1) an advanced Janus‐head ligand, di(benzothiazol‐2‐yl)phosphane (2), was synthesised and structurally…”
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An alternative to the goodness of fit
Published in Acta crystallographica. Section A, Foundations and advances (01-11-2016)“…An alternative measure to the goodness of fit (GoF) is developed and applied to experimental data. The alternative goodness of fit squared (aGoFs) demonstrates…”
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More about systematic errors in charge‐density studies
Published in Acta crystallographica. Section A, Foundations and advances (01-09-2014)“…In order to detect and graphically visualize the absence or presence of systematic errors in fit data, conditional probabilities are employed to analyze the…”
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About systematic errors in charge‐density studies
Published in Acta crystallographica. Section A, Foundations and advances (01-05-2014)“…The formerly introduced theoretical R values [Henn & Schönleber (2013). Acta Cryst. A69, 549–558] are used to develop a relative indicator of systematic errors…”
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Statistical tests against systematic errors in data sets based on the equality of residual means and variances from control samples: theory and applications
Published in Acta crystallographica. Section A, Foundations and advances (01-03-2015)“…Statistical tests are applied for the detection of systematic errors in data sets from least‐squares refinements or other residual‐based reconstruction…”
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Progress in detection of and correction for low‐energy contamination
Published in Journal of applied crystallography (01-08-2023)“…Contamination with low‐energy radiation leads to an increased number of weighted residuals being larger in absolute terms than three standard uncertainties…”
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Expectation values for integer powers of a Poisson-distributed random number
Published in Acta crystallographica. Section A, Foundations of crystallography (01-11-2012)“…It is shown that expectation values of Poisson‐distributed random numbers exist not only for the well known positive integer powers but also for negative…”
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11
Lewis Base Stabilized Dichlorosilylene
Published in Angewandte Chemie (International ed.) (20-07-2009)“…Stable? You can bottle it! The base‐stabilized dichlorosilylene L1SiCl2 (see picture; L1=1,3‐bis(2,6‐diisopropylphenyl)imidazol‐2‐ylidene) is stable at room…”
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12
Ambiguities in the scattering tomography for central potentials
Published in Physical review letters (18-08-2006)“…Invisibility devices exploit ambiguities in the inverse scattering problem of light in media. Scattering also serves as an important general tool to infer…”
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13
Foundations of residual-density analysis
Published in Acta crystallographica. Section A, Foundations of crystallography (01-05-2008)“…New and concise descriptors of the residual density are presented, namely the gross residual electrons, the net residual electrons and the fractal dimension…”
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14
Zwitterionic Si-C-Si-P and Si-P-Si-P Four-Membered Rings with Two-Coordinate Phosphorus Atoms
Published in Angewandte Chemie (International ed.) (01-03-2011)“…It's hip to be square: The reaction of amidinato chlorosilylene (PhC(NtBu)2SiCl) with adamantyl phosphaalkyne and white phosphorus affords the formation of…”
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15
Electron Densities of Three B 12 Vitamins
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (23-07-2009)Get full text
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Chemical interpretation of molecular electron density distributions
Published in Journal of computational chemistry (15-11-2007)“…In this study, the two small molecules HS(CH)(CH₂), 1, and F(CH)₄F, 2, are presented, which yield different chemical interpretations when one and the same…”
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Anharmonic Motion in Experimental Charge Density Investigations
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (24-01-2013)“…In the charge density study of 9-diphenylthiophosphinoylanthracene the thermal motion of several atoms needed an anharmonic description via Gram–Charlier…”
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Carbanion or Amide? First Charge Density Study of Parent 2-Picolyllithium
Published in Angewandte Chemie (International ed.) (06-04-2009)“…The negative charge originating from deprotonation of the methyl group is distributed over the 2-picolyl ring. Bonding properties derived from the electron…”
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Electron Densities of Three B12 Vitamins
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (23-07-2009)“…The electron densities of the three natural B12-vitamins, two of them being essential cofactors for animal life, were determined in a procedure combining…”
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Charge Density Distribution in a Metallaphosphane
Published in Angewandte Chemie (International ed.) (22-03-2010)“…Two lone pairs: The metallaphosphane [Me2Al(μ‐Py)2P] contains a divalent PIII atom. Charge density investigations reveal the presence of two lone pairs at the…”
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