Results 11 to 20 of about 623,551 (341)
Cyclopentyldiphenyl(4-thiosemicarbazonopentanoato-κO)tin(IV)
Acta Crystallographica Section E, 2008 The Sn atom in the title compound, [Sn(C5H9)(C6H5)2(C6H10N3O2S)], exists within a tetrahedral geometry. The –NH2 group forms a weak hydrogen bond across a center of inversion to the S atom of an adjacent molecule, as well as another weaker hydrogen
Seik Weng Ng, Kong Mun Lo
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Study on synergistic effects of H and He in α-Fe
Nuclear Materials and Energy, 2018 The synergistic effect of hydrogen and helium in α-Fe has been investigated using density functional theory calculation method. In perfect crystal of Fe, the presence of helium atom would decrease the dissolution energy of hydrogen atom near helium atom.
Jingming Shi, Naoyuki Hashimoto
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Acta Crystallographica Section E: Crystallographic Communications, 2020 The crystal structures of disodium hydrogen citrate monohydrate, Na2HC6H5O7(H2O), and diammonium sodium citrate, (NH4)2NaC6H5O7, have been solved and refined using laboratory X-ray powder diffraction data, and optimized using density functional ...
Jerry Hong +3 more
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On-Surface Synthesis with Atomic Hydrogen [PDF]
ACS Nano, 2020 Surface-assisted synthesis has become a powerful approach for generation of molecular nanostructures, which could not be obtained via traditional solution chemistry. Nowadays there is an intensive search for reactions that could proceed on flat surfaces in order to boost the versatility and applicability of synthesized nano-objects.
Rafal Zuzak +5 more
openaire +4 more sources
Nature Communications, 2021 Although hydrogen atom transfer is widely observed in synthetic organic chemistry, intramolecular hydrogen atom transfer between atoms separated by fewer than four bonds is kinetically slow. Here the authors show a method to form indanones, with hydrogen
Bo Yang +4 more
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1-(2-Methylbenzoyl)-3-m-tolylthiourea
Acta Crystallographica Section E, 2008 The molecule of the title compound, C16H16N2OS, is not planar; the two aromatic rings are inclined to one another by 37.59 (9)°. There are intramolecular hydrogen bonds between the benzoyl O atom and the H atom of the thioamide N atom, and ...
B. M. Yamin +3 more
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Classical approach in quantum physics [PDF]
, 2010 The application of a classical approach to various quantum problems - the secular perturbation approach to quantization of a hydrogen atom in external fields and a helium atom, the adiabatic switching method for calculation of a semiclassical spectrum of
A. Einstein +52 more
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A Second Crystal Polymorph of Anilinium Picrate [PDF]
, 2004 The crystal structure of a second monoclinic polymorph of anilinium picrate shows a three-dimensional hydrogen-bonded polymer with strong primary interspecies interactions involving the proximal phenolate and adjacent nitro group O-atom acceptors and ...
Healy, Peter +2 more
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Bromido(quinolin-8-ol-κ2N,O)(quinolin-8-olato-κ2N,O)zinc(II) methanol monosolvate
Acta Crystallographica Section E, 2010 The title compound, [ZnBr(C9H6NO)(C9H7NO)]·CH3OH, has its metal atom N,O-chelated by a neutral and a deprotonated 8-hydroxyquinoline ligand. The hydroxy unit of the neutral ligand is a hydrogen-bond donor to the methanol O atom and the alkoxy O ...
Seik Weng Ng +2 more
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2-{[(Pyridin-2-yl)amino]methyl}phenol
Acta Crystallographica Section E, 2012 The planes of the aromatic rings of the title compound, C12H12N2O, are twisted by 50.33 (15)°. The phenol O atom is a hydrogen-bond donor to the pyridine N atom, resulting in the formation of an eight-membered ring in the molecule. The
Shan Gao, Seik Weng Ng
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