✦ LIBER ✦

Frequency of bond vibrations of N-H, perturbed by the N-H...O = C interaction, as an indicator of the electron density distribution around the oxygen atom

✍ Scribed by E. G. Atovmyan

Book ID: 104873044
Publisher: Springer US
Year: 1990
Tongue: English
Weight: 384 KB
Volume: 52
Category: Article
ISSN: 0021-9037
DOI: 10.1007/bf00664792

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Universal Features of the Electron Densi

Universal Features of the Electron Density Distribution in Hydrogen-Bonding Regions: A Comprehensive Study Involving H⋅⋅⋅X (X=H, C, N, O, F, S, Cl, π) Interactions

✍ Ignasi Mata; Ibon Alkorta; Elies Molins; Enrique Espinosa 📂 Article 📅 2010 🏛 John Wiley and Sons 🌐 English ⚖ 978 KB

Experimental Charge Density Evidence for

Experimental Charge Density Evidence for the Existence of High Polarizability of the Electron Density of the Free Electron Pairs on the Sulfur Atom of the Thioureido Group, NH−C(S)−NH 2 , Induced by N−H···S and C−H···S Interactions

✍ Novaković, Sladjana B.; Fraisse, Bernard; Bogdanović, Goran A.; Spasojević-de Bi 📂 Article 📅 2007 🏛 American Chemical Society 🌐 English ⚖ 211 KB

Electronically excited oxygen atoms, O(2

Electronically excited oxygen atoms, O(21D2). A time-resolved study of the collisional quenching by the gases H2, D2, CH4, NO, NO2, N2O, and C3O2 using atomic absorption spectroscopy in the vacuum ultraviolet

✍ R. F. Heidner III; D. Husain 📂 Article 📅 1973 🏛 John Wiley and Sons 🌐 English ⚖ 597 KB

Time-resolved atomic absorption spectroscopy in the vacuum ultraviolet has been employed to monitor electronically excited oxygen atoms, 0(2\*D2), following their generation by the flash photolysis of ozone in the Hartley band region. We report the first values for the absolute second-order rate con

Reactivity of cyclopalladated compounds:

Reactivity of cyclopalladated compounds: VIII. Synthesis of cyclometallated compounds with an oxygen as the donor atom. Crystal and molecular structure of (8-methylquinoline-C,N)-(1-methoxynaphthalene-8-C,O)palladium(II)

✍ J. Dehand; A. Mauro; H. Ossor; M. Pfeffer; R.H. de A. Santos; J.R. Lechat 📂 Article 📅 1983 🏛 Elsevier Science 🌐 English ⚖ 897 KB

Guanine tetrads interacting with metal i

Guanine tetrads interacting with metal ions. An AIM topological analysis of the electronic densityElectronic Supplementary Information (ESI) available: Geometric data, topologic data at the BCP and integrated properties of the hydrogen atom of every H1â¯O6 and H2â¯N7 hydrogen bond. See http://www.rsc.org/suppdata/qu/b2/b210911e/

✍ Louit, Guillaume; Hocquet, Alexandre; Ghomi, Mahmoud; Meyer, Michael; SÃ¼hnel, J 📂 Article 📅 2003 🏛 Royal Society of Chemistry 🌐 English ⚖ 468 KB

Oxygenate, oxyalkyl and alkoxycarbonyl t

Oxygenate, oxyalkyl and alkoxycarbonyl thermochemistry and rates for hydrogen abstraction from oxygenatesElectronic supplementary information (ESI) available: Supplementary Table A: The MP2/6-31G(d?) optimized Cartesian coordinates (in ?), the unscaled harmonic vibrational frequencies (in cm?1) and rotational CONSTS (in GHz) at the HF/6-31G(d?) level of the transition structures involved in the abstraction by H atom from the methoxy, primary and secondary alkoxy, carbonyl and hydroperoxy hydrogens. Supplementary Table B: The MP2/6-31G(d?) optimized Cartesian coordinates (in ?), the unscaled harmonic vibrational frequencies (in cm?1) and rotational constants (in GHz) at the HF/6-31G(d?) level of the transition structures involved in the abstraction by CH3 group from the methoxy, primary and secondary alkoxy, carbonyl and hydroperoxy hydrogens. Supplementary Table C: Number of minima on the one-dimensional rotational potential energy surface and the relative energies (in kcal mol?1) of minima together with the total barrier height (in kcal mol?1) for rotation around the specified bond at the HF/6-31G(d?) level. See http://www.rsc.org/suppdata/cp/b3/b307050f/

✍ Sumathi, R.; Green, Jr., William H. 📂 Article 📅 2003 🏛 Royal Society of Chemistry 🌐 English ⚖ 345 KB