화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Rationalizing the Effect of Halogenation on the Molecular Structure of Simple Cyclobutene Derivatives by Topological Real-Space Analysis of Their Electron Density
Lo Presti L, Ellern A, Destro R, Soave R, Lunelli B
Journal of Physical Chemistry A, 115(45), 12695, 2011
2 Effect of Methoxy Substituents on the Structural and Electronic Properties of Fluorinated Cyclobutenes: A Study of Hexafluorocyclobutene and Its Vinyl Methoxy Derivatives by XRD and Periodic DFT Calculations
Lo Presti L, Ellern A, Destro R, Lunelli B
Journal of Physical Chemistry A, 113(13), 3186, 2009
3 Physicochemical properties of zwitterionic L- and DL-alanine crystals from their experimental and theoretical charge densities
Destro R, Soave R, Barzaghi M
Journal of Physical Chemistry B, 112(16), 5163, 2008
4 On the interplay between CH...O and OH...O interactions in determining crystal packing and molecular conformation: An experimental and theoretical charge density study of the fungal secondary metabolite austdiol (C12H12O5)
Lo Presti L, Soave R, Destro R
Journal of Physical Chemistry B, 110(12), 6405, 2006
5 Looking for structural phase transitions in the colossal magnetoresistive thiospinel FeCr2S4 by a multi-temperature single-crystal X-ray diffraction study
Lo Presti L, Invernizzi D, Soave R, Destro R
Chemical Physics Letters, 416(1-3), 28, 2005
6 Approximate anisotropic displacement parameters for H atoms in molecular crystals
Roversi P, Destro R
Chemical Physics Letters, 386(4-6), 472, 2004
7 Fundamental properties and nature of CH center dot center dot O interactions in crystals on the basis of experimental and theoretical charge densities. The case of 3,4-bis(dimethylamino)-3-cyclobutene-1,2-dione (DMACB) crystal
Gatti C, May E, Destro R, Cargnoni F
Journal of Physical Chemistry A, 106(11), 2707, 2002
8 The unexpected and large enhancement of the dipole moment in the 3,4-bis(dimethylamino)-3-cyclobutene-1,2-dione (DMACB) molecule upon crystallization: A new role of the intermolecular CH center dot center dot center dot O interactions
May E, Destro R, Gatti C
Journal of the American Chemical Society, 123(49), 12248, 2001
9 Experimental charge density of alpha-glycine at 23 K
Destro R, Roversi P, Barzaghi M, Marsh RE
Journal of Physical Chemistry A, 104(5), 1047, 2000
10 C-13 NMR of Citrinin in the Solid-State and in Solutions
Poupko R, Luz Z, Destro R
Journal of Physical Chemistry A, 101(28), 5097, 1997