ModernChargeDensityAnalysis

< Publications 2009   >


(*)Macchi, P. Chimia, 2009, 63, 29-34
Electron Density distribution in Organometallic materials.

Casati, N.; (*)Macchi, P.; Sironi, A. Chemistry, Eur. J., 2009, 15, 4446-4457.
Molecular Crystals Under High Pressure: Theoretical and Experimental Investigations of the Solid-Solid Phase Transitions in Co2(CO)6(XPh3)2 (X=P, As). (pdf)

Dragonetti, C.; Carlucci, L.; D'Alfonso, G.; Lucenti, E.; Macchi, P.; Roberto, D. Sironi, A.; Ugo, R. Organometalics., 2009, 28, 2668–2676.
Synthesis, Spectroscopic and X-ray Characterization of Rhenium Carbonyl Complexes with Different Silsesquioxanes, as Models that Mimic the Chemical Behaviour and the Topology of the Silica Surface
(pdf)

Casati, N.; (*)Macchi, P.; Sironi, A. Chem. Commun., 2009, 2679-2681.
Hydrogen migration in oxalic acid di-hydrate at high pressure? (pdf)

Acetti, D.; D’Arrigo, P.; Giordano, C.; Macchi, P.; Servia, S.; Tessaro, D. int. J. Art. Organs, 2009, 32, 204-212.
New aliphatic glycerophosphoryl-containing polyurethanes: synthesis, platelet adhesion and cytotoxicity studies (pdf)

Fantauzzi, S.; Gallo, E.; Caselli, A.; Ragaini, F.; Casati, N.; Macchi, P.; Cenini, S. Chem. Comm. 2009, 3952-3954.
The Key-Intermediate in the Aminations of Saturated C-H Bonds: Synthesis, X-ray Characterization and Catalytic Activity of Ru(TPP)(NAr)2 (Ar = 3,5-(CF3)2C6H5) (pdf)

(*)Macchi, P. Angew. Chem. Int Engl. Ed., 2009, 48, 5793-5795
Resonant structures and electron density analysis
(pdf)

Ragaini, F.; Gasperini, M.; Cenini, S.; Arnera, L.; Caselli, A.; Macchi, P.; Casati, N. Chemistry, Eur. J. , 2009, 15, 8064-8077.
Mechanistic Study of the Palladium–Phenanthroline Catalyzed Carbonylation of Nitroarenes and Amines: Palladium–Carbonyl. (pdf)

Farrugia, L. J.; (*)Macchi, P. J. Phys. Chem. A., 2009, 113, 10058-10067
On the interpretation of the source function
. (pdf)

Jaggi, M.; Blum, C.; Dupont, N.; Grilj, J.; Liu, S-X.; Hauser, J.; Hauser, A.; Decurtins, S.
Org. Lett., 2009, 11, 3096–3099
A Compactly Fused π-Conjugated Tetrathiafulvalene−Perylenediimide Donor−Acceptor Dyad (pdf)

Schaniel, D.; Woike, T.; Behrnd, N.-R., Hauser, J.; Krämer, K. W.; Todorova, T.; Delley., B. Inorg. Chem. 2009, 48, 11399–11406
Photogeneration of Nitrosyl Linkage Isomers in Octahedrally Coordinated Platinum Complexes in the Red Spectral Range.

Mariaca, R.; Labat, G.; Behrnd, N.R; Bonin, M.; Helbling, F.; Eggli, P.; Coudrec, G.; Neels, A.; Stoeckli-Evans, H.; Hulliger, J. J. Fluo. Chem., 2009, 130, 175-196.
Preparation of donor–acceptor substituted fluorostilbenes and crystal chemistry of fluorinated (E)-4-(4-halogeno-styryl)-benzonitriles

 

Conference proceedings:

Macchi, P. High Pressure crystallography: from novel experimental approaches to applications in cutting edge technologies (41st course International School of Crystallography, Erice), 303-312
Ab initio quantum chemistry and semi-empirical description of solid state phases under high pressure: chemical application

 

Invited lectures:

Macchi, P. High Pressure crystallography: from novel experimental approaches to applications in cutting edge technologies (41st course International School of Crystallography, Erice) 4-14 June 2009
Ab initio quantum chemistry and semi-empirical description of solid state phases under high pressure: chemical application

Macchi, P. Sagamore XVI, Santa Fe New Mexico 2-7 August 2009
Interplay between Theory and Experiment in Charge Density Studies

Macchi P, Scattering Techniques: From Microscopic To Atomic Structures, AIC International School, Camerino, 30th August - 4th September 2009
- Crystals and symmetry

- WAXS: Single Crystal Diffraction
- X-ray charge density analysis

Short Talks:

Macchi P.; Casati, N.; Marshall, W.; Sironi, A. Swiss Crsyatllographic Meeting, Fribourg 8 Sept. 2009
Hydrogen bond evolution in molecular crystals (1st poster prize)