ModernChargeDensityAnalysis

< Publications 2014 >



P. Macchi

Macchi, P.(*) Chimia 2014, 68,31-37 (pdf)
Crystallographic approaches for the investigation of molecular materials: structure property relationships and reverse crystal engineering.

Zardi, P.; Caselli, A.; Macchi, P.; Ferretti, F.; Gallo, E. Organometallics 2014,33, 2210−2218 (pdf)
Synthesis of Biologically Relevant Compounds by Ruthenium Porphyrin Catalyzed Amination of Benzylic C–H Bonds

Krawczuk, A.; Pérez, D.; Macchi, P.(*) J. Appl. Cryst., 2014, 47, 1452–1458 (pdf)
PolaBer: a program to calculate and visualize distributed atomic polarizabilities based on electron density partitioning

Macchi, P.(*); Casati, N.; Evans, S. R.; Gozzo, F.; Simoncic, P.; Tiana, D. Chem. Commun. 2014, 50, 12824 - 12827 (pdf)
"Off-axis" metal-metal bond in Mn2(CO)10 at high pressure
JOURNAL COVER

Viganò, M; Ferretti, F.; Caselli, A.; Ragaini, F.; Rossi, M.; Mussini, P.; Macchi, P. Chemistry, Eur. J. 2014, 20, 14451–14464 (pdf)
Easy Entry into Reduced Ar-BIANH2 compounds. A New Class of Quinone/Hydroquinone-Type Redox Active Couples with an Easily Tunable Potential

Lanza, A.; Fiolka, C.; Fisch, M.;Casati, N.; Skoulatos, M.; Rüegg, C.; Krämer, K. Macchi, P.(*); Chem. Comm. 2014, 50, 14504-14507 (pdf)
New Magnetic Frameworks of [(CuF2(H2O)2)x(pyz)]

Dos Santos, L.; Genoni, A.; Macchi, P. Acta Cryst. Sec. A 2014, A70, 532-551 (pdf)
Unconstrained and X-ray constrained Extremely Localized Molecular Orbitals:
analysis of the reconstructed electron density
JOURNAL COVER

Calahorro,A. J.; Macchi, P. (*); Salinas-Castillo, A.; San Sebastián, E.; Seco, J. M.; Rodríguez-Diéguez, A. CrystEngComm 2014, 16, 10492-10496 (pdf)
Photoluminescence of the First Examples of Metal-Organic-Frameworks with Two Novel Tetrazolatephenyl Acetic Acid Derivatives. An Experimental and Theoretical Study.

Krawczuk, A; Macchi, P.(*) Chemistry Central Journal 2014, 8:68 (pdf)
Charge density analysis for crystal engineering

 

 

J. Hauser

Geng, Y.; Pfattner, R.; Campos, A.; Hauser, J.; Laukhin, V.; Puigdollers, J.; Veciana, J.; Mas-Torrent, M.; Rovira, C.; Decurtins, S; Liu, S.-X., Chemistry Eur. J., 2014, 20, 7136-7143
A compact tetrathiafulvalene-benzothiadiazole dyad and its highly symmetrical charge-transfer salt: Ordered donor π-stacks closely bound to their acceptors 

Amacher, A.; Luo, H.; Liu, Z.; Bircher, M.; Cascella, M.; Hauser, J.; Decurtins, S.; Zhang, D.; Liu, S.-X. RSC Advances, 2014, 4, 2873-2878
Electronic tuning effects via cyano substitution of a fused tetrathiafulvalene-benzothiadiazole dyad for ambipolar transport properties

Geng, Y.; Fiolka, C.; Krämer, K.; Hauser, J.; Laukhin, V.; Decurtins, S.; Liu, S.-X, New J. Chem., 2014, 38, 2052-2057
A quinoxaline-fused tetrathiafulvalene derivative and its semiconducting charge-transfer salt: Synthesis, crystal structures and physical properties

Botezat, O; Van Leusen, J.; Kravtsov, V.C.; Filippova, I.G.; Hauser, J.; Speldrich, M.; Hermann, R.P.; Krämer, K.W.; Liu, S.-X.; Decurtins, S.; Kögerler, P.; Baca, S.G. Cryst. Growth & Design, 2014, 14, 721-4728 (pdf)
Interpenetrated (8,3)-c and (10,3)-b metal-organic frameworks based on {FeIII 3} and {FeIII 2CoII} pivalate spin clusters

Wang, W.; Zhao, N.; Geng, Y.; Cui, S.-B.; Hauser, J.; Decurtins, S.; Liu, S.-X RSC advances, 2014, 4, 32639-32642 (pdf)
A highly sensitive TTF-functionalised probe for the determination of physiological thiols and its application in tumor cells

Zimmermann, I.; Keene, T.D.; Hauser, J.; Decurtins, S.; Liu, S.-X. Acta Cryst E, 2014, 10, 178-182 (pdf)
Crystal structures of isotypic poly[bis(benzimidazolium) [tetra-μ-iodido-stannate(II)]] and poly[bis(5,6-difluorobenzimidazolium) [tetra-μ-iodido-stannate(II)]]

Geng, Y.; Pfattner, R.; Campos, A.; Wang, W.; Jeannin, O.; Hauser, J.; Puigdollers, J.; Bromley, S. T.; Decurtins, S.; Veciana, J. Rovira, C.; Mas-Torrent, M.; Liu1, S.-X. Chemistry, Europ. J. 2014, 20, 16672-16679 (pdf)
HOMO stabilization in π-Extended Dibenzotetrathiafulvalene Derivatives for Thier Application in Organic Field-Effect transistors

 

 


Lectures / Talks

Macchi Piero, Casati Nicola, Kleppe Annette, Jephcoat. Andrew IUCr General Assembly, Montreal 4-12 August 2014
Electron density of molecular crystals at high pressure from synchrotron data
Acta Crystallographica, 2014, A70, C1340.

 

Abstracts

Ferretti, M.; Vigano, F.; Giani, R.; Ragaini, F.; Macchi, P. CoGICO, Milano Italy 24-27 June 2014
Novel Palladium-Ar-BIAN Multinuclear Complexes

Della Pergola, R.; Garlaschelli L.; Sironi, A.; Macchi, P.; Sironi, A. CoGICO, Milano Italy 24-27 June 2014
Alloying Co and As at a Molecular Level

Casati Nicola, Jephcoat Andrew, Wilhelm Heribert, Macchi Piero, IUCr General Assembly, Montreal 4-12 August 2014,
Chemical reactivity at high pressure: the ordered polymerization of oxalic acid
Acta Crystallographica, 2014, A70, C898.

 

 

Last modified 30.9.2013  Webmaster