Goar Sanchez
Goar Sanchez
Computational Scientist, Irish Centre for High-End Computing
Verifierad e-postadress på ichec.ie - Startsida
Titel
Citeras av
Citeras av
År
Structures, Energies, Bonding, and NMR Properties of Pnicogen Complexes H2XP:NXH2 (X  H, CH3, NH2, OH, F, Cl)
JE Del Bene, I Alkorta, G Sanchez-Sanz, J Elguero
The Journal of Physical Chemistry A 115 (46), 13724-13731, 2011
1522011
31P–31P spin–spin coupling constants for pnicogen homodimers
JE Del Bene, I Alkorta, G Sanchez-Sanz, J Elguero
Chemical Physics Letters 512 (4-6), 184-187, 2011
1142011
Influence of hydrogen bonds on the P··· P pnicogen bond
I Alkorta, G Sánchez-Sanz, J Elguero, JE Del Bene
Journal of Chemical Theory and Computation 8 (7), 2320-2327, 2012
942012
Intermolecular weak interactions in HTeXH dimers (X= O, S, Se, Te): Hydrogen bonds, chalcogen–chalcogen contacts and chiral discrimination
G Sánchez‐Sanz, C Trujillo, I Alkorta, J Elguero
ChemPhysChem 13 (2), 496, 2012
942012
Interplay of F–H...F Hydrogen Bonds and P...N Pnicogen Bonds
JE Del Bene, I Alkorta, G Sánchez-Sanz, J Elguero
The Journal of Physical Chemistry A 116 (36), 9205-9213, 2012
872012
Structures, Binding Energies, and Spin–Spin Coupling Constants of Geometric Isomers of Pnicogen Homodimers (PHFX)2, X = F, Cl, CN, CH3, NC
JE Del Bene, I Alkorta, G Sanchez-Sanz, J Elguero
The Journal of Physical Chemistry A 116 (11), 3056-3060, 2012
762012
Competition and Interplay between σ-Hole and π-Hole Interactions: A Computational Study of 1:1 and 1:2 Complexes of Nitryl Halides (O2NX) with Ammonia
M Solimannejad, V Ramezani, C Trujillo, I Alkorta, G Sánchez-Sanz, ...
The Journal of Physical Chemistry A 116 (21), 5199-5206, 2012
752012
Exploring (NH2F)2, H2FP:NFH2, and (PH2F)2 Potential Surfaces: Hydrogen Bonds or Pnicogen Bonds?
I Alkorta, G Sánchez-Sanz, J Elguero, JE Del Bene
The Journal of Physical Chemistry A 117 (1), 183-191, 2013
742013
Theoretical study of the HXYH dimers (X, Y= O, S, Se). Hydrogen bonding and chalcogen–chalcogen interactions
G Sanchez-Sanz, I Alkorta, J Elguero
Molecular Physics 109 (21), 2543-2552, 2011
742011
Orthogonal interactions between nitryl derivatives and electron donors: pnictogen bonds
G Sánchez-Sanz, C Trujillo, M Solimannejad, I Alkorta, J Elguero
Physical Chemistry Chemical Physics 15 (34), 14310-14318, 2013
692013
Phosphorus as a simultaneous electron-pair acceptor in intermolecular P··· N pnicogen bonds and electron-pair donor to Lewis acids
JE Del Bene, I Alkorta, G Sánchez-Sanz, J Elguero
The Journal of Physical Chemistry A 117 (14), 3133-3141, 2013
622013
Pnicogen Bonds between XPH3 (X = O, S, NH, CH2) and Phosphorus and Nitrogen Bases
I Alkorta, G Sánchez-Sanz, J Elguero, JE Del Bene
The Journal of Physical Chemistry A 118 (8), 1527-1537, 2014
612014
Homo-and heterochiral dimers (PHFX) 2, X= Cl, CN, CH3, NC: To what extent do they differ?
JE Del Bene, G Sanchez-Sanz, I Alkorta, J Elguero
Chemical Physics Letters 538, 14-18, 2012
562012
Intramolecular pnicogen interactions in phosphorus and arsenic analogues of proton sponges
G Sánchez-Sanz, C Trujillo, I Alkorta, J Elguero
Physical Chemistry Chemical Physics 16 (30), 15900-15909, 2014
472014
FCl: PCX complexes: Old and new types of halogen bonds
I Alkorta, G Sanchez-Sanz, J Elguero, JE Del Bene
The Journal of Physical Chemistry A 116 (9), 2300-2308, 2012
452012
-doped : Electronic structure of impurity states and impurity-trapped excitons
G Sánchez-Sanz, L Seijo, Z Barandiarán
The Journal of chemical physics 133 (11), 114509, 2010
442010
Intramolecular Pnicogen Interactions in PHFÀ (CH2) nÀPHF (n= 2–6) Systems
G Sµnchez-Sanz, I Alkorta, C Trujillo, JØ Elguero
402013
Halogen, chalcogen and pnictogen interactions in (XNO 2) 2 homodimers (X= F, Cl, Br, I)
C Trujillo, G Sánchez-Sanz, I Alkorta, J Elguero
New Journal of Chemistry 39 (9), 6791-6802, 2015
392015
Weak interactions between hypohalous acids and dimethylchalcogens
G Sanchez-Sanz, C Trujillo, I Alkorta, J Elguero
Physical Chemistry Chemical Physics 14 (28), 9880-9889, 2012
382012
In vitro and in vivo investigations into the carbene gold chloride and thioglucoside anticancer drug candidates NHC-AuCl and NHC-AuSR
W Walther, O Dadac, C Beirnec, I Ott, G Sánchez-Sanz, C Schmidt, ...
Letters in Drug Design & Discovery 14 (2), 125-134, 2017
36*2017
Systemet kan inte utföra åtgärden just nu. Försök igen senare.
Artiklar 1–20