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References to this Article:
J.A. Dobado, H. Martinez-Garcia, J. Molina and M.R. Sundberg
"Chemical Bonding in Hypervalent Molecules Revised. 2.
Application of the Atoms in Molecules Theory to Y2XZ and
Y2XZ2 (Y = H, F, CH3; X = O, S, Se; Z = O, S)
Compounds."
Journal of the American Chemical Society, 121, 3156-3164, (1999).
|
Huang, Zhijian; Yu, Wenbo; Lin, Zijing. First-principle studies of
gaseous aromatic amino acid histidine. Journal of Molecular
Structure (2006), 801(1-3), 7-20
Antoine, Mathias; Gand, Adeline; Boschi-Muller, Sandrine; Branlant, Guy.
Characterization of the Amino Acids from Neisseria meningitidis MsrA
Involved in the Chemical Catalysis of the Methionine Sulfoxide Reduction
Step. Journal of Biological Chemistry (2006), 281(51), 39062-39070
Zabalov, M. V.; Karlov, S. S.; Zaitseva, G. S.; Lemenovskii, D. A. The
molecular and electronic structure features of silatranes, germatranes,
and their carbon analogs. Russian Chemical Bulletin (2006), 55(3),
464-476
Bzhezovskii, V. M.; Chura, M. B.; Il'chenko, N. N. Methyl and
trifluoromethyl vinyl sulfones: Steric and electronic structure.
Russian Journal of General Chemistry (2006), 76(3), 366-375
Mericko, D.; Lehotay, J.; Skacani, I.; Armstrong, D. Effect of
temperature on retention and enantiomeric separation of chiral
sulfoxides using teicoplanin aglycone chiral stationary phase.
Journal of Liquid Chromatography & Related Technologies
(2006), 29(5), 623-638
Ibdah, Abdellatif; Espenson, James H.; Jenks, William S. Computational
Study of Sulfur Atom-Transfer Reactions from Thiiranes to ER3 (E
= As, P; R = CH3, Ph). Inorganic Chemistry (2005), 44(23),
8426-8432
Filatov, Alexander S.; Block, Eric; Petrukhina, Marina A. Dimethyl
selenoxide. Acta Crystallographica, Section C: Crystal Structure
Communications (2005), C61(10), o596-o598
Beckmann, Jens; Duthie, Andrew. Synthesis and structure of
bis(para-methoxyphenyl)selenoxide and its monohydrate. theoretical
considerations of the hydration of diorganoselenium oxides.
Zeitschrift fuer Anorganische und Allgemeine Chemie (2005), 631(10),
1849-1855
Senthilkumar, L.; Ghanty, Tapan K.; Ghosh, Swapan K. Electron Density
and Energy Decomposition Analysis in Hydrogen-Bonded Complexes
of Azabenzenes with Water, Acetamide, and Thioacetamide.
Journal of Physical Chemistry A (2005), 109(33), 7575-7582
Vidal, Isaac; Melchor, Santiago; Dobado, Jose A. On the Nature of
Metal-Carbon Bonding: AIM and ELF Analyses of MCHn (n = 1-3) Compounds
Containing Early Transition Metals. Journal of Physical Chemistry A
(2005), 109(33), 7500-7508
Chen WK, Yang YC, Li JQ, Ye ZX, Yang HJ
A theoretical study on the equilibrium structures and relative stabilities of H2SO
CHINESE J STRUC CHEM 24, 104-108, (2005).
Lee CR, Tang TH, Chen L, Wang CC, Wang Y
Topological analysis of charge density in heptasulfur imide (S7NH) from isolated molecule to solid
J PHYS CHEM SOLIDS 65, 1957-1966, (2004).
Chen WK, Yang YC, Zhang YF, Ding KN, Li JQ
A theoretical study on the structures and isomerization of H2S2
CHINESE J CHEM PHYS 17, 421-425, (2004).
Renault E, Le Questel JY
Selenoxides are better hydrogen-bond acceptors than sulfoxides: a crystallographic database and theoretical investigation
J PHYS CHEM A 108, 7232-7240, (2004).
Chen WK, Zhang YF, Ding KN, et al.
A DFT study on the structures and stabilities of halogen substitutents of H2S2
CHINESE J INORG CHEM 20, 824-828, (2004).
Sundberg, M. R. Charge distribution in coordinate bonds - important
concept in coordination chemistry. Monograph Series of the
International Conferences on Coordination Chemistry held periodically at
Smolenice in Slovakia (2003), 6(Progress in Coordination and
Bioinorganic Chemistry), 39-44
Alabugin IV, Manoharan M, Weinhold FA
Blue-shifted and red-shifted hydrogen bonds in hypervalent rare-gas FRg-H center dot center dot center dot Y sandwiches
J PHYS CHEM A 108, 4720-4730, (2004).
Lobring KC, Hao CT, Forbes JK, et al.
Bond strengths in ChCl(3)(-) and ChOCl(3)(-) (Ch = S, Se, Te): Experiment and theory
J PHYS CHEM A 107, 11153-11160, (2003).
Pepi F, Ricci A, Di Stefano M, et al.
Sulfur hexafluoride corona discharge decomposition: gas-phase ion chemistry of SOFx+ (x=1-3) ions
CHEM PHYS LETT 381, 168-176, (2003).
Dikarev EV, Becker RY, Block E, et al.
The first coordination complexes of selenones: A structural comparison with complexes of sulfones
INORG CHEM 42, 7098-7105, (2003).
Dikarev EV, Petrukhina MA, Li XJ, Block E
Small organoselenium molecules. 1. Dimethyl selenoxide:
Structure, complexation, and gas-phase transformation
INORG CHEM 42, 1966-1972, (2003).
Checinska L, Kudzin ZH, Malecka M, et al.
Physical image vs structure relation, part 10. [(Diphenoxyphosphinyl)methylidene]triphenylphosphoran - the double P+-stabilised carbanion: a crystallographic, computational and solution NMR comparative study on the ylidic bonding
TETRAHEDRON 59, 7681-7693, (2003).
Sanz P, Yanez M, Mo O
Cyclization triggered by deprotonation: The gas-phase acidity of 1,8-chalcogen-bridged naphthalenes
CHEM PHYS CHEM 4, 830-837, (2003).
Ghanty, Tapan K.; Ghosh, Swapan K. Hydrogen-Bonding Interactions in
Selected Super-molecular Systems: Electron Density Point of View.
Journal of Physical Chemistry A (2003), 107(36), 7062-7067
Lee CR, Tang TH, Chen L, et al.
A combined experimental and theoretical electron density study of intra- and intermolecular interactions in thiourea S,S-dioxide
CHEM-EUR J 9, 3112-3121, (2003).
Dikarev EV, Petrukhina MA, Li XJ, et al.
Small organoselenium molecules. 1. Dimethyl selenoxide: Structure, complexation, and gas-phase transformation
INORG CHEM 42, 1966-1972, (2003).
Mitrasinovic PM
Sharing analysis of the behavior of electrons in some simple ylides
CHEM PHYS 286, 1-13, (2003).
Sanz P, Yañez M, Mo O
1,8-Chalcogen-bridged naphthalenes. Strong carbon bases in the gas phase
NEW J CHEM 26, 1747-1752, (2002).
Ghanty, Tapan K.; Ghosh, Swapan K. Ab Initio CASSCF and DFT
Investigations of (H2O)2+ and (H2S)2+: Hemi-Bonded vs Proton-Transferred
Structure. Journal of Physical Chemistry A (2002), 106(48), 11815-11821
Liu Y, Berthod A, Mitchell CR, Xiao TL, Zhang B, Armstrong DW
Super/subcritical fluid chromatography chiral separations with macrocyclic glycopeptide stationary phases
J CHROMATOGR A 978, 185-204, (2002).
Pepi F, Ricci A, Di Stefano M, Rosi M, D'Arcangelo G
Thionyl fluoride from sulfur hexafluoride corona discharge decomposition: Gas-phase chemistry of [SOF2]H+ ions
J PHYS CHEM A 106, 9261-9266, (2002).
Haworth NL, Bacskay GB
The structure of N-delta-(N '-sulfodiaminophosphinyl)-L-ornithine
and its binding to ornithine transcarbamoylase: A quantum chemical study
MOL SIMULAT 28, 773-790, (2002).
Mitrasinovic PM
Qualitative characterization of the P-C bonds in ylides of phosphorus
J PHYS CHEM A 106, 7026-7033, (2002).
Berthod A, Xiao TL, Liu Y, Jenks WS, Armstrong DW
Separation of chiral sulfoxides by liquid chromatography using macrocyclic glycopeptide chiral stationary phases
J CHROMATOGR A 955, 53-69, (2002).
Typke V, Dakkouri M
The force field and molecular structure of dimethylsulfoxide from spectroscopic and gas electron diffraction data and ab initio calculations
J. Mol. Structure 599, 177-193, (2001).
Jenks, William S. Photochemically induced stereomutation of
sulfoxides. Spectrum (Bowling Green, OH, United States) (2001),
14(3), 1, 3-7
Wang ZX, Schleyer PvR
Are the six-membered lambda(5)-phosphorins aromatic or ylidic?
Helv. Chim. Acta 84, 1578-1600, (2001).
Cubbage JW, Jenks WS
Computational studies of the ground and excited state potentials of DMSO and H2SO: Relevance to photostereomutation
J. Phys. Chem. A105, 10588-10595 (2001).
Cubbage JW, Guo YS, McCulla RD, Jenks WS
Thermolysis of alkyl sulfoxides and derivatives: A comparison of experiment and theory
J. Org. Chem.66, 8722-8736 (2001).
Minkin-VI Minyaev-RM
Cyclic Aromatic Systems with Hypervalent Centers
Chem. Rev.101, 1247-1265 (2001).
Deubel-DV
Thianthrene 5-Oxide as a Probe for the Electronic Character of
Oxygen-Transfer Reactions - Reinterpretation of Experiments Required
J. Org. Chem.66, 2686-2691 (2001).
Popelier, P. L. A.; Aicken, F. M.; O'Brien, S. E. Atoms in molecules.
Chemical Modelling (2000), 1 143-198
Rozas-I Alkorta-I Elguero-J
Behavior of Ylides Containing N, O, and C Atoms as Hydrogen-Bond Acceptors
J. Am. Chem. Soc.122, 11154-11161 (2000).
Groves-C Lewars-E
Dimers, Trimers and Oligomers of Sulfur-Oxides -
An Ab-Initio and Density-Functional Study
J. Mol. Structure-THEOCHEM 530, 265-279 (2000).
Dobado JA, Molina JM, Uggla R, et al.
Multiple bonding in four-coordinated titanium(IV) compounds
INORG CHEM 39, 2831-2836 (2000).
Dobado JA, Martinez-Garcia H, Molina JM, et al.
Chemical bonding in hypervalent molecules revised. 3. Application of the atoms in molecules theory to Y3X-CH2 (X = N, P, or As ; Y = H or F] and H2X-GH(2) (X = O, S, or Se) ylides
J AM CHEM SOC 122, 1144-1149 (2000).
El-Bergmi R, Dobado JA, Portal D, et al.
Stabilization in neutral bicyclic sulfoxide compounds
J COMPUT CHEM 21, 322-327 (2000).
Dobado JA, Martinez-Garcia H, Molina JM
Theoretical bonding description of alkylidene chalcogen (O, S, Se) difluorides (H2C=XF2): Planar versus bent conformations
INORG CHEM 38, 6257-6260 (1999).
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