gaussian09 revisiona.02 (Gaussian inc)
90
Structured Review
Gaussian inc
gaussian09 revisiona.02
Gaussian09 Revisiona.02, supplied by Gaussian inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/gaussian09+revisiona%2E02/gaussian09/pm40042191-219-2-3
Average 90 stars, based on 1 article reviews
Gaussian09 Revisiona.02, supplied by Gaussian inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/gaussian09+revisiona%2E02/gaussian09/pm40042191-219-2-3
Average 90 stars, based on 1 article reviews
gaussian09 revisiona.02 - by Bioz Stars,
2026-09
90/100 stars
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other:Article Title: Copper(I)-Catalyzed Chemoselective Coupling of Cyclopropanols with Diazoesters: Ring-Opening C-C Bond Formations. Article Snippet: Reported herein is an exceptional chemoselective ring-opening/C(sp) C(sp) bond formation in the copper(I)catalyzed reaction of cyclopropanols with diazo esters.. The conventional O H insertion product is essentially suppressed by judicious choice of reaction conditions.. DFT calculations provide insights into the reaction mechanism and the rationale for this unusual chemoselectivity. Article Title: Intramolecular Electron Transfer in Unsymmetric Azohetero-aromatic Radical Bridged Diruthenium(III) Set Up. Article Snippet: The article demonstrated the stabilization of MLCT excited state in structurally characterized unsymmetric N,N/N,O donating azoheteroaromatic radical bridged (acac)2Ru (μ-L3 )Ru(acac)2 (2, S=1/2) [L3= deprotonated 5-(diethylamino)-2-(6methybenzo[d] thiazol-2-yl)diazenylphenol, acac= electron rich acetylacetonate, N N(azo) distance: 1.379(4) Å] via intramolecular electron transfer (IET) at the metal-azo interface.. On the contrary, similar IET driven stabilization of MLCT excited state was failed to take place in N,N donating HL3 derived mononuclear counterpart (acac)2Ru (HL3) (1, S=0) with unperturbed azo function (N=N distance: 1.3361(18) Å) in spite of the fact of facile Ru/Ru oxidation (0.28 V versus SCE) and azo reduction ( 1.05 V versus SCE), presumably due to the influence of hydrogen bonding interaction at the back face of coordinated HL3.. On the other hand, the use of electron poor bpy (2,2’-bipyridine) as a co-ligand facilitated exclusive generation of the mononuclear [(bpy)2Ru L3]ClO4 ([3]ClO4, S=0) encompassing N,O -donating L3 with neutral azo group (N=N distance: 1.317(6) Å), unlike N,N donating HL3 in 1 due to the impact of σ-donating acac versus π-accepting bpy, which also devoided of IET step. |