About: Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds

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About: Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds Goto Sponge NotDistinct Permalink

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rdf:type	Item
description	wetenschappelijk artikel (nl) наукова стаття, опублікована у 2012 (uk) im Januar 2012 veröffentlichter wissenschaftlicher Artikel (de)
publication date	wds:Q56880605-45EED568-358F-4C0D-BE2C-A5CD9614B4A9
publication date	2012-01-01 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q56880605-0106F3DC-4133-4B19-94FD-5D9F9053C703
language of work or name	English
cites work	wds:Q56880605-1577C637-FE80-4655-AD6B-4E6711ECF522 wds:Q56880605-34961DF5-CCDF-4809-84E0-FF8104228A45 wds:Q56880605-3962B322-E30B-4133-993F-D8244AE8B975 wds:Q56880605-46FA4656-EC9F-47E1-8CE9-AAB84A5E8446 wds:Q56880605-630A22BF-FBE2-428C-9776-392BE9F0A9D6 wds:Q56880605-8307C25F-030F-4472-AECF-F77885463777 wds:Q56880605-8838DEB5-F601-421F-BF6D-B5C39ACB52F8 wds:Q56880605-8EC3FB9B-A97F-469B-9069-E7F6B94AED71 wds:Q56880605-9E12DFB7-53B5-4D93-B41F-E4BDA7B45D58 wds:Q56880605-A265DFDD-AB87-413C-82DF-386D60F7798F wds:Q56880605-A875B0A0-144C-4347-9111-7EC5DD5A34C0 wds:Q56880605-AE05FD6C-4846-417D-89F2-F4D6BAB468AA wds:Q56880605-D04B2537-BDBC-434F-BEC0-5B32605ED827 wds:Q56880605-EF4989C2-C743-4D9E-AFE8-3F3D6C89DB2F wds:Q56880605-F2D37558-AFFD-47D8-8BFC-F51B3A61A441
cites work	COSMO: a new approach to dielectric screening in solvents with explicit expressions for the screening energy and its gradient A pirouette on a metallofullerene sphere: interconversion of isomers of N-tritylpyrrolidino I(h) Sc3N@C80. On the mechanism of action of fullerene derivatives in superoxide dismutation A new all-round density functional based on spin states and S[sub N]2 barriers The reactivity of endohedral fullerenes. What can be learnt from computational studies? Proton Affinities in Water of Maingroup-Element Hydrides – Effects of Hydration and Methyl Substitution Sc3N@C78: encapsulated cluster regiocontrol of adduct docking on an ellipsoidal metallofullerene sphere The Diels-Alder reaction on endohedral Y3N@C78: the importance of the fullerene strain energy Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc(3)N@C(80). Chemical reactivity of D3h C78 (metallo)fullerene: regioselectivity changes induced by Sc3N encapsulation Structure and enhanced reactivity rates of the D5h Sc3N@C80 and Lu3N@C80 metallofullerene isomers: the importance of the pyracylene motif Nuclear Shieldings with the SSB-D Functional Cycloaddition reactions of butadiene and 1,3-dipoles to curved arenes, fullerenes, and nanotubes: theoretical evaluation of the role of distortion energies on activation barriers Reactivity and regioselectivity of noble gas endohedral fullerenes Ng@C(60) and Ng(2)@C(60) (Ng=He-Xe). The first fulleropyrrolidine derivative of Sc3N@C80: pronounced chemical shift differences of the geminal protons on the pyrrolidine ring
author name string	wds:Q56880605-6537BF6B-A280-45A4-815E-51204FE5C008
author name string	Antonio Rodríguez-Fortea
rdfs:label	Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (en) Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (nl)
skos:prefLabel	Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (en) Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (nl)
name	Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (en) Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (nl)
author	wds:Q56880605-1AF02513-EF5E-4158-A77A-FAE9DE10F7F9 wds:Q56880605-26C2914A-E9EE-42C9-9D4D-5EDF11455D1C wds:Q56880605-EB12133E-729E-49BB-8F2F-6BFAAC1D34F4 wds:Q56880605-F5839B37-BB05-4917-A516-7344BB212E30
author	Sílvia Osuna Oliveras Josep Maria Poblet Marcel Swart Miquel Solà i Puig
title	wds:Q56880605-DF1E3F92-D958-4EB8-876A-2756F843BD2D
title	Product formation in the Prato reaction on Sc3N@D5h-C80: preference for [5,6]-bonds, and not pyracylenic bonds (en)
page(s)	wds:Q56880605-04EF79CE-0679-4735-B166-3FBA6EC06F55
page(s)	2486
instance of	wds:Q56880605-19EE2773-DC4B-4D8E-BDF0-DA9BE25D61FA
instance of	scholarly article
PubMed ID	wds:Q56880605-1AF532D0-23B6-4C35-8947-6C5BBE2223EB
PubMed ID	http://rdf.ncbi.nlm.nih.gov/pubchem/reference/22241074
PubMed ID	22241074
published in	wds:Q56880605-297568C9-A376-4D82-AC66-5D0F0D42A1C3
published in	Chemical Communications
issue	wds:Q56880605-E2AF59B9-092F-4EBE-B54F-66F0FF27E8DF
volume	wds:Q56880605-FF51EED1-E861-4652-B092-D7F3BC0657BF
issue	19
volume	48
DOI	wds:Q56880605-422F3B98-AD4E-4980-863B-5B5602E8B9C4
DOI	http://dx.doi.org/10.1039/C2CC17210K
DOI	10.1039/C2CC17210K
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q56880605
is cites work of	Current status and future developments of endohedral metallofullerenes Reactivity differences of Sc3N@C(2n) (2n = 68 and 80). Synthesis of the first methanofullerene derivatives of Sc3N@D(5h)-C80. Bingel-Hirsch addition on endohedral metallofullerenes: kinetic versus thermodynamic control A complete guide on the influence of metal clusters in the Diels-Alder regioselectivity of I(h)-C80 endohedral metallofullerenes The role of aromaticity in determining the molecular structure and reactivity of (endohedral metallo)fullerenes Electrochemical control of the regioselectivity in the exohedral functionalization of C60: the role of aromaticity Adamantylidene Addition to M3 N@Ih -C80 (M=Sc, Lu) and Sc3 N@D5h -C80 : Synthesis and Crystallographic Characterization of the [5,6]-Open and [6,6]-Open Adducts W(CO)3(Ph2PC2H4PPh2)(η(2)-Sc3N@Ih-C80/Sc3N@D5h-C80): regioselective synthesis and crystallographic characterization of air-stable mononuclear complexes of endohedral fullerenes. Full exploration of the Diels-Alder cycloaddition on metallofullerenes M3N@C80 (M = Sc, Lu, Gd): the D(5h) versus I(h) isomer and the influence of the metal cluster. Dimetallic sulfide endohedral metallofullerene Sc2S@C76: density functional theory characterization Nuclear magnetic resonance shieldings of water clusters: is it possible to reach the complete basis set limit by extrapolation?
is cites work of	wds:Q38036083-E2E72B7A-2190-4050-99DF-AB4C91D7BA19 wds:Q42688160-434A00F3-A663-4DA4-B6B1-56AC67DC12CB wds:Q39170318-1BA06ED2-7F84-4DFC-9DE9-4386AE8AD6BC wds:Q56880595-E7289095-BBD3-4628-BE4E-6346E1231E51 wds:Q30667038-6E985430-2760-4B71-BFC8-4BB02EC17493 wds:Q38211982-EDE8FF08-DCFB-4DC1-9906-3B7F484E4A17 wds:Q46020143-D0781BF5-38CB-464B-8A79-347F3841DAFA wds:Q46156832-E3DF45C0-71B1-4EB3-B677-C3DD7C93DF14 wds:Q43405856-BF0A14E9-5801-477D-B548-348872AB2AB6 wds:Q51372671-20FABA37-A772-4A75-8B21-A320ADBE521B wds:Q46046192-EC332F41-950F-4752-8FBD-9EB027F06E08

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