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Statements

Subject Item
n2:RIV%2F61388963%3A_____%2F12%3A00383692%21RIV13-AV0-61388963
rdf:type
skos:Concept n6:Vysledek
dcterms:description
The syntheses of all 16 CB11(CH3)(n)(CD3)(12-n)(center dot) radicals with 5-fold substitution symmetry are described. The variation in the width of their broad and featureless electron paramagnetic resonance signals as a function of the deuteriation pattern is used to deduce the relative values of the average hyperfine coupling constants a(H) of the hydrogen atoms in the ipso (1), ortho (2-6), meta (7-11), and para (12) methyl groups, a(H)(i):a(H)(o):a(H)(m):a(H)(p) = (0.18 +/- 0.09):(0.71 +/- 0.02):(1.00 +/- 0.03):(0.52 +/- 0.05), and these can be compared with ratios expected from a B3LYP/EPRII calculation, 0.04:0.55:1:0.51. The syntheses of all 16 CB11(CH3)(n)(CD3)(12-n)(center dot) radicals with 5-fold substitution symmetry are described. The variation in the width of their broad and featureless electron paramagnetic resonance signals as a function of the deuteriation pattern is used to deduce the relative values of the average hyperfine coupling constants a(H) of the hydrogen atoms in the ipso (1), ortho (2-6), meta (7-11), and para (12) methyl groups, a(H)(i):a(H)(o):a(H)(m):a(H)(p) = (0.18 +/- 0.09):(0.71 +/- 0.02):(1.00 +/- 0.03):(0.52 +/- 0.05), and these can be compared with ratios expected from a B3LYP/EPRII calculation, 0.04:0.55:1:0.51.
dcterms:title
The 16 CB11(CH3)(n)(CD3)(12-n)(center dot) Radicals with 5-Fold Substitution Symmetry: Spin Density Distribution in CB11Me12 center dot The 16 CB11(CH3)(n)(CD3)(12-n)(center dot) Radicals with 5-Fold Substitution Symmetry: Spin Density Distribution in CB11Me12 center dot
skos:prefLabel
The 16 CB11(CH3)(n)(CD3)(12-n)(center dot) Radicals with 5-Fold Substitution Symmetry: Spin Density Distribution in CB11Me12 center dot The 16 CB11(CH3)(n)(CD3)(12-n)(center dot) Radicals with 5-Fold Substitution Symmetry: Spin Density Distribution in CB11Me12 center dot
skos:notation
RIV/61388963:_____/12:00383692!RIV13-AV0-61388963
n6:predkladatel
n7:ico%3A61388963
n3:aktivita
n5:P n5:I
n3:aktivity
I, P(GC203/09/J058)
n3:cisloPeriodika
20
n3:dodaniDat
n8:2013
n3:domaciTvurceVysledku
n4:3603652 Michl, Josef n4:3189856 n4:7553099
n3:druhVysledku
n18:J
n3:duvernostUdaju
n11:S
n3:entitaPredkladatele
n13:predkladatel
n3:idSjednocenehoVysledku
183282
n3:idVysledku
RIV/61388963:_____/12:00383692
n3:jazykVysledku
n17:eng
n3:klicovaSlova
anion; oxidation; polymerization; isobutylene; carboranes; CB11Me12
n3:klicoveSlovo
n9:polymerization n9:CB11Me12 n9:anion n9:oxidation n9:isobutylene n9:carboranes
n3:kodStatuVydavatele
US - Spojené státy americké
n3:kontrolniKodProRIV
[A3B964C19D39]
n3:nazevZdroje
Inorganic Chemistry
n3:obor
n12:CC
n3:pocetDomacichTvurcuVysledku
4
n3:pocetTvurcuVysledku
5
n3:projekt
n15:GC203%2F09%2FJ058
n3:rokUplatneniVysledku
n8:2012
n3:svazekPeriodika
51
n3:tvurceVysledku
Kaleta, Jiří Akdag, A. Pohl, Radek Michl, Josef Tarábek, Ján
n3:wos
000309739100038
s:issn
0020-1669
s:numberOfPages
6
n19:doi
10.1021/ic301236s