1999
DOI: 10.1107/s010827019801436x
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3,5-Di-tert-butyl-1,2-benzoquinone

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Cited by 6 publications
(3 citation statements)
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“…S22 † ), with the average C–C distance intermediate between those typical for closed-shell catecholates and quinones. 56 , 57 Calculated structures of the complexed ligands in [4˙] + and [5˙] + are similar (Table S4 † ), with slightly longer average C–O ( ca. 1.30 Å) and shorter average C–C(ring) (1.41 Å) distances than free [DBsq˙] – (1.26 and 1.43 Å, respectively).…”
Section: Resultsmentioning
confidence: 93%
“…S22 † ), with the average C–C distance intermediate between those typical for closed-shell catecholates and quinones. 56 , 57 Calculated structures of the complexed ligands in [4˙] + and [5˙] + are similar (Table S4 † ), with slightly longer average C–O ( ca. 1.30 Å) and shorter average C–C(ring) (1.41 Å) distances than free [DBsq˙] – (1.26 and 1.43 Å, respectively).…”
Section: Resultsmentioning
confidence: 93%
“…Selected bond angles and bond distances of 2 are given in Table S2. Literature survey on the crystal structure of 3,5‐DTBQ indicates that Wen et al , isolated this compound in the form of a single crystal. Most interestingly, C−O bond distances are found in the quinone unit [C2‐O1, 1.216 Å; C1‐O2, 1.230 Å] while C−O distances are seen as C15‐O3, 1.371 Å; C16‐O4, 1.384 Å; C29‐O5, 1.371 Å, C30‐O6, 1.382 Åin two asymmetric catechol units.…”
Section: Resultsmentioning
confidence: 99%
“…The C-O distances range from 1.331( 7) to 1.366(7) Å and are elongated compared to the C-O distance in DTBQ, 1.214(3) and 1.217(3) Å; [17a, 17c] the catecholate C-C bond lengths, 1.413(8) and 1.412(9) Å, are contracted compared to the same C-C bond in DTBQ, 1.544(4) Å. [18] Taken together (Figure S10), the C-O and C-C distances are fully consistent with catecholate electronic structure.…”
Section: Attempted Four-electron Reduction Of [Crl]2mentioning
confidence: 99%