1995
DOI: 10.1021/ja00109a012
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A New Metastable Three-Dimensional Bismuth Sulfide with Large Tunnels: Synthesis, Structural Characterization, Ion-Exchange Properties, and Reactivity of KBi3S5

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Cited by 116 publications
(55 citation statements)
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“…This coupling constant almost corresponds to sp hybridization of the C atom in this bond (the exact value is sp 1.15 ). [8] A PM3 calculation, combined with an NBO analysis, [9] provided a hybridization of sp 1.23 . This unprecedented result can also be reached qualitatively by applying Bents rules: [10] The carbon atom bridging the sixmembered rings in 4 (ªbridging C atomº) has two strongly electronegative substituents (the N centers), which should induce a higher p character in the C hybrid orbitals associated with them.…”
Section: Communicationsmentioning
confidence: 99%
See 1 more Smart Citation
“…This coupling constant almost corresponds to sp hybridization of the C atom in this bond (the exact value is sp 1.15 ). [8] A PM3 calculation, combined with an NBO analysis, [9] provided a hybridization of sp 1.23 . This unprecedented result can also be reached qualitatively by applying Bents rules: [10] The carbon atom bridging the sixmembered rings in 4 (ªbridging C atomº) has two strongly electronegative substituents (the N centers), which should induce a higher p character in the C hybrid orbitals associated with them.…”
Section: Communicationsmentioning
confidence: 99%
“…The 1 H ± 13 C coupling constant of 170.65 Hz for the geminal C À H bonds corresponds to sp 1.93 hybridization in these bonds, which is highly unusual for a saturated C atom. [8] Salt 4-Br was deprotonated to the neutral species 5 in a fast and quantitative reaction with KOtBu in THF at À 30 8C (Scheme 2). Under these reaction conditions, 5 was stable for several hours.…”
Section: Communicationsmentioning
confidence: 99%
“…This class of compounds has proven to be remarkably large and has contributed many complex compositions and structures favorable for high thermoelectric performance [3], e.g., K 2.5 Bi 8.5 Se 14 [4], β-K 2 Bi 8 Se 13 [4], A 2 Bi 8 Se 13 (A = Rb, Cs) [5], and CsBi 4 Te 6 [6]. In comparison to selenides and tellurides, most of the alkali-metal bismuth sulfides exhibit wide energy band gaps and strong ionic interactions between the alkali-metal ions and the [Bi x S y ] z-framework, e.g., in β-and γ-CsBiS 2 [7], γ-RbBi 3 S 5 [8], and KBi 3 S 5 [9]. Because of these characteristics, further compounds of this class are sought after.…”
Section: Introductionmentioning
confidence: 99%
“…5,6 Furthermore, fundamental interest in these compounds is growing due to their structural diversity they exhibit. For example, the compounds of a general formula of ABi 3 Q 5 (A=K, Rb, Cs; Q=S, Se, Te) [7][8][9][10][11] are known to have six different structure types. The polymorphism is made possible by subtle changes in the edge-sharing modes between the infinite BiQ 6 (Q=S, Se) octahedral chains found in the frameworks.…”
mentioning
confidence: 99%