Chiral Au22(SR)17-: A new ligand-binding strategy for structural prediction of thiolate-protected gold nanocluster

Wen Wu Xu; Dongdong Lin; Jie Fu; Wenhui Zhao; Xiangmei Duan; Xiao Cheng Zeng

doi:10.1039/d0cc00134a

Chiral Au₂₂(SR)₁₇^-: A new ligand-binding strategy for structural prediction of thiolate-protected gold nanocluster

Wen Wu Xu, Dongdong Lin, Jie Fu, Wenhui Zhao, Xiangmei Duan, Xiao Cheng Zeng

Chemistry

Research output: Contribution to journal › Article › peer-review

3 Scopus citations

Abstract

A new atomic structure of chiral thiolate-protected gold nanocluster Au₂₂(SR)₁₇^- is predicted on the basis of the new ligand-binding strategy, namely, redistributing the Au-S "staple" motifs on the well-known Au₁₀ core from previously laboratory-determined Au₂₁(SR)₁₅ crystal structure. Density functional theory calculations show that this structure is very likely the realistic structure for the synthesized Au₂₂(SR)₁₇^-

Original language	English (US)
Pages (from-to)	2995-2998
Number of pages	4
Journal	Chemical Communications
Volume	56
Issue number	20
DOIs	https://doi.org/10.1039/d0cc00134a
State	Published - Mar 11 2020

ASJC Scopus subject areas

Catalysis
Electronic, Optical and Magnetic Materials
Ceramics and Composites
Chemistry(all)
Surfaces, Coatings and Films
Metals and Alloys
Materials Chemistry

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title = "Chiral Au22(SR)17-: A new ligand-binding strategy for structural prediction of thiolate-protected gold nanocluster",

abstract = "A new atomic structure of chiral thiolate-protected gold nanocluster Au22(SR)17- is predicted on the basis of the new ligand-binding strategy, namely, redistributing the Au-S {"}staple{"} motifs on the well-known Au10 core from previously laboratory-determined Au21(SR)15 crystal structure. Density functional theory calculations show that this structure is very likely the realistic structure for the synthesized Au22(SR)17-",

author = "Xu, {Wen Wu} and Dongdong Lin and Jie Fu and Wenhui Zhao and Xiangmei Duan and Zeng, {Xiao Cheng}",

note = "Funding Information: WWX, DL, JF, and XD are supported by Natural Science Foundation of China (11974195, 11804174, 11804175, and 11874033) and K. C. Wong Magna Fund in Ningbo University. WWX acknowledges computational support from National Supercomputing Center in Guangzhou (NSCC-GZ) and XCZ is supported by University of Nebraska Holland Computing Center. The authors thank Prof. T. Pradeep of Indian Institute of Technology for providing experimental spectral data. Publisher Copyright: {\textcopyright} 2020 The Royal Society of Chemistry.",

year = "2020",

month = mar,

day = "11",

doi = "10.1039/d0cc00134a",

language = "English (US)",

volume = "56",

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journal = "Chemical Communications",

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publisher = "Royal Society of Chemistry",

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T1 - Chiral Au22(SR)17-

T2 - A new ligand-binding strategy for structural prediction of thiolate-protected gold nanocluster

AU - Xu, Wen Wu

AU - Lin, Dongdong

AU - Fu, Jie

AU - Zhao, Wenhui

AU - Duan, Xiangmei

AU - Zeng, Xiao Cheng

N1 - Funding Information: WWX, DL, JF, and XD are supported by Natural Science Foundation of China (11974195, 11804174, 11804175, and 11874033) and K. C. Wong Magna Fund in Ningbo University. WWX acknowledges computational support from National Supercomputing Center in Guangzhou (NSCC-GZ) and XCZ is supported by University of Nebraska Holland Computing Center. The authors thank Prof. T. Pradeep of Indian Institute of Technology for providing experimental spectral data. Publisher Copyright: © 2020 The Royal Society of Chemistry.

PY - 2020/3/11

Y1 - 2020/3/11

N2 - A new atomic structure of chiral thiolate-protected gold nanocluster Au22(SR)17- is predicted on the basis of the new ligand-binding strategy, namely, redistributing the Au-S "staple" motifs on the well-known Au10 core from previously laboratory-determined Au21(SR)15 crystal structure. Density functional theory calculations show that this structure is very likely the realistic structure for the synthesized Au22(SR)17-

AB - A new atomic structure of chiral thiolate-protected gold nanocluster Au22(SR)17- is predicted on the basis of the new ligand-binding strategy, namely, redistributing the Au-S "staple" motifs on the well-known Au10 core from previously laboratory-determined Au21(SR)15 crystal structure. Density functional theory calculations show that this structure is very likely the realistic structure for the synthesized Au22(SR)17-

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Chiral Au₂₂(SR)₁₇^-: A new ligand-binding strategy for structural prediction of thiolate-protected gold nanocluster

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