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Merck
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重要文件

900854

Sigma-Aldrich

FBR

同義詞:

5,5′-[(9,9-Dioctyl-9H-fluorene-2,7-diyl)bis(2,1,3-benzothiadiazole-7,4-diylmethylidyne)]bis[3-ethyl-2-thioxo-4-thiazolidinone]

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About This Item

經驗公式(希爾表示法):
C53H56N6O2S6
CAS號碼:
分子量::
1001.44
MDL號碼:
分類程式碼代碼:
12352101
NACRES:
NA.23

描述

Band gap: 1.59 eV

品質等級

化驗

≥97%

形狀

solid

溶解度

chlorobenzene: soluble
chloroform: soluble
dichlorobenzene: soluble

軌道能量

HOMO -5.61 eV 
LUMO -4.02 eV 

SMILES 字串

S1\C(=C/c2c3n[s]nc3c(cc2)c4cc5c(cc4)c6c(cc(cc6)c7c8n[s]nc8c(cc7)\C=C9/SC(=S)N(C/9=O)CC)C5(CCCCCCCC)CCCCCCCC)\C(=O)N(C1=S)CC

InChI

1S/C53H56N6O2S6/c1-5-9-11-13-15-17-27-53(28-18-16-14-12-10-6-2)41-29-33(37-23-21-35(45-47(37)56-66-54-45)31-43-49(60)58(7-3)51(62)64-43)19-25-39(41)40-26-20-34(30-42(40)53)38-24-22-36(46-48(38)57-67-55-46)32-44-50(61)59(8-4)52(63)65-44/h19-26,29-32H,5-18,

InChI 密鑰

OLBOENQKGKQCJD-XOTMQJHLSA-N

儲存類別代碼

11 - Combustible Solids

水污染物質分類(WGK)

WGK 3

閃點(°F)

Not applicable

閃點(°C)

Not applicable


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分析證明 (COA)

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Sarah Holliday et al.
Journal of the American Chemical Society, 137(2), 898-904 (2014-12-30)
A novel small molecule, FBR, bearing 3-ethylrhodanine flanking groups was synthesized as a nonfullerene electron acceptor for solution-processed bulk heterojunction organic photovoltaics (OPV). A straightforward synthesis route was employed, offering the potential for large scale preparation of this material. Inverted
Derya Baran et al.
Nature materials, 16(3), 363-369 (2016-11-22)
Technological deployment of organic photovoltaic modules requires improvements in device light-conversion efficiency and stability while keeping material costs low. Here we demonstrate highly efficient and stable solar cells using a ternary approach, wherein two non-fullerene acceptors are combined with both

文章

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