Crystallography Open Database

Information card for entry 7234260

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Coordinates	7234260.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H16
Calculated formula	C26 H16
SMILES	c1cccc2cc3cccc(c3cc12)C#Cc1ccc2ccccc2c1
Title of publication	The position effect of an ethynyl spacer on the carrier mobility of anthracene derivatives
Authors of publication	Xiaotao Zhang; Guangyao Zhao; Yonggang Zhen; Zeyi Tu; Ping He; Yuanping Yi; Huanli Dong; Wenping Hu
Journal of publication	Journal of Materials Chemistry C
Year of publication	2015
Journal volume	3
Pages of publication	5368 - 5371
a	4.888 ± 0.001 Å
b	23.378 ± 0.005 Å
c	15.437 ± 0.003 Å
α	90°
β	94.07 ± 0.03°
γ	90°
Cell volume	1759.6 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	2
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0748
Residual factor for significantly intense reflections	0.0667
Weighted residual factors for significantly intense reflections	0.1555
Weighted residual factors for all reflections included in the refinement	0.1599
Goodness-of-fit parameter for all reflections included in the refinement	1.276
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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