Crystallography Open Database

Information card for entry 7233751

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Coordinates	7233751.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H26
Calculated formula	C36 H26
SMILES	c1c(c2c(c3ccccc3)c(cc(c3ccccc3)c2c2ccccc2)c2ccccc2)cccc1
Title of publication	Emission enhancement and color adjustment of silicon-cored structure in tetraphenyl benzene with aggregation-enhanced emission
Authors of publication	Hua Wang; Yan Liang; Huanling Xie; Linglong Feng; Haifeng Lu; Shengyu Feng
Journal of publication	Journal of Materials Chemistry C
Year of publication	2014
Journal volume	2
Pages of publication	5601 - 5606
a	10.355 ± 0.015 Å
b	12 ± 0.017 Å
c	12.897 ± 0.018 Å
α	63.27 ± 0.02°
β	68.47 ± 0.03°
γ	65.42 ± 0.02°
Cell volume	1269 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1857
Residual factor for significantly intense reflections	0.092
Weighted residual factors for significantly intense reflections	0.2394
Weighted residual factors for all reflections included in the refinement	0.3151
Goodness-of-fit parameter for all reflections included in the refinement	0.96
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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