Crystallography Open Database

Information card for entry 7233771

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Coordinates	7233771.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H24 O3
Calculated formula	C36 H24 O3
Title of publication	Substitution degree engineering the crystal packing and optoelectronic properties of benzofuranvinyl-substituted benzene-cored derivatives
Authors of publication	Jin-Xing Qiu; Ye-Xin Li; Xiao-Feng Yang; Yong Nie; Zhen-Wei Zhang; Zhong-He Chen; Guo-Xin Sun
Journal of publication	Journal of Materials Chemistry C
Year of publication	2014
Journal volume	2
Pages of publication	5954 - 5962
a	4.30313 ± 0.00016 Å
b	23.6764 ± 0.0009 Å
c	25.1955 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	2566.98 ± 0.16 Å³
Cell temperature	174 ± 70 K
Ambient diffraction temperature	174 ± 70 K
Number of distinct elements	3
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1454
Residual factor for significantly intense reflections	0.0985
Weighted residual factors for significantly intense reflections	0.2492
Weighted residual factors for all reflections included in the refinement	0.2878
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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