Crystallography Open Database

Information card for entry 4032423

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Structure parameters

Formula	C24 H19 F O2
Calculated formula	C24 H19 F O2
SMILES	Fc1ccc(c2c3c(cc(c4ccccc4)cc3)c(OC)c(OC)c2)cc1
Title of publication	Synthesis of Substituted 1,6-Diarylnaphthalenes via a Tandem Claisen Rearrangement and Ene Reaction Protocol.
Authors of publication	Chan, Chieh-Kai; Chen, Yu-Hsin; Tsai, Yu-Lin; Chang, Meng-Yang
Journal of publication	The Journal of organic chemistry
Year of publication	2017
Journal volume	82
Journal issue	6
Pages of publication	3317 - 3326
a	53.153 ± 0.006 Å
b	5.7648 ± 0.0006 Å
c	26.264 ± 0.003 Å
α	90°
β	116.484 ± 0.003°
γ	90°
Cell volume	7203.2 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0659
Residual factor for significantly intense reflections	0.0414
Weighted residual factors for significantly intense reflections	0.088
Weighted residual factors for all reflections included in the refinement	0.0996
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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