Crystallography Open Database

Information card for entry 1547799

Preview

Coordinates	1547799.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H6 Al F15 O
Calculated formula	C26 H6 Al F15 O
SMILES	[Al](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)[o]1ccc2c1cccc2
Title of publication	Renewable Benzofuran Polymerization Initiated by Lewis Acid Al(C6F5)3 and Mechanism
Authors of publication	Lin, Fei; Wang, Meiyan; Cui, Dongmei
Journal of publication	Macromolecules
Year of publication	2017
Journal volume	50
Journal issue	21
Pages of publication	8449
a	10.91 ± 0.004 Å
b	12.115 ± 0.005 Å
c	18.761 ± 0.008 Å
α	80.274 ± 0.009°
β	83.225 ± 0.009°
γ	77.211 ± 0.01°
Cell volume	2375.1 ± 1.7 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1561
Residual factor for significantly intense reflections	0.0733
Weighted residual factors for significantly intense reflections	0.1741
Weighted residual factors for all reflections included in the refinement	0.2396
Goodness-of-fit parameter for all reflections included in the refinement	0.973
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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