Crystallography Open Database

Information card for entry 4036526

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Coordinates	4036526.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	5 in paper
Formula	C56 H70 Cl4 O6
Calculated formula	C56 H70 Cl4 O6
Title of publication	Synthesis of Substituted Trinaphthylenes.
Authors of publication	Rüdiger, Elias C; Rominger, Frank; Steuer, Lena; Bunz, Uwe H. F.
Journal of publication	The Journal of organic chemistry
Year of publication	2016
Journal volume	81
Journal issue	1
Pages of publication	193 - 196
a	8.5192 ± 0.0007 Å
b	15.3684 ± 0.0013 Å
c	20.385 ± 0.0017 Å
α	87.9604 ± 0.0015°
β	82.649 ± 0.0014°
γ	81.3905 ± 0.0015°
Cell volume	2616.8 ± 0.4 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1203
Residual factor for significantly intense reflections	0.0644
Weighted residual factors for significantly intense reflections	0.1374
Weighted residual factors for all reflections included in the refinement	0.1649
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	Yes
Has F_obs	No

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