Crystallography Open Database

Information card for entry 4107694

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Coordinates	4107694.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H87 N O38
Calculated formula	C51 H54 N O38
Title of publication	Switching between Supramolecular Dimer and Nonthreaded Supramolecular Self-Assembly of Stilbene Amide-α-Cyclodextrin by Photoirradiation
Authors of publication	Kazuhiro Yamauchi; Yoshinori Takashima; Akihito Hashidzume; Hiroyasu Yamaguchi; Akira Harada
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	5024 - 5025
a	19.3707 ± 0.0004 Å
b	19.3707 ± 0.0004 Å
c	32.1948 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	12080.3 ± 0.4 Å³
Cell temperature	93.1 K
Number of distinct elements	4
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for significantly intense reflections	0.1193
Weighted residual factors for all reflections included in the refinement	0.3416
Goodness-of-fit parameter for all reflections included in the refinement	1.202
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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