Crystallography Open Database

Information card for entry 7107371

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Structure parameters

Formula	C51 H71 N3 O15
Calculated formula	C51 H71 N3 O15
Title of publication	Le Aromatic Oligoamide Macrocycles with Drastically Changed Behavior
Authors of publication	Xiangxiang Wu; Guoxing Liang; Gang Ji; Hoong-Kun Fun; Lan He; Bing Gong
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	2228
a	13.8349 ± 0.0005 Å
b	14.3436 ± 0.0005 Å
c	15.2208 ± 0.0004 Å
α	75.917 ± 0.002°
β	86.728 ± 0.002°
γ	66.006 ± 0.002°
Cell volume	2673.52 ± 0.16 Å³
Cell temperature	271 ± 2 K
Ambient diffraction temperature	271 ± 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	0.1661
Residual factor for significantly intense reflections	0.0819
Weighted residual factors for significantly intense reflections	0.2362
Weighted residual factors for all reflections included in the refinement	0.3087
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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