Crystallography Open Database

Information card for entry 7106714

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Coordinates	7106714.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H48 Cl2 F6 N10 O16
Calculated formula	C46 H48 Cl2 F6 N10 O16
Title of publication	Reassembly self-sorting triggered by heterodimerization
Authors of publication	Liping Cao; Jun-Gang Wang; Jiao-Yang Ding; Anxin Wu; Lyle Isaacs
Journal of publication	Chem.Commun.
Year of publication	2011
Journal volume	47
Pages of publication	8548
a	31.26 ± 0.011 Å
b	13.333 ± 0.005 Å
c	27.209 ± 0.01 Å
α	90°
β	112.158 ± 0.006°
γ	90°
Cell volume	10503 ± 7 Å³
Cell temperature	292 ± 2 K
Ambient diffraction temperature	292 ± 2 K
Number of distinct elements	6
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	0.1271
Residual factor for significantly intense reflections	0.0705
Weighted residual factors for significantly intense reflections	0.1929
Weighted residual factors for all reflections included in the refinement	0.2233
Goodness-of-fit parameter for all reflections included in the refinement	0.986
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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