Crystallography Open Database

Information card for entry 7206252

7206251 << 7206252 >> 7206253

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Coordinates	7206252.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C116 H118 Cl4 Cu4 N30 O38
Calculated formula	C116 H98 Cl4 Cu4 N30 O38
Title of publication	Structural tuning of meso-hexamer, chiral-trimer and chiral-chain by anion directed supramolecular interactions
Authors of publication	Liu, Yu; Li, Kang; Wei, Shi-Chao; Pan, Mei; Su, Cheng-Yong
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	14
Pages of publication	4564
a	24.7325 ± 0.0008 Å
b	12.9895 ± 0.0007 Å
c	20.3885 ± 0.0008 Å
α	90°
β	105.252 ± 0.004°
γ	90°
Cell volume	6319.4 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0937
Residual factor for significantly intense reflections	0.0629
Weighted residual factors for significantly intense reflections	0.1661
Weighted residual factors for all reflections included in the refinement	0.1811
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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