Crystallography Open Database

Information card for entry 4306696

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Coordinates	4306696.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C106 H90 Cl3 N28 O12 Pr
Calculated formula	C106 H89.94 Cl3 N28 O12 Pr
Title of publication	Self-Assembly of Triple Helical and meso-Helical Cylindrical Arrays Tunable by Bis-Tripodal Coordination Converters
Authors of publication	Ji-Jun Jiang; Sheng-Run Zheng; Yu Liu; Mei Pan; Wei Wang; Cheng-Yong Su
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	10692 - 10699
a	17.8881 ± 0.0005 Å
b	17.8881 ± 0.0005 Å
c	53.59 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	14850.6 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.1231
Residual factor for significantly intense reflections	0.0754
Weighted residual factors for significantly intense reflections	0.1919
Weighted residual factors for all reflections included in the refinement	0.2027
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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