Crystallography Open Database

Information card for entry 7215309

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Coordinates	7215309.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H48 Co3 N6 O14 S3
Calculated formula	C50 H48 Co3 N6 O14 S3
Title of publication	A new 8-connected porous coordination polymer: crystal structure and selective adsorption properties
Authors of publication	Zou, Hua-Hong; He, Yan-Ping; Gui, Liu-Cheng; Liang, Fu-Pei
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	10
Pages of publication	3325
a	16.744 ± 0.006 Å
b	15.092 ± 0.006 Å
c	22.518 ± 0.008 Å
α	90°
β	90°
γ	90°
Cell volume	5690 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	54
Hermann-Mauguin space group symbol	P c c a
Hall space group symbol	-P 2a 2ac
Residual factor for all reflections	0.1027
Residual factor for significantly intense reflections	0.0825
Weighted residual factors for significantly intense reflections	0.2235
Weighted residual factors for all reflections included in the refinement	0.2415
Goodness-of-fit parameter for all reflections included in the refinement	1.121
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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