Crystallography Open Database

Information card for entry 7105141

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Coordinates	7105141.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C108 H96 Co8 N14 O31
Calculated formula	C108 H72 Co8 N14 O30.96
Title of publication	Porous ionic/molecular crystal composed of highly symmetric magnetic clusters.
Authors of publication	Cheng, Xiao-Ning; Xue, Wei; Lin, Jian-Bin; Chen, Xiao-Ming
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2009
Journal volume	46
Journal issue	2
Pages of publication	246 - 248
a	27.769 ± 0.001 Å
b	27.769 ± 0.001 Å
c	27.769 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	21413.2 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	227
Hermann-Mauguin space group symbol	F d -3 m :2
Hall space group symbol	-F 4vw 2vw 3
Residual factor for all reflections	0.0662
Residual factor for significantly intense reflections	0.0523
Weighted residual factors for significantly intense reflections	0.1463
Weighted residual factors for all reflections included in the refinement	0.1575
Goodness-of-fit parameter for all reflections included in the refinement	1.085
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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