Crystallography Open Database

Information card for entry 7238750

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Coordinates	7238750.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H50 Ca O19 Zn2
Calculated formula	C36 H50 Ca O19 Zn2
Title of publication	Fluorescent Zn-based hetero-MOFs design via single metal site substitution
Authors of publication	Bo, Qi-Bing; Wang, Hong-Yan; Miao, Jin-Ling; Wang, Da-Qi
Journal of publication	RSC Advances
Year of publication	2012
Journal volume	2
Journal issue	31
Pages of publication	11650
a	15.7091 ± 0.0007 Å
b	21.6243 ± 0.0009 Å
c	13.2974 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	4517.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.0778
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.1415
Weighted residual factors for all reflections included in the refinement	0.1596
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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