Crystallography Open Database

Information card for entry 7231182

Preview

Coordinates	7231182.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H24 Cd N6 O12
Calculated formula	C38 H24 Cd N6 O12
Title of publication	The influence of the secondary building linker geometry on the photochromism of naphthalenediimide-based metal‒organic frameworks
Authors of publication	Fu, Chen; Wang, Hai-Yu; Zhang, Guo-Shuai; Li, Li; Sun, Ya-Nan; Fu, Jia-Wei; Zhang, Hong
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	33
Pages of publication	4849
a	26.906 ± 0.004 Å
b	7.5367 ± 0.0009 Å
c	17.21 ± 0.002 Å
α	90°
β	92.375 ± 0.004°
γ	90°
Cell volume	3486.9 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
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	0.0742
Residual factor for significantly intense reflections	0.044
Weighted residual factors for significantly intense reflections	0.0873
Weighted residual factors for all reflections included in the refinement	0.0975
Goodness-of-fit parameter for all reflections included in the refinement	0.99
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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