Crystallography Open Database

Information card for entry 7054115

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Coordinates	7054115.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H25 Cd0.5 N6 O7 S
Calculated formula	C24 H25 Cd0.5 N6 O7 S
Title of publication	A metal‒organic framework gel with Cd2+ derived from only coordination bonds without intermolecular interactions and its catalytic ability
Authors of publication	Lee, Hyo Hee; Jung, Sung Ho; Park, Sunhong; Park, Ki-Min; Jung, Jong Hwa
Journal of publication	New Journal of Chemistry
Year of publication	2013
Journal volume	37
Journal issue	8
Pages of publication	2330
a	15.7778 ± 0.0004 Å
b	14.6264 ± 0.0004 Å
c	29.5827 ± 0.0007 Å
α	90°
β	97.554 ± 0.001°
γ	90°
Cell volume	6767.6 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
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	0.0366
Residual factor for significantly intense reflections	0.0322
Weighted residual factors for significantly intense reflections	0.0845
Weighted residual factors for all reflections included in the refinement	0.0865
Goodness-of-fit parameter for all reflections included in the refinement	1.099
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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