Crystallography Open Database

Information card for entry 7224400

Preview

Coordinates	7224400.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H14 Cd K N3 O10
Calculated formula	C9 H14 Cd K N3 O10
Title of publication	Alkaline reagent-induced structural diversity of four metal‒organic frameworks based on a flexible bicarboxylate ligand
Authors of publication	Bai, Yue-Ling; Xu, Liangzhen; Bao, Xiaoli; Hou, Chaoyi; Zhao, Yongmei; Zhu, Shourong
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	13
Pages of publication	2347
a	8.5713 ± 0.0017 Å
b	9.793 ± 0.002 Å
c	9.91 ± 0.002 Å
α	97.99 ± 0.03°
β	90.62 ± 0.03°
γ	112.72 ± 0.03°
Cell volume	757.9 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0319
Residual factor for significantly intense reflections	0.0288
Weighted residual factors for significantly intense reflections	0.0677
Weighted residual factors for all reflections included in the refinement	0.0699
Goodness-of-fit parameter for all reflections included in the refinement	0.928
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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