Crystallography Open Database

Information card for entry 4348604

Preview

Coordinates	4348604.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H15 Cd0.5 N2 O4
Calculated formula	C15 H15 Cd0.5 N2 O4
Title of publication	Structural Diversity of Cadmium(II) Coordination Polymers Induced by Tuning the Coordination Sites of Isomeric Ligands.
Authors of publication	Liu, Bo; Zhou, Hui-Fang; Hou, Lei; Wang, Jian-Ping; Wang, Yao-Yu; Zhu, Zhonghua
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	17
Pages of publication	8871 - 8880
a	18.6345 ± 0.0019 Å
b	18.6345 ± 0.0019 Å
c	21.563 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	6484.5 ± 1.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	178
Hermann-Mauguin space group symbol	P 61 2 2
Hall space group symbol	P 61 2 (0 0 5)
Residual factor for all reflections	0.0979
Residual factor for significantly intense reflections	0.0725
Weighted residual factors for significantly intense reflections	0.1957
Weighted residual factors for all reflections included in the refinement	0.2117
Goodness-of-fit parameter for all reflections included in the refinement	0.987
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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