Crystallography Open Database

Information card for entry 7133989

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Coordinates	7133989.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H4 Cd N2 O6
Calculated formula	C14 H4 Cd N2 O6
Title of publication	Efficient charge transport <i>via</i> limited π-π interactions between naphthyl carbon atoms in a metal-organic framework.
Authors of publication	Yan, Yong; Li, Zhen-Yu; Krautscheid, Harald; Zhang, Ning-Ning
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	99
Pages of publication	14862 - 14865
a	21.5322 ± 0.0009 Å
b	9.414 ± 0.0003 Å
c	7.3067 ± 0.0003 Å
α	90°
β	90.868 ± 0.003°
γ	90°
Cell volume	1480.93 ± 0.1 Å³
Cell temperature	180 K
Ambient diffraction temperature	180 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	0.0293
Residual factor for significantly intense reflections	0.0268
Weighted residual factors for significantly intense reflections	0.0669
Weighted residual factors for all reflections included in the refinement	0.0678
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54186 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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