Crystallography Open Database

Information card for entry 8106349

Preview

Coordinates	8106349.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H47 Cd2 N7 O10
Calculated formula	C52 H47 Cd2 N7 O10
Title of publication	Crystal structure of bis(μ2-3-formyl-5-methoxy-2-oxidobenzoato-κ3 O,O′:O′)-hexapyridine-dicadmium(II) – pyridine (1/1), C53H47Cd2N7O10
Authors of publication	Niu, Xue L.; Yang, Hua
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	233
Journal issue	5
Pages of publication	927 - 929
a	9.667 ± 0.0009 Å
b	10.5089 ± 0.0011 Å
c	13.2081 ± 0.0012 Å
α	109.879 ± 0.002°
β	97.894 ± 0.001°
γ	92.201 ± 0.001°
Cell volume	1244.7 ± 0.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0612
Residual factor for significantly intense reflections	0.0388
Weighted residual factors for significantly intense reflections	0.0829
Weighted residual factors for all reflections included in the refinement	0.0926
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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