Crystallography Open Database

Information card for entry 4505978

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Coordinates	4505978.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H21 Cd N2 O6 P
Calculated formula	C19 H21 Cd N2 O6 P
Title of publication	Temperature-Dependent Crystal Self-Assembly, Disassembly, and Reassembly Among Three Cadmium(II) Carboxylate-Phosphinates
Authors of publication	Dong, Li-Jie; Zhao, Cui-Cui; Xu, Xiang; Du, Zi-Yi; Xie, Yong-Rong; Zhang, Jian
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	4
Pages of publication	2052
a	5.6549 ± 0.0001 Å
b	22.9356 ± 0.0003 Å
c	15.8278 ± 0.0003 Å
α	90°
β	94.422 ± 0.001°
γ	90°
Cell volume	2046.73 ± 0.06 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0302
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.0605
Weighted residual factors for all reflections included in the refinement	0.0614
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	No
Has F_obs	No

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