Crystallography Open Database

Information card for entry 1562144

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Coordinates	1562144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H27 Cd N7 O8
Calculated formula	C20 H27 Cd N7 O8
Title of publication	Five chiral Cd(II) complexes with dual chiral components: Effect of positional isomerism, luminescence and SHG response
Authors of publication	Cheng, Lin; Wang, Jun; Yu, Hai-Yan; Zhang, Xiu-Ying; Gou, Shao-Hua; Fang, Lei
Journal of publication	Journal of Solid State Chemistry
Year of publication	2015
Journal volume	221
Pages of publication	85 - 94
a	10.864 ± 0.0014 Å
b	12.6272 ± 0.0015 Å
c	19.317 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	2649.9 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0509
Residual factor for significantly intense reflections	0.0424
Weighted residual factors for significantly intense reflections	0.1034
Weighted residual factors for all reflections included in the refinement	0.1095
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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