Crystallography Open Database

Information card for entry 1548558

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Coordinates	1548558.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H26 Cd N4 O5
Calculated formula	C21 H26 Cd N4 O5
Title of publication	Synthesis, Crystal Structure, and Luminescent Properties of New Zinc(II) and Cadmium(II) Metal-Organic Frameworks Based on Flexible Bis(imidazol-1-yl)alkane Ligands
Authors of publication	Marina Barsukova; Tatiana Goncharova; Denis Samsonenko; Danil Dybtsev; Andrei Potapov
Journal of publication	Crystals
Year of publication	2016
Journal volume	6
Pages of publication	132
a	9.2444 ± 0.001 Å
b	10.0116 ± 0.0008 Å
c	14.4659 ± 0.0013 Å
α	107.371 ± 0.008°
β	91.269 ± 0.008°
γ	116.622 ± 0.01°
Cell volume	1123.1 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.0503
Residual factor for significantly intense reflections	0.0487
Weighted residual factors for significantly intense reflections	0.1236
Weighted residual factors for all reflections included in the refinement	0.1292
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
204582 (current)	2017-12-29	cif/ Adding structures of 1548558 via cif-deposit CGI script.	1548558.cif