Crystallography Open Database

Information card for entry 4510182

Preview

Coordinates	4510182.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H67 Gd2 N3 O23
Calculated formula	C75 H42 Gd2 N2 O22
Title of publication	Synthesis and Characterization of Two Lanthanide (Gd3+and Dy3+)-Based Three-Dimensional Metal Organic Frameworks with Squashed Metallomacrocycle Type Building Blocks and Their Magnetic, Sorption, and Fluorescence Properties Study
Authors of publication	Biswas, Soumava; Jena, Himanshu Sekhar; Goswami, Soumyabrata; Sanda, Suresh; Konar, Sanjit
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	3
Pages of publication	1287
a	31.517 ± 0.012 Å
b	14.882 ± 0.004 Å
c	28.494 ± 0.008 Å
α	90°
β	120.19 ± 0.02°
γ	90°
Cell volume	11552 ± 7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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	0.0649
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.1532
Weighted residual factors for all reflections included in the refinement	0.1548
Goodness-of-fit parameter for all reflections included in the refinement	1.171
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179648 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/01.	4510182.cif
106401	2014-03-15	cif/ Adding structures of 4510182 via cif-deposit CGI script.	4510182.cif