Crystallography Open Database

Information card for entry 4507486

Preview

Coordinates	4507486.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	73.11Co
Formula	C26 H38 Co2 N2 O16
Calculated formula	C26 H30 Co2 N2 O16
Title of publication	Novel Layered 2D and Triply Interpenetrating 3D Cobalt-Functionalized Diaza-12-crown Based Coordination Polymers: Synthesis, Structure, and Magnetic Properties
Authors of publication	Ingram, Conrad W.; Liao, Liang; Bacsa, John; Harruna, Issifu; Sabo, Daniel; Zhang, Z. John
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	3
Pages of publication	1131
a	14.8991 ± 0.0015 Å
b	11.3688 ± 0.0012 Å
c	17.9705 ± 0.0018 Å
α	90°
β	90.782 ± 0.002°
γ	90°
Cell volume	3043.6 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1009
Residual factor for significantly intense reflections	0.0795
Weighted residual factors for significantly intense reflections	0.2116
Weighted residual factors for all reflections included in the refinement	0.2257
Goodness-of-fit parameter for all reflections included in the refinement	1.064
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179610 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/74.	4507486.cif
85535	2013-05-07	cif/ Adding structures of 4507486 via cif-deposit CGI script.	4507486.cif