Crystallography Open Database

Information card for entry 7214685

Preview

Coordinates	7214685.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(Co(L)(PIN))-dioxane-H2O
Chemical name	[Co(L)(PIN)]-dioxane-H2O
Formula	C28 H26 Co N4 O8
Calculated formula	C27.998 H25.996 Co N4 O7.999
Title of publication	Dynamic porous metal‒organic frameworks: synthesis, structure and sorption property
Authors of publication	Hou, Chao; Liu, Qing; Okamura, Taka-aki; Wang, Peng; Sun, Wei-Yin
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	24
Pages of publication	8569
a	20.512 ± 0.005 Å
b	9.9435 ± 0.0019 Å
c	26.994 ± 0.005 Å
α	90°
β	101.945 ± 0.011°
γ	90°
Cell volume	5387 ± 2 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 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	0.0523
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.1019
Weighted residual factors for all reflections included in the refinement	0.1058
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180477 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/46.	7214685.cif
110945	2014-04-20	cif/ Adding structures of 7214685, 7214686, 7214687 via cif-deposit CGI script.	7214685.cif