Crystallography Open Database

Information card for entry 4338281

Preview

Coordinates	4338281.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H35 Cu2 N6 O7
Calculated formula	C28 H35 Cu2 N6 O7
Title of publication	Enantioselective inclusion of alcohols by solvent-controlled assembled flexible metal-organic frameworks.
Authors of publication	Lin, Lang; Yu, Rongmin; Wu, Xiao-Yuan; Yang, Wen-Bin; Zhang, Jian; Guo, Xiang-Guang; Lin, Zu-Jin; Lu, Can-Zhong
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	10
Pages of publication	4794 - 4796
a	13.504 ± 0.004 Å
b	14.375 ± 0.004 Å
c	16.193 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	3143.4 ± 1.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0842
Residual factor for significantly intense reflections	0.0754
Weighted residual factors for significantly intense reflections	0.2174
Weighted residual factors for all reflections included in the refinement	0.2261
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
179485 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/82.	4338281.cif
115705	2014-06-05	cif/ Updating files of 4338272, 4338273, 4338274, 4338275, 4338276, 4338277, 4338278, 4338279, 4338280, 4338281 Original log message: Adding full bibliography for 4338272--4338281.cif.	4338281.cif
112336	2014-05-01	cif/ Adding structures of 4338272, 4338273, 4338274, 4338275, 4338276, 4338277, 4338278, 4338279, 4338280, 4338281 via cif-deposit CGI script.	4338281.cif