Crystallography Open Database

Information card for entry 4338272

Preview

Coordinates	4338272.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H40 Cu2 N10 O6
Calculated formula	C30 H40 Cu2 N10 O6
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	9.0711 ± 0.0005 Å
b	9.6401 ± 0.0004 Å
c	11.0829 ± 0.0007 Å
α	90.337 ± 0.004°
β	113.571 ± 0.006°
γ	98.063 ± 0.004°
Cell volume	877.46 ± 0.09 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.0381
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0943
Weighted residual factors for all reflections included in the refinement	0.0971
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
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.	4338272.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.	4338272.cif
112336	2014-05-01	cif/ Adding structures of 4338272, 4338273, 4338274, 4338275, 4338276, 4338277, 4338278, 4338279, 4338280, 4338281 via cif-deposit CGI script.	4338272.cif