Crystallography Open Database

Information card for entry 7205961

7205960 << 7205961 >> 7205962

Preview

Coordinates	7205961.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C109 H134 Cd4 N16 O33
Calculated formula	C85 H68 Cd4 N8 O20
Title of publication	Pore-size tuning in double-pillared metal‒organic frameworks containing cadmium clusters
Authors of publication	Lin, Zu-Jin; Liu, Tian-Fu; Xu, Bo; Han, Li-Wei; Huang, Yuan-Biao; Cao, Rong
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	10
Pages of publication	3321
a	17.3376 ± 0.0008 Å
b	17.3376 ± 0.0008 Å
c	27.957 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	8403.7 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	128
Hermann-Mauguin space group symbol	P 4/m n c
Hall space group symbol	-P 4 2n
Residual factor for all reflections	0.1002
Residual factor for significantly intense reflections	0.0978
Weighted residual factors for significantly intense reflections	0.2602
Weighted residual factors for all reflections included in the refinement	0.2617
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
180390 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/59.	7205961.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205961.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205961.cif
21298	2011-06-22	../uploads/cif-deposit/cod/cif Adding structures of 7205958, 7205959, 7205960, 7205961 via cif-deposit CGI script.	7205961.cif