Crystallography Open Database

Information card for entry 4505066

Preview

Coordinates	4505066.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H K O8 Zn0.5
Calculated formula	C5 H K O8 Zn0.5
Title of publication	Bottom-Up Crystal Engineering toward Nanoporosity Exemplified by a Zinc Carboxylate Coordination Polymer Adopting a Tenorite Analogue Network Topology
Authors of publication	Lu, Kuang-Lieh; Chen, Yen-Fu; Liu, Yen-Hsiang; Cheng, Yi-Wei; Liao, Rong-Tang; Wen, Yuh-Sheng
Journal of publication	Crystal Growth & Design
Year of publication	2005
Journal volume	5
Journal issue	2
Pages of publication	403
a	11.3366 ± 0.001 Å
b	15.3829 ± 0.001 Å
c	11.1085 ± 0.001 Å
α	90°
β	91.398 ± 0.01°
γ	90°
Cell volume	1936.6 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0577
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.1052
Weighted residual factors for all reflections included in the refinement	0.1156
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation probe	x-ray
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4505066.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4505066.cif
50137	2012-03-31	../uploads/cif-deposit/cod/cif Adding structures of 4505066 via cif-deposit CGI script.	4505066.cif