Crystallography Open Database

Information card for entry 7018054

Preview

Coordinates	7018054.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H13.75 N O7 Zn2
Calculated formula	C35 H25 N O7 Zn2
Title of publication	A porous metal-organic framework (MOF) with unusual 2D→3D polycatenation based on honeycomb layers.
Authors of publication	Zhao, Xiaoliang; Dou, Jianmin; Sun, Di; Cui, Peipei; Sun, Daofeng; Wu, Qingyin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	7
Pages of publication	1928 - 1930
a	27.854 ± 0.006 Å
b	17.042 ± 0.004 Å
c	20.656 ± 0.004 Å
α	90°
β	116.017 ± 0.004°
γ	90°
Cell volume	8812 ± 3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.1271
Residual factor for significantly intense reflections	0.0763
Weighted residual factors for significantly intense reflections	0.2064
Weighted residual factors for all reflections included in the refinement	0.2286
Goodness-of-fit parameter for all reflections included in the refinement	0.883
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
179884 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/80.	7018054.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7018054.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7018054.cif
33578	2012-02-12	../uploads/cif-deposit/cod/cif Adding structures of 7018054 via cif-deposit CGI script.	7018054.cif