Crystallography Open Database

Information card for entry 4336329

Preview

Coordinates	4336329.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C156 H84 Mn6 N0 O30
Calculated formula	C156 H84 Mn6 O30
Title of publication	Metastable Interwoven Mesoporous Metal-Organic Frameworks
Authors of publication	Yabing He; Zhiyong Guo; Shengchang Xiang; Zhangjing Zhang; Wei Zhou; Frank R. Fronczek; Sean Parkin; Stephen T. Hyde; Michael O'Keeffe; Banglin Chen
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	11580 - 11584
a	33.5118 ± 0.0018 Å
b	33.5118 ± 0.0018 Å
c	33.5118 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	37635 ± 4 Å³
Cell temperature	243 ± 2 K
Ambient diffraction temperature	243 ± 2 K
Number of distinct elements	5
Space group number	222
Hermann-Mauguin space group symbol	P n -3 n :2
Hall space group symbol	-P 4a 2bc 3
Residual factor for all reflections	0.1184
Residual factor for significantly intense reflections	0.0704
Weighted residual factors for significantly intense reflections	0.1773
Weighted residual factors for all reflections included in the refinement	0.1926
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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
179466 (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 4/33/63.	4336329.cif
102307	2014-02-19	cif/ Adding structures of 4336329 via cif-deposit CGI script.	4336329.cif