Crystallography Open Database

Information card for entry 4106467

Preview

Coordinates	4106467.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C67.5 H65.5 Ag3 Mo2 N17.5 O14.5
Calculated formula	C67.5 H48 Ag3 Mo2 N17.5 O10
Title of publication	An Exceptional 54-Fold Interpenetrated Coordination Polymer with 103-srs Network Topology
Authors of publication	Hua Wu; Jin Yang; Zhong-Min Su; Stuart R. Batten; Jian-Fang Ma
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	11406 - 11409
a	30.5678 ± 0.0001 Å
b	30.5678 ± 0.0001 Å
c	30.5678 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	28562.3 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	220
Hermann-Mauguin space group symbol	I -4 3 d
Hall space group symbol	I -4bd 2c 3
Residual factor for all reflections	0.0731
Residual factor for significantly intense reflections	0.0695
Weighted residual factors for significantly intense reflections	0.183
Weighted residual factors for all reflections included in the refinement	0.1873
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
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.	4106467.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4106467.cif
53268	2012-04-19	cif/ Adding structures of 4106467 via cif-deposit CGI script.	4106467.cif