Crystallography Open Database

Information card for entry 7111590

Preview

Coordinates	7111590.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H6 Cd7 N16 O14
Calculated formula	C8 H6 Cd7 N16 O14
Title of publication	A highly-connected acentric organic‒inorganic hybrid material with unique 3D inorganic and 3D organic connectivity
Authors of publication	Zhong, Di-Chang; Meng, Miao; Zhu, Jie; Yang, Guo-Yu; Lu, Tong-Bu
Journal of publication	Chemical Communications
Year of publication	2010
Journal volume	46
Journal issue	24
Pages of publication	4354 - 4356
a	9.4631 ± 0.0007 Å
b	9.4631 ± 0.0007 Å
c	13.662 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	1223.4 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	82
Hermann-Mauguin space group symbol	I -4
Hall space group symbol	I -4
Residual factor for all reflections	0.0232
Residual factor for significantly intense reflections	0.0226
Weighted residual factors for significantly intense reflections	0.0559
Weighted residual factors for all reflections included in the refinement	0.0563
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180229 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/15.	7111590.cif
96689	2014-01-29	cif/ Adding structures of 7111590 via cif-deposit CGI script.	7111590.cif