Crystallography Open Database

Information card for entry 7209854

7209853 << 7209854 >> 7209855

Preview

Coordinates	7209854.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H10 Cu3 I2 N4 O6
Calculated formula	C10 H10 Cu3 I2 N4 O6
Title of publication	The construction of Cu(i)/Cu(ii) coordination polymers based on pyrazine‒carboxylate: Structural diversity tuned by in situ hydrolysis reaction
Authors of publication	Wen, Zhen-Zhen; Wen, Xi-Ling; Cai, Song-Liang; Zheng, Sheng-Run; Fan, Jun; Zhang, Wei-Guang
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	26
Pages of publication	5359
a	7.6664 ± 0.0016 Å
b	31.951 ± 0.007 Å
c	15.481 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3792.1 ± 1.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.1308
Residual factor for significantly intense reflections	0.0867
Weighted residual factors for significantly intense reflections	0.1536
Weighted residual factors for all reflections included in the refinement	0.1696
Goodness-of-fit parameter for all reflections included in the refinement	1.087
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
180429 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/98.	7209854.cif
86867	2013-07-12	cif/ Adding structures of 7209852, 7209853, 7209854 via cif-deposit CGI script.	7209854.cif