Crystallography Open Database

Information card for entry 7207449

7207448 << 7207449 >> 7207450

Preview

Coordinates	7207449.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H24 Cu2 I2 N4 S2
Calculated formula	C25 H24 Cu2 I2 N4 S2
Title of publication	Spacer length-controlled assembly of [CunIn]-based coordination polymers from CuI and bis(4-phenylpyrimidine-2-thio)alkane ligands
Authors of publication	Yang, Xiao-Juan; Li, Hong-Xi; Xu, Zhong-Lin; Li, Hai-Yan; Ren, Zhi-Gang; Lang, Jian-Ping
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	5
Pages of publication	1641
a	10.868 ± 0.002 Å
b	13.951 ± 0.003 Å
c	19.474 ± 0.004 Å
α	86.82 ± 0.03°
β	88.76 ± 0.03°
γ	76.72 ± 0.03°
Cell volume	2869.1 ± 1.1 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0893
Residual factor for significantly intense reflections	0.0648
Weighted residual factors for significantly intense reflections	0.1107
Weighted residual factors for all reflections included in the refinement	0.1219
Goodness-of-fit parameter for all reflections included in the refinement	1.151
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
180405 (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 7/20/74.	7207449.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207449.cif
37645	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7207445, 7207446, 7207447, 7207448, 7207449, 7207450 via cif-deposit CGI script.	7207449.cif