Crystallography Open Database

Information card for entry 7215041

Preview

Coordinates	7215041.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H18 Cu4 I5 N5
Calculated formula	C16 H18 Cu4 I5 N5
Title of publication	Solvothermal synthesis of two new coordination polymers: in situ heterocycle conversion and N-alkylation, network topologies and luminescence properties
Authors of publication	Fang, Zhenlan; Yang, Wenbin; He, Jiangang; Ding, Kaining; Wu, Xiaoyuan; Zhang, Qisheng; Yu, Rongmin; Lu, Canzhong
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	14
Pages of publication	4794
a	10.366 ± 0.009 Å
b	11.154 ± 0.009 Å
c	12.483 ± 0.01 Å
α	96.342 ± 0.01°
β	105.741 ± 0.006°
γ	104.4 ± 0.004°
Cell volume	1320.8 ± 1.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0698
Residual factor for significantly intense reflections	0.0519
Weighted residual factors for significantly intense reflections	0.1311
Weighted residual factors for all reflections included in the refinement	0.1462
Goodness-of-fit parameter for all reflections included in the refinement	0.99
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
180481 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/50.	7215041.cif
111021	2014-04-20	cif/ Adding structures of 7215041, 7215042 via cif-deposit CGI script.	7215041.cif