Crystallography Open Database

Information card for entry 7038712

Preview

Coordinates	7038712.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H6 Cu I N2 O2
Calculated formula	C12 H6 Cu I N2 O2
Title of publication	Two-semiconductive-component hybrid coordination polymers with controllable photo-induced electron-transfer properties.
Authors of publication	Liu, Jian-Jun; Chen, Yong; Lin, Mei-Jin; Huang, Chang-Cang; Dai, Wen-Xin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	15
Pages of publication	6339 - 6342
a	14.484 ± 0.003 Å
b	4.1532 ± 0.0008 Å
c	20.91 ± 0.004 Å
α	90°
β	92.11 ± 0.03°
γ	90°
Cell volume	1257 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0519
Residual factor for significantly intense reflections	0.0443
Weighted residual factors for significantly intense reflections	0.1193
Weighted residual factors for all reflections included in the refinement	0.1241
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
182691 (current)	2016-05-06	cif/ Updating files of 7038711, 7038712 Original log message: Adding full bibliography for 7038711--7038712.cif.	7038712.cif
178011	2016-03-08	cif/ Adding structures of 7038711, 7038712 via cif-deposit CGI script.	7038712.cif