Crystallography Open Database

Information card for entry 7226631

Preview

Coordinates	7226631.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H18 Cd N4 O5
Calculated formula	C14 H18 Cd N4 O5
Title of publication	Employing mixed-ligand strategy to construct a series of luminescent Cd(ii) compounds with structural diversities
Authors of publication	Yang, Jin-Xia; Qin, Ye-Yan; Ye, Run-Ping; Zhang, Xin; Yao, Yuan-Gen
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	42
Pages of publication	8309
a	20.8809 ± 0.001 Å
b	10.6287 ± 0.0004 Å
c	16.6021 ± 0.0007 Å
α	90°
β	115.3 ± 0.005°
γ	90°
Cell volume	3331.2 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0375
Residual factor for significantly intense reflections	0.0289
Weighted residual factors for significantly intense reflections	0.0626
Weighted residual factors for all reflections included in the refinement	0.0675
Goodness-of-fit parameter for all reflections included in the refinement	1.006
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
188104 (current)	2016-11-08	cif/ Updating files of 7226631, 7226632, 7226633, 7226634, 7226635, 7226636, 7226637, 7226638 Original log message: Adding full bibliography for 7226631--7226638.cif.	7226631.cif
186773	2016-09-25	cif/ Adding structures of 7226631, 7226632, 7226633, 7226634, 7226635, 7226636, 7226637, 7226638 via cif-deposit CGI script.	7226631.cif