Crystallography Open Database

Information card for entry 1560774

Preview

Coordinates	1560774.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H44 N12 O16 Zn2
Calculated formula	C52 H36 N12 O16 Zn2
Title of publication	3-Fold and 6-Fold interpenetrating diamond nets based on the designed N,N'-dioxide 3,3'-benzo(c)cinnoline dicarboxylic acid with highly sensitive luminscence sensing for NACs and Fe3+ ion
Authors of publication	Zhang, Xiu-Tang; Chen, Hong-Tai; Li, Bin; Liu, Guang-Zeng; Liu, Xin-Zheng
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	267
Pages of publication	28 - 34
a	6.4259 ± 0.0003 Å
b	23.2131 ± 0.0012 Å
c	17.4546 ± 0.001 Å
α	90°
β	94.881 ± 0.002°
γ	90°
Cell volume	2594.2 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1084
Residual factor for significantly intense reflections	0.056
Weighted residual factors for significantly intense reflections	0.1275
Weighted residual factors for all reflections included in the refinement	0.1504
Goodness-of-fit parameter for all reflections included in the refinement	1.002
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
262384 (current)	2021-03-03	cif/ Adding structures of 1560773, 1560774 via cif-deposit CGI script.	1560774.cif