Crystallography Open Database

Information card for entry 7055899

Preview

Coordinates	7055899.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H46 N6 O15 S0 Zn2
Calculated formula	C57 H46 N6 O15 Zn2
Title of publication	Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies
Authors of publication	Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi
Journal of publication	New J. Chem.
Year of publication	2017
Journal volume	41
Journal issue	3
Pages of publication	1046
a	9.5056 ± 0.0004 Å
b	37.3101 ± 0.0015 Å
c	14.736 ± 0.0006 Å
α	90°
β	96.305 ± 0.001°
γ	90°
Cell volume	5194.6 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.0967
Residual factor for significantly intense reflections	0.0675
Weighted residual factors for significantly intense reflections	0.158
Weighted residual factors for all reflections included in the refinement	0.1671
Goodness-of-fit parameter for all reflections included in the refinement	1.104
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
191706 (current)	2017-02-04	cif/ Updating files of 7055892, 7055893, 7055894, 7055895, 7055896, 7055897, 7055898, 7055899 Original log message: Adding full bibliography for 7055892--7055899.cif.	7055899.cif
189120	2016-12-14	cif/ Adding structures of 7055892, 7055893, 7055894, 7055895, 7055896, 7055897, 7055898, 7055899 via cif-deposit CGI script.	7055899.cif