Crystallography Open Database

Information card for entry 7057238

Preview

Coordinates	7057238.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H26 N4 O2
Calculated formula	C33 H26 N4 O2
Title of publication	Symmetrical and dissymmetrical 2,2′-bis-dipyrrin ligands and Zn(ii) binuclear helicates
Authors of publication	Zhang, Fan; Baudron, Stéphane A.; Hosseini, Mir Wais
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	9
Pages of publication	6997
a	7.4764 ± 0.0005 Å
b	9.8577 ± 0.0007 Å
c	18.0856 ± 0.0012 Å
α	94.177 ± 0.003°
β	90.378 ± 0.003°
γ	98.712 ± 0.003°
Cell volume	1313.82 ± 0.16 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1335
Residual factor for significantly intense reflections	0.1045
Weighted residual factors for significantly intense reflections	0.3061
Weighted residual factors for all reflections included in the refinement	0.3286
Goodness-of-fit parameter for all reflections included in the refinement	1.066
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
230450 (current)	2019-11-17	cif/ Updating files of 7057234, 7057235, 7057236, 7057237, 7057238 Original log message: Adding full bibliography for 7057234--7057238.cif.	7057238.cif
207206	2018-04-03	cif/ Adding structures of 7057234, 7057235, 7057236, 7057237, 7057238 via cif-deposit CGI script.	7057238.cif