Crystallography Open Database

Information card for entry 7242374

Preview

Coordinates	7242374.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H48 N16 O8 Zn4
Calculated formula	C50 H48 N16 O8 Zn4
Title of publication	Differentiating intramolecular spodium bonds from coordination bonds in two polynuclear zinc(ii) Schiff base complexes
Authors of publication	Basak, Tanmoy; Gomila, Rosa M.; Frontera, Antonio; Chattopadhyay, Shouvik
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	14
Pages of publication	2703 - 2710
a	15.458 ± 0.002 Å
b	14.634 ± 0.003 Å
c	23.965 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	5421.2 ± 1.6 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1335
Residual factor for significantly intense reflections	0.0803
Weighted residual factors for significantly intense reflections	0.2361
Weighted residual factors for all reflections included in the refinement	0.2794
Goodness-of-fit parameter for all reflections included in the refinement	1.108
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
265976 (current)	2021-06-05	cif/ Updating files of 7242374, 7242375 Original log message: Adding full bibliography for 7242374--7242375.cif.	7242374.cif
262954	2021-03-10	cif/ Adding structures of 7242374, 7242375 via cif-deposit CGI script.	7242374.cif