Crystallography Open Database

Information card for entry 7242494

Preview

Coordinates	7242494.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H31 N11 O5 S2 Zn2
Calculated formula	C18 H31 N11 O5 S2 Zn2
Title of publication	On the importance of RH3C⋯N tetrel bonding interactions in the solid state of a dinuclear zinc complex with a tetradentate Schiff base ligand
Authors of publication	Mondal, Ipsita; Frontera, Antonio; Chattopadhyay, Shouvik
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	18
Pages of publication	3391 - 3397
a	9.2129 ± 0.0009 Å
b	9.9156 ± 0.001 Å
c	17.7795 ± 0.0018 Å
α	80.589 ± 0.003°
β	77.092 ± 0.003°
γ	64.355 ± 0.003°
Cell volume	1423.1 ± 0.2 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0322
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.0751
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
265984 (current)	2021-06-05	cif/ Updating files of 7242494 Original log message: Adding full bibliography for 7242494.cif.	7242494.cif
263227	2021-03-23	cif/ Adding structures of 7242494 via cif-deposit CGI script.	7242494.cif