Crystallography Open Database

Information card for entry 7058837

Preview

Coordinates	7058837.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C100 H128 N4 O14 Sn4
Calculated formula	C100 H128 N4 O14 Sn4
Title of publication	Selective sensing of a Cu(ii) ion by organotin anchored keto-enamine ligands
Authors of publication	Vinayak, Richa; Nayek, Hari Pada
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	40
Pages of publication	16050
a	11.4406 ± 0.0003 Å
b	13.4384 ± 0.0005 Å
c	17.7025 ± 0.0005 Å
α	78.369 ± 0.003°
β	74.699 ± 0.002°
γ	68.198 ± 0.003°
Cell volume	2421.03 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0535
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0766
Weighted residual factors for all reflections included in the refinement	0.0825
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
224868 (current)	2019-11-08	cif/ Updating files of 7058835, 7058836, 7058837 Original log message: Adding full bibliography for 7058835--7058837.cif.	7058837.cif
218656	2019-09-21	cif/ Adding structures of 7058835, 7058836, 7058837 via cif-deposit CGI script.	7058837.cif