Crystallography Open Database

Information card for entry 7058131

Preview

Coordinates	7058131.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H40 N3 O6 Tb
Calculated formula	C53 H40 N3 O6 Tb
Title of publication	Syntheses, crystal structure and photophysical properties of [Sm(dbm)3(impy)] and [Tb(dbm)3(impy)] and their hybrid films
Authors of publication	Hasan, Najmul; Iftikhar, Khalid
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	11
Pages of publication	4391
a	13.1862 ± 0.0007 Å
b	22.503 ± 0.0014 Å
c	16.0608 ± 0.001 Å
α	90°
β	109.979 ± 0.002°
γ	90°
Cell volume	4478.9 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.0571
Residual factor for significantly intense reflections	0.031
Weighted residual factors for significantly intense reflections	0.0525
Weighted residual factors for all reflections included in the refinement	0.0605
Goodness-of-fit parameter for all reflections included in the refinement	1.065
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
224981 (current)	2019-11-08	cif/ Updating files of 7058131, 7058132 Original log message: Adding full bibliography for 7058131--7058132.cif.	7058131.cif
213382	2019-01-30	cif/ Adding structures of 7058131, 7058132 via cif-deposit CGI script.	7058131.cif