Crystallography Open Database

Information card for entry 7714793

Preview

Coordinates	7714793.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C147 H126 Gd N12 O3 P3 S6
Calculated formula	C147 H126 Gd N12 O3 P3 S6
Title of publication	Lanthanide complexes with a new luminescent iminophosphonamide ligand bearing phenylbenzothiazole substituents.
Authors of publication	Sinitsa, Dmitry K.; Pylova, Ekaterina K.; Mironova, Olga A.; Bashirov, Denis A.; Ryadun, Alexey A.; Sukhikh, Taisiya S.; Konchenko, Sergey N.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	5
Pages of publication	2181 - 2192
a	22.7279 ± 0.0006 Å
b	14.474 ± 0.0005 Å
c	38.0128 ± 0.0012 Å
α	90°
β	93.449 ± 0.001°
γ	90°
Cell volume	12482.2 ± 0.7 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
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	0.0578
Residual factor for significantly intense reflections	0.0454
Weighted residual factors for significantly intense reflections	0.108
Weighted residual factors for all reflections included in the refinement	0.1157
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
289475 (current)	2024-02-04	cif/ Updating files of 7714787, 7714788, 7714789, 7714790, 7714791, 7714792, 7714793 Original log message: Adding full bibliography for 7714787--7714793.cif.	7714793.cif
288455	2023-12-21	cif/ Adding structures of 7714787, 7714788, 7714789, 7714790, 7714791, 7714792, 7714793 via cif-deposit CGI script.	7714793.cif