Crystallography Open Database

Information card for entry 7700170

Preview

Coordinates	7700170.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H43 N9 O6.5 Sm
Calculated formula	C51 H43 N9 O6.5 Sm
Title of publication	Synthesis and structural, redox and photophysical properties of tris-(2,5-di(2-pyridyl)pyrrolide) lanthanide complexes.
Authors of publication	McPherson, James N.; Abad Galan, Laura; Iranmanesh, Hasti; Massi, Massimiliano; Colbran, Stephen B.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	25
Pages of publication	9365 - 9375
a	17.177 ± 0.003 Å
b	13.222 ± 0.003 Å
c	19.402 ± 0.004 Å
α	90°
β	90.85 ± 0.03°
γ	90°
Cell volume	4406 ± 1.6 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0465
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.0986
Weighted residual factors for all reflections included in the refinement	0.1035
Goodness-of-fit parameter for all reflections included in the refinement	1.133
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
224216 (current)	2019-11-08	cif/ Updating files of 7700168, 7700169, 7700170 Original log message: Adding full bibliography for 7700168--7700170.cif.	7700170.cif
215723	2019-06-06	cif/ Adding structures of 7700168, 7700169, 7700170 via cif-deposit CGI script.	7700170.cif