Crystallography Open Database

Information card for entry 7702974

Preview

Coordinates	7702974.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H130 Br6 Ce2 Ir4 N8 P4
Calculated formula	C76 H132 Br6 Ce2 Ir4 N8 P4
Title of publication	Isolation of heterometallic cerium(iii) complexes with a multidentate nitrogen-phosphorus ligand.
Authors of publication	Xin, Xiaoqing; Zhu, Congqing
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	3
Pages of publication	603 - 607
a	14.3632 ± 0.0005 Å
b	19.3199 ± 0.0007 Å
c	21.3343 ± 0.0007 Å
α	91.439 ± 0.002°
β	104.959 ± 0.001°
γ	109.739 ± 0.001°
Cell volume	5342.3 ± 0.3 Å³
Cell temperature	193 K
Ambient diffraction temperature	193 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0553
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.1496
Weighted residual factors for all reflections included in the refinement	0.1554
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
247736 (current)	2020-02-04	cif/ Updating files of 7702971, 7702972, 7702973, 7702974 Original log message: Adding full bibliography for 7702971--7702974.cif.	7702974.cif
245234	2019-12-17	cif/ Adding structures of 7702971, 7702972, 7702973, 7702974 via cif-deposit CGI script.	7702974.cif