Crystallography Open Database

Information card for entry 7135188

Preview

Coordinates	7135188.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H35 Cl4 O2 P2 Re
Calculated formula	C41 H35 Cl4 O2 P2 Re
Title of publication	Synthesis and characterization of rhena-phenalenyl complexes.
Authors of publication	Li, Lei; Fu, Bingjie; Zhao, Yue; Sun, Yue; Li, Yang; Jiang, Wenfeng; Bai, Wei
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	81
Pages of publication	15858 - 15861
a	12.6366 ± 0.0004 Å
b	10.614 ± 0.0003 Å
c	28.7173 ± 0.0009 Å
α	90°
β	95.677 ± 0.001°
γ	90°
Cell volume	3832.8 ± 0.2 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	6
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	0.0296
Residual factor for significantly intense reflections	0.0225
Weighted residual factors for significantly intense reflections	0.0462
Weighted residual factors for all reflections included in the refinement	0.0483
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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