Crystallography Open Database

Information card for entry 7708596

Preview

Coordinates	7708596.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H28.03 Cl0.89 I1.11 N4 O4.51 Re
Calculated formula	C23 H28.032 Cl0.891 I1.109 N4 O4.516 Re
Title of publication	Remote Control: Stereoselective Coordination of Electron-Deficient 2,2’-bipyridine Ligands to Re(I) and Ir(III) Cores
Authors of publication	Newman, Paul David; Kariuki, Benson; Lowy, Phoebe; Jerwood, Kimberley; Deeming, Laura
Journal of publication	Dalton Transactions
Year of publication	2021
a	9.9804 ± 0.0003 Å
b	10.6322 ± 0.0003 Å
c	12.5079 ± 0.0004 Å
α	90°
β	92.751 ± 0.003°
γ	90°
Cell volume	1325.73 ± 0.07 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0345
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0496
Weighted residual factors for all reflections included in the refinement	0.0522
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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