Crystallography Open Database

Information card for entry 7061455

Preview

Coordinates	7061455.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C90 H73 Ag Br Cl Cu N5 O10 P4
Calculated formula	C90 H65 Ag Br Cl Cu N5 O6 P4
Title of publication	Photophysical properties of homobimetallic Cu(i)–Cu(i) and heterobimetallic Cu(i)–Ag(i) complexes of 2-(6-bromo-2-pyridyl)-1H-imidazo[4,5-f][1,10]phenanthroline
Authors of publication	Wu, Zhan; Cui, Shu; Zhao, Zhenqin; He, Bingling; Li, Xiu-Ling
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	18
Pages of publication	8881 - 8891
a	13.8637 ± 0.0012 Å
b	24.798 ± 0.002 Å
c	26.122 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	8980.5 ± 1.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150.15 K
Number of distinct elements	9
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0361
Residual factor for significantly intense reflections	0.0315
Weighted residual factors for significantly intense reflections	0.0707
Weighted residual factors for all reflections included in the refinement	0.0725
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	No
Has F_obs	No

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