Crystallography Open Database

Information card for entry 2022132

2022131 << 2022132 >> 2022133

Preview

Coordinates	2022132.cif
Structure factors	2022132.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	<i>catena</i>-Poly[[[diaqua[1,2-bis(pyridin-4-yl)ethene]{4-[2-(pyridin-4-yl)ethenyl]pyridinium}gold(I)iron(II)]-di-μ-cyanido] bis[dicyanidogold(I)] 1,2-bis(pyridin-4-yl)ethene dihydrate]
Formula	C42 H39 Au3 Fe N12 O4
Calculated formula	C42 H39 Au3 Fe N12 O4
Title of publication	Crystal structure of catena-poly[[[diaqua[1,2-bis(pyridin-4-yl)ethene]{4-[2-(pyridin-4-yl)ethenyl]pyridinium}gold(I)iron(II)]-di-μ-cyanido] bis[dicyanidogold(I)] 1,2-bis(pyridin-4-yl)ethene dihydrate]
Authors of publication	Partsevska, Sofiia V.; Naumova, Dina D.; Matushko, Igor P.; Shova, Sergiu; Gural'skiy, Il'ya A.
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2020
Journal volume	76
Journal issue	6
Pages of publication	944
a	10.5601 ± 0.0007 Å
b	11.0044 ± 0.0012 Å
c	11.8145 ± 0.001 Å
α	80.212 ± 0.008°
β	69.124 ± 0.007°
γ	78.565 ± 0.007°
Cell volume	1249.9 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0645
Residual factor for significantly intense reflections	0.0501
Weighted residual factors for significantly intense reflections	0.1426
Weighted residual factors for all reflections included in the refinement	0.1555
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

Version history

Revision	Date	Message	Files
252481 (current)	2020-05-30	cif/ hkl/ Adding structures of 2022132 via cif-deposit CGI script.	2022132.cif 2022132.hkl