Crystallography Open Database

Information card for entry 1572025

1572024 << 1572025 >> 1572026

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Coordinates	1572025.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	<i>trans</i>-Diaquatetrakis(tetrahydrofuran-κ<i>O</i>)iron(II) μ-carbonyl-tetradecacarbonyltetrachlorido-μ-dimethylsilanediolato-tetragalliumtetrairon(7 <i>Ga</i>–<i>Fe</i>)(<i>Fe</i>–<i>Fe</i>) tetrahydrofuran tetrasolvate
Formula	C49 H74 Cl4 Fe5 Ga4 O27 Si
Calculated formula	C49 H74 Cl4 Fe5 Ga4 O27 Si
Title of publication	trans-Diaquatetrakis(tetrahydrofuran-κO)iron(II) μ-carbonyl-tetradecacarbonyltetrachlorido-μ-dimethylsilanediolato-tetragalliumtetrairon(7 Ga–Fe)(Fe–Fe) tetrahydrofuran tetrasolvate
Authors of publication	Demmin, Mary Elizabeth; Bauer, Cary; Ruf, Michael; Harakas, George N.
Journal of publication	IUCrData
Year of publication	2024
Journal volume	9
Journal issue	6
a	12.1954 ± 0.0006 Å
b	15.2657 ± 0.0007 Å
c	39.03 ± 0.0016 Å
α	90°
β	95.5629 ± 0.0016°
γ	90°
Cell volume	7232 ± 0.6 Å³
Cell temperature	203 ± 2 K
Ambient diffraction temperature	203 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0568
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.093
Weighted residual factors for all reflections included in the refinement	0.1004
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKa
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
292683 (current)	2024-07-02	cif/ Adding structures of 1572025 via cif-deposit CGI script.	1572025.cif