Crystallography Open Database

Information card for entry 8107296

Preview

Coordinates	8107296.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H46 Mn N10 O14 Ru
Calculated formula	C58 H46 Mn N10 O14 Ru
Title of publication	The crystal structure of dimethanol-κ1O-(5,10,15,20-tetrakis(4-nitrophenyl)porphyrin-21,23-diido-κ4 O,O′,O″,O′″)manganese(III) trans-dicyanido-κ1C-bis(acetylacetonato-κ2 O,O′)ruthenium(III), C58H46N10O14RuMn
Authors of publication	Zhou, Tingting
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2022
Journal volume	237
Journal issue	6
Pages of publication	1071 - 1073
a	8.0148 ± 0.0018 Å
b	12.141 ± 0.003 Å
c	14.843 ± 0.003 Å
α	107.379 ± 0.004°
β	98.415 ± 0.004°
γ	93.43 ± 0.004°
Cell volume	1355.3 ± 0.5 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	0.0949
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.1184
Weighted residual factors for all reflections included in the refinement	0.14
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

Version history

Revision	Date	Message	Files
284152 (current)	2023-06-02	cif/ Adding structures of 8107296 via cif-deposit CGI script.	8107296.cif