Crystallography Open Database

Information card for entry 4308891

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Coordinates	4308891.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78.5 H43 Cl F24 N6 Ru
Calculated formula	C78.5 H42 Cl F24 N6 Ru
Title of publication	Tuning the Reactivity of Dioxoruthenium(VI) Porphyrins toward an Arylimine by Altering Porphyrin Substituents
Authors of publication	Jie-Sheng Huang; Sarana Ka-Yan Leung; Zhong-Yuan Zhou; Nianyong Zhu; Chi-Ming Che
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	3780 - 3788
a	16.597 ± 0.0014 Å
b	17.9044 ± 0.0015 Å
c	25.811 ± 0.002 Å
α	90°
β	93.517 ± 0.002°
γ	90°
Cell volume	7655.5 ± 1.1 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1697
Residual factor for significantly intense reflections	0.0775
Weighted residual factors for significantly intense reflections	0.195
Weighted residual factors for all reflections included in the refinement	0.2264
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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