Crystallography Open Database

Information card for entry 7058409

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Coordinates	7058409.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H30 Fe N4 O9
Calculated formula	C25 H30 Fe N4 O9
Title of publication	Syntheses and NMR and XRD studies of carbohydrate‒ferrocene conjugates
Authors of publication	Peigneguy, Fanny; Allain, Magali; Cougnon, Charles; Frère, Pierre; Siegler, Benjamin; Bressy, Christine; Gohier, Frédéric
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	24
Pages of publication	9706
a	7.387 ± 0.0001 Å
b	9.4146 ± 0.0002 Å
c	36.6094 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	2546.02 ± 0.08 Å³
Cell temperature	149.9 ± 0.3 K
Ambient diffraction temperature	149.9 ± 0.3 K
Number of distinct elements	5
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	0.0336
Residual factor for significantly intense reflections	0.0311
Weighted residual factors for significantly intense reflections	0.076
Weighted residual factors for all reflections included in the refinement	0.0794
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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