Crystallography Open Database

Information card for entry 7718453

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Coordinates	7718453.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H23 Cr
Calculated formula	C17 H23 Cr
Title of publication	Revisiting the structure and properties of mid-valent monopentamethylcyclopentadienylchromium complexes.
Authors of publication	Calvo-Molina, Adrián; Jover, Jesús; Pérez-Redondo, Adrián; Yélamos, Carlos
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	20
Pages of publication	8190 - 8203
a	10.5776 ± 0.0004 Å
b	12.2828 ± 0.0006 Å
c	10.9543 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1423.21 ± 0.11 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	3
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0421
Residual factor for significantly intense reflections	0.0269
Weighted residual factors for significantly intense reflections	0.0926
Weighted residual factors for all reflections included in the refinement	0.1177
Goodness-of-fit parameter for all reflections included in the refinement	1.259
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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