Crystallography Open Database

Information card for entry 7107717

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Coordinates	7107717.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H61 N Os P2
Calculated formula	C42 H61 N Os P2
Title of publication	Preparation and Characterisation of [6]-Azaosmahelicenes: The First d4-Heterometallahelicenes
Authors of publication	Olga Crespo; Beatriz Eguillor; Miguel A. Esteruelas; Israel Fernandez; Jorge Garcia-Raboso; Mar Gomez-Gallego; Mamen Martin-Ortiz; Montserrat Olivan; Miguel A. Sierra
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	5328 - 5330
a	39.3354 ± 0.0014 Å
b	39.3354 ± 0.0014 Å
c	11.0574 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	17108.8 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1243
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.1001
Weighted residual factors for all reflections included in the refinement	0.1194
Goodness-of-fit parameter for all reflections included in the refinement	0.857
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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