Crystallography Open Database

Information card for entry 4069566

Preview

Coordinates	4069566.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	compound4a
Formula	C57 H87 O3 P2 Si7
Calculated formula	C57 H87 O3 P2 Si7
Title of publication	[4+2] Cycloaddition of 9-Anthryldiphosphene with Electron-Deficient Olefins: Transformation of a Diaryldiphosphene to Alkylaryldiphosphenes
Authors of publication	Tsurusaki, Akihiro; Sasamori, Takahiro; Tokitoh, Norihiro
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	13
Pages of publication	3604
a	11.7476 ± 0.0003 Å
b	12.6699 ± 0.0003 Å
c	22.2004 ± 0.0007 Å
α	74.0631 ± 0.0012°
β	79.3447 ± 0.0014°
γ	88.6068 ± 0.0015°
Cell volume	3121.32 ± 0.15 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1175
Residual factor for significantly intense reflections	0.052
Weighted residual factors for significantly intense reflections	0.0848
Weighted residual factors for all reflections included in the refinement	0.0957
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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