Crystallography Open Database

Information card for entry 4075527

Preview

Coordinates	4075527.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H37 N2 O7 P Si2 W
Calculated formula	C23 H37 N2 O7 P Si2 W
SMILES	[W]([P]1(N=C(N2CCCCC2)C(C1)C(=O)OCC)C([Si](C)(C)C)[Si](C)(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
Title of publication	1,2-Azaphosphol-5-ene Complexes through Metal-Assisted Synthesis
Authors of publication	Streubel, Rainer; Wilkens, Hendrik; Ruthe, Frank; Jones, Peter G.
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	20
Pages of publication	4830
a	10.049 ± 0.003 Å
b	17.105 ± 0.004 Å
c	17.623 ± 0.01 Å
α	90°
β	95.5 ± 0.04°
γ	90°
Cell volume	3015 ± 2 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	7
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	0.0422
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0768
Weighted residual factors for all reflections included in the refinement	0.0822
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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