Crystallography Open Database

Information card for entry 7703864

Preview

Coordinates	7703864.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H55 O3 P Si2 W
Calculated formula	C36 H55 O3 P Si2 W
SMILES	[W]12345([P](C)(C)C)(O[Si](OC=1[Si](C)(C)C)(c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)(C#[O])[c]1([c]5([c]4([c]3([c]21C)C)C)C)C
Title of publication	Synthesis, structure, and reactivity of a pyridine-stabilized silanonetungsten complex.
Authors of publication	Muraoka, Takako; Tsuchimoto, Masato; Ueno, Keiji
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	16
Pages of publication	5100 - 5107
a	28.087 ± 0.002 Å
b	28.087 ± 0.002 Å
c	9.4238 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	7434.2 ± 0.9 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.036
Residual factor for significantly intense reflections	0.0289
Weighted residual factors for significantly intense reflections	0.0636
Weighted residual factors for all reflections included in the refinement	0.0654
Goodness-of-fit parameter for all reflections included in the refinement	0.982
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
251625 (current)	2020-05-05	cif/ Updating files of 7703862, 7703863, 7703864 Original log message: Adding full bibliography for 7703862--7703864.cif.	7703864.cif
249723	2020-03-26	cif/ Adding structures of 7703862, 7703863, 7703864 via cif-deposit CGI script.	7703864.cif