Crystallography Open Database

Information card for entry 7127409

Preview

Coordinates	7127409.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H61 Li O6 P4 Ta
Calculated formula	C35 H61 Li O6 P4 Ta
Title of publication	The reaction behavior of [Cp<sub>2</sub>Mo<sub>2</sub>(CO)<sub>4</sub>(μ,η<sup>2:2</sup>-P<sub>2</sub>)] and [Cp''Ta(CO)<sub>2</sub>(η<sup>4</sup>-P<sub>4</sub>)] towards hydroxide and tert-butyl nucleophiles.
Authors of publication	Riedlberger, Felix; Seidl, Michael; Scheer, Manfred
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	89
Pages of publication	13836 - 13839
a	11.8625 ± 0.0001 Å
b	21.7618 ± 0.0003 Å
c	16.0909 ± 0.0002 Å
α	90°
β	94.017 ± 0.001°
γ	90°
Cell volume	4143.65 ± 0.08 Å³
Cell temperature	123 ± 0.1 K
Ambient diffraction temperature	123 ± 0.1 K
Number of distinct elements	6
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	0.0542
Residual factor for significantly intense reflections	0.0503
Weighted residual factors for significantly intense reflections	0.1318
Weighted residual factors for all reflections included in the refinement	0.1366
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
260650 (current)	2021-01-07	cif/ Updating files of 7127408, 7127409, 7127410 Original log message: Adding full bibliography for 7127408--7127410.cif.	7127409.cif
258284	2020-10-10	cif/ Adding structures of 7127408, 7127409, 7127410 via cif-deposit CGI script.	7127409.cif