Crystallography Open Database

Information card for entry 7706462

Preview

Coordinates	7706462.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	AS-358
Formula	C39 H47 N O10 P2 W2
Calculated formula	C39 H47 N O10 P2 W2
Title of publication	Molecular 1,1'-bifunctional mixed-valence P-P compounds, enabled through metal complexation.
Authors of publication	Schmer, Alexander; Bauza, Antonio; Schnakenburg, Gregor; Frontera, Antonio; Streubel, Rainer
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	6
Pages of publication	2131 - 2137
a	9.8761 ± 0.0018 Å
b	10.9209 ± 0.0019 Å
c	12.138 ± 0.002 Å
α	67.727 ± 0.005°
β	66.395 ± 0.005°
γ	70.17 ± 0.005°
Cell volume	1082.6 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0561
Residual factor for significantly intense reflections	0.042
Weighted residual factors for significantly intense reflections	0.0884
Weighted residual factors for all reflections included in the refinement	0.0949
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
262646 (current)	2021-03-05	cif/ Updating files of 7706462, 7706463, 7706464, 7706465 Original log message: Adding full bibliography for 7706462--7706465.cif.	7706462.cif
261131	2021-01-22	cif/ Adding structures of 7706462, 7706463, 7706464, 7706465 via cif-deposit CGI script.	7706462.cif