Crystallography Open Database

Information card for entry 7036776

Preview

Coordinates	7036776.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H118 N2 Nb2 O6 P6
Calculated formula	C94 H124 N2 Nb2 O6 P6
Title of publication	Assembly and stabilization of {E(cyclo-P3)2} (E = Sn, Pb) as a bridging ligand spanning two triaryloxyniobium units.
Authors of publication	Velian, Alexandra; Cossairt, Brandi M.; Cummins, Christopher C.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	5
Pages of publication	1891 - 1895
a	10.4029 ± 0.0007 Å
b	13.7294 ± 0.001 Å
c	16.3434 ± 0.0012 Å
α	94.929 ± 0.001°
β	93.683 ± 0.001°
γ	95.884 ± 0.001°
Cell volume	2307.1 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 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	0.0837
Residual factor for significantly intense reflections	0.0461
Weighted residual factors for significantly intense reflections	0.0829
Weighted residual factors for all reflections included in the refinement	0.0982
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
176068 (current)	2016-02-05	cif/ Updating files of 7036776, 7036777, 7036778, 7036779, 7036780, 7036781 Original log message: Adding full bibliography for 7036776--7036781.cif.	7036776.cif
160979	2015-10-08	cif/ Adding structures of 7036776, 7036777, 7036778, 7036779, 7036780, 7036781 via cif-deposit CGI script.	7036776.cif