Crystallography Open Database

Information card for entry 4108077

Preview

Coordinates	4108077.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Ph3Sn{(CO)5W}P3Nb(N[Np]Ar)3 O(SiMe3)2
Formula	C68 H93 N3 Nb O6 P3 Si2 Sn W
Calculated formula	C68 H93 N3 Nb O6 P3 Si2 Sn W
Title of publication	P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes
Authors of publication	Nicholas A. Piro; Christopher C. Cummins
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	9524 - 9535
a	12.1488 ± 0.0008 Å
b	13.9473 ± 0.0009 Å
c	24.4655 ± 0.0015 Å
α	75.719 ± 0.001°
β	79.17 ± 0.001°
γ	66.612 ± 0.001°
Cell volume	3668.4 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0591
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for significantly intense reflections	0.0662
Weighted residual factors for all reflections included in the refinement	0.0746
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

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