Crystallography Open Database

Information card for entry 4089336

Preview

Coordinates	4089336.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	RuTp(PPh~2~NHPh)~2~Cl.CHCl~3~ (2a.CHCl3)
Formula	C46 H43 B Cl4 N8 P2 Ru
Calculated formula	C46.0019 H43 B Cl4 N8 P2 Ru
Title of publication	Reactions of the Cationic Fragments [RuCp(PPh2NHR)2]+and [RuTp(PPh2NHR)2]+(R = Ph,n-Pr) with Alkynes: Formation of Four-Membered Azaphosphacarbenes
Authors of publication	Pavlik, Sonja; Mereiter, Kurt; Puchberger, Michael; Kirchner, Karl
Journal of publication	Organometallics
Year of publication	2005
Journal volume	24
Journal issue	14
Pages of publication	3561
a	11.005 ± 0.002 Å
b	21.85 ± 0.003 Å
c	20.272 ± 0.003 Å
α	90°
β	103.544 ± 0.002°
γ	90°
Cell volume	4739 ± 1.3 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	7
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	0.036
Residual factor for significantly intense reflections	0.0291
Weighted residual factors for significantly intense reflections	0.0699
Weighted residual factors for all reflections included in the refinement	0.0738
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
243613 (current)	2019-11-26	cif/ Adding structures of 4089335, 4089336, 4089337, 4089338, 4089339, 4089340, 4089341, 4089342, 4089343, 4089344 via cif-deposit CGI script.	4089336.cif