Crystallography Open Database

Information card for entry 4067104

Preview

Coordinates	4067104.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H52 B2 F8 Ir2 N2 P2
Calculated formula	C50 H52 B2 F8 Ir2 N2 P2
Title of publication	Dirhodium Complexes Bridged by Bis(diphenylphosphino)phthalazine (PNNPPh): Central Ring Size and Charge Effects As Compared with the Pyrazolate Derivative (PNNPPy)
Authors of publication	Yamaguchi, Takafumi; Koike, Takashi; Akita, Munetaka
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	23
Pages of publication	6493
a	11.458 ± 0.006 Å
b	11.136 ± 0.007 Å
c	37.99 ± 0.01 Å
α	90°
β	93.98 ± 0.03°
γ	90°
Cell volume	4836 ± 4 Å³
Cell temperature	213 K
Ambient diffraction temperature	213 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0713
Weighted residual factors for all reflections included in the refinement	0.2108
Goodness-of-fit parameter for all reflections included in the refinement	0.814
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4067104.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4067104.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4067104.cif
34085	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4067103, 4067104, 4067105, 4067106, 4067107, 4067108, 4067109, 4067110, 4067111, 4067112 via cif-deposit CGI script.	4067104.cif