Crystallography Open Database

Information card for entry 4068908

Preview

Coordinates	4068908.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H46 B2 F8 N3 O P2 Rh
Calculated formula	C28 H46 B2 F8 N3 O P2 Rh
Title of publication	Synthesis, Structure, and Reactivity of Nitrosyl Pincer-Type Rhodium Complexes
Authors of publication	Gaviglio, Carina; Ben-David, Yehoshoa; Shimon, Linda J. W.; Doctorovich, Fabio; Milstein, David
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	6
Pages of publication	1917
a	11.705 ± 0.002 Å
b	16.359 ± 0.003 Å
c	19.271 ± 0.004 Å
α	90°
β	98.26 ± 0.03°
γ	90°
Cell volume	3651.8 ± 1.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	8
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	0.0658
Residual factor for significantly intense reflections	0.0468
Weighted residual factors for significantly intense reflections	0.1266
Weighted residual factors for all reflections included in the refinement	0.136
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
178579 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/89.	4068908.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4068908.cif
40036	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4068908 via cif-deposit CGI script.	4068908.cif