Crystallography Open Database

Information card for entry 4071803

Preview

Coordinates	4071803.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H51 N4 Rh
Calculated formula	C56 H43 N4 Rh
Title of publication	Base-Promoted Carbon−Hydrogen Bond Activation of Alkanes with Rhodium(III) Porphyrin Complexes
Authors of publication	Chan, Yun Wai; Chan, Kin Shing
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	18
Pages of publication	4625
a	10.578 ± 0.002 Å
b	14.574 ± 0.003 Å
c	16.226 ± 0.004 Å
α	65.745 ± 0.004°
β	77.764 ± 0.004°
γ	82.348 ± 0.004°
Cell volume	2225.9 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0616
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.1124
Weighted residual factors for all reflections included in the refinement	0.1245
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
178607 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/18.	4071803.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4071803.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071803.cif
44051	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071803 via cif-deposit CGI script.	4071803.cif