Crystallography Open Database

Information card for entry 4313566

Preview

Coordinates	4313566.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Rh(III)TPP(Me)
Formula	C45 H31 N4 Rh
Calculated formula	C45 H31.12 N4 Rh
Title of publication	Complexation of Diphenyl(phenylacetenyl)phosphine to Rhodium(III) Tetraphenyl Porphyrins: Synthesis and Structural, Spectroscopic, and Thermodynamic Studies
Authors of publication	Eugen Stulz; Sonya M. Scott; Andrew D. Bond; Sijbren Otto; Jeremy K. M. Sanders
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	3086 - 3096
a	13.4741 ± 0.0005 Å
b	13.4741 ± 0.0005 Å
c	9.6462 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1751.28 ± 0.13 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	4
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.0434
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.0746
Weighted residual factors for all reflections included in the refinement	0.0753
Goodness-of-fit parameter for all reflections included in the refinement	1.15
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
179196 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/35.	4313566.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4313566.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4313566.cif
6635	2011-01-12	../uploads/cif-deposit/cod/cif Adding structures of 4313566 via cif-deposit CGI script.	4313566.cif