Crystallography Open Database

Information card for entry 4083906

Preview

Coordinates	4083906.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46.5 H33 Cl2 N4 Rh
Calculated formula	C46.5 H33 Cl2 N4 Rh
Title of publication	Alkylation of Rhodium Porphyrins Using Ammonium and Quinolinium Salts
Authors of publication	Thompson, Samuel J.; Dong, Guangbin
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	14
Pages of publication	3757
a	11.235 ± 0.0008 Å
b	13.1958 ± 0.001 Å
c	13.8948 ± 0.001 Å
α	104.215 ± 0.002°
β	107.305 ± 0.002°
γ	99.963 ± 0.002°
Cell volume	1837.9 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0825
Residual factor for significantly intense reflections	0.0597
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.1178
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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
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.	4083906.cif
121329	2014-08-05	cif/ Updating files of 4083903, 4083904, 4083905, 4083906, 4083907 Original log message: Adding full bibliography for 4083903--4083907.cif.	4083906.cif
119597	2014-07-08	cif/ Adding structures of 4083903, 4083904, 4083905, 4083906, 4083907 via cif-deposit CGI script.	4083906.cif