Crystallography Open Database

Information card for entry 4342231

Preview

Coordinates	4342231.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H31 Cl2 N O2.5 P Rh
Calculated formula	C31 H31 Cl2 N O2.5 P Rh
Title of publication	Design, Synthesis, and Characterization of Hybrid Metal-Ligand Hydrogen-Bonded (MLHB) Supramolecular Architectures.
Authors of publication	Sommer, Samantha K.; Zakharov, Lev N.; Pluth, Michael D.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	1912 - 1918
a	8.9031 ± 0.0007 Å
b	16.4605 ± 0.0013 Å
c	21.474 ± 0.0017 Å
α	90°
β	95.794 ± 0.001°
γ	90°
Cell volume	3130.9 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
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	0.1067
Residual factor for significantly intense reflections	0.0626
Weighted residual factors for significantly intense reflections	0.128
Weighted residual factors for all reflections included in the refinement	0.143
Goodness-of-fit parameter for all reflections included in the refinement	1.106
Diffraction radiation wavelength	0.71073 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.	4342231.cif
132810	2015-03-04	cif/ Updating files of 4342231, 4342232, 4342233 Original log message: Adding full bibliography for 4342231--4342233.cif.	4342231.cif
130436	2015-02-04	cif/ Adding structures of 4342231 via cif-deposit CGI script.	4342231.cif