Crystallography Open Database

Information card for entry 7039234

Preview

Coordinates	7039234.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H52 B Cl F24 N4 O4 Rh2
Calculated formula	C58 H52 B Cl F24 N4 O4 Rh2
Title of publication	Coordination chemistry of a calix[4]arene-based NHC ligand: dinuclear complexes and comparison to I(i)Pr2Me2.
Authors of publication	Patchett, Ruth; Chaplin, Adrian B.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	21
Pages of publication	8945 - 8955
a	12.2319 ± 0.0003 Å
b	13.2693 ± 0.0003 Å
c	21.7143 ± 0.0004 Å
α	100.987 ± 0.0015°
β	94.9257 ± 0.0017°
γ	91.7507 ± 0.0018°
Cell volume	3443.07 ± 0.13 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0566
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.107
Weighted residual factors for all reflections included in the refinement	0.1152
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation probe	x-ray
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
185440 (current)	2016-08-07	cif/ Updating files of 7039227, 7039228, 7039229, 7039230, 7039231, 7039232, 7039233, 7039234, 7039235, 7039236 Original log message: Adding full bibliography for 7039227--7039236.cif.	7039234.cif
182873	2016-05-11	cif/ Adding structures of 7039227, 7039228, 7039229, 7039230, 7039231, 7039232, 7039233, 7039234, 7039235, 7039236 via cif-deposit CGI script.	7039234.cif