Crystallography Open Database

Information card for entry 7715930

Preview

Coordinates	7715930.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H57 Au O2 P Rh3
Calculated formula	C48 H57 Au O2 P Rh3
SMILES	[Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)[O]12[Rh]34567([Rh]89%10%111([Rh]1%12%1323([O]48)[CH]2=[CH]1CC[CH]%12=[CH]%13CC2)[CH]1=[CH]9CC[CH]%10=[CH]%11CC1)[CH]1=[CH]5CC[CH]6=[CH]7CC1.c1ccccc1
Title of publication	Effect of distal metal species on lewis basicity of a μ<sub>3</sub>-oxo ligand in a doubly oxo-bridged (μ<sub>3</sub>-O)[Rh(cod)]<sub>3</sub>(μ<sub>4</sub>-O)M core.
Authors of publication	Tsurugi, Hayato; Mori, Hiroki; Mori, Haruna; Nakamoto, Masami; Tanaka, Shinji; Mashima, Kazushi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	20
Pages of publication	8546 - 8549
a	9.4939 ± 0.0005 Å
b	23.9667 ± 0.0015 Å
c	18.8664 ± 0.0011 Å
α	90°
β	97.2108 ± 0.0013°
γ	90°
Cell volume	4258.9 ± 0.4 Å³
Cell temperature	113 K
Ambient diffraction temperature	113 K
Number of distinct elements	6
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	0.016
Residual factor for significantly intense reflections	0.0145
Weighted residual factors for significantly intense reflections	0.0347
Weighted residual factors for all reflections included in the refinement	0.035
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
293096 (current)	2024-07-05	cif/ Updating files of 7715930, 7715931 Original log message: Adding full bibliography for 7715930--7715931.cif.	7715930.cif
291466	2024-05-03	cif/ Adding structures of 7715930, 7715931 via cif-deposit CGI script.	7715930.cif