Crystallography Open Database

Information card for entry 4086607

Preview

Coordinates	4086607.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H68 O2 P2 Pt Ru2
Calculated formula	C38 H68 O2 P2 Pt Ru2
SMILES	[c]12([c]3([c]4([c]5([c]1(C)[Ru]162345(C#[O])[Pt]23([H][Ru]45783([P]2(C(C)(C)C)C(C)(C)C)([c]2([c]4([c]5([c]7([c]82C)C)C)C)C)C#[O])([H]1)[P]6(C(C)(C)C)C(C)(C)C)C)C)C)C
Title of publication	Synthesis of a Heterometallic Trinuclear Cluster of Ruthenium and Platinum with a Linear Alignment
Authors of publication	Kuzutani, Takuya; Torihata, Yushi; Suzuki, Hiroharu; Takao, Toshiro
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	15
Pages of publication	2543
a	8.752 ± 0.0005 Å
b	10.7962 ± 0.0006 Å
c	12.7446 ± 0.0006 Å
α	67.263 ± 0.001°
β	74.113 ± 0.002°
γ	69.112 ± 0.002°
Cell volume	1024.65 ± 0.1 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0306
Residual factor for significantly intense reflections	0.0285
Weighted residual factors for significantly intense reflections	0.0655
Weighted residual factors for all reflections included in the refinement	0.067
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
186256 (current)	2016-09-07	cif/ Updating files of 4086605, 4086606, 4086607, 4086608, 4086609, 4086610, 4086611 Original log message: Adding full bibliography for 4086605--4086611.cif.	4086607.cif
184694	2016-07-28	cif/ Adding structures of 4086605, 4086606, 4086607, 4086608, 4086609, 4086610, 4086611 via cif-deposit CGI script.	4086607.cif