Crystallography Open Database

Information card for entry 4311957

4311956 << 4311957 >> 4311958

Preview

Coordinates	4311957.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C65 H66 Cl2 F12 N12 O P2 Pt2
Calculated formula	C65 H66 Cl2 F12 N12 O P2 Pt2
SMILES	[Pt]12(Cl)[n]3ccccc3c3cc(cc([n]13)c1cccc[n]21)c1cc(cc2C(c3cc(cc(c4cc5[n]6[Pt](Cl)([n]7ccccc57)[n]5c(cccc5)c6c4)c3Oc12)C(C)(C)C)(C)C)C(C)(C)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].N#CC.N#CC.N#CC.N#CC.N#CC.N#CC
Title of publication	A Platinum-Ruthenium Dinuclear Complex Bridged by Bis(terpyridyl)xanthene
Authors of publication	Rei Okamura; Tohru Wada; Katsuji Aikawa; Toshi Nagata; Koji Tanaka
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	7210 - 7217
a	13.841 ± 0.007 Å
b	14.377 ± 0.007 Å
c	19.442 ± 0.01 Å
α	95.226 ± 0.007°
β	100.167 ± 0.005°
γ	110.974 ± 0.007°
Cell volume	3505 ± 3 Å³
Cell temperature	173.1 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 significantly intense reflections	0.0649
Weighted residual factors for all reflections included in the refinement	0.1553
Goodness-of-fit parameter for all reflections included in the refinement	1.52
Diffraction radiation wavelength	0.7107 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.	4311957.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4311957.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4311957.cif
3459	2010-11-15	../uploads/cif-deposit/cod/cif Adding structures of 4311957 via cif-deposit CGI script.	4311957.cif