Crystallography Open Database

Information card for entry 2203748

2203747 << 2203748 >> 2203749

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Structure parameters

Formula	C50 H76 N2 P4 Pt2
Calculated formula	C50 H76 N2 P4 Pt2
SMILES	c1(ccccc1)[Pt]([P](CC)(CC)CC)(C#Cc1cnc(c2ccc(C#C[Pt](c3ccccc3)([P](CC)(CC)CC)[P](CC)(CC)CC)cn2)cc1)[P](CC)(CC)CC
Title of publication	<i>trans</i>-(μ-5,5'-Diethynyl-2,2'-bipyridine)bis[phenylbis(triethylphosphine)platinum(II)]
Authors of publication	Khan, Muhammad S.; Al-Suti, Mohammed K.; Ahrens, Birte; Raithby, Paul R.; Teat, Simon J.
Journal of publication	Acta Crystallographica Section E
Year of publication	2004
Journal volume	60
Journal issue	6
Pages of publication	m735 - m737
a	9.2651 ± 0.0007 Å
b	16.684 ± 0.0014 Å
c	16.8258 ± 0.0014 Å
α	92.13 ± 0.002°
β	90.032 ± 0.002°
γ	94.958 ± 0.002°
Cell volume	2589.4 ± 0.4 Å³
Cell temperature	150 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0468
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.0654
Weighted residual factors for all reflections included in the refinement	0.0677
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.6941 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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