Crystallography Open Database

Information card for entry 7131558

Preview

Coordinates	7131558.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53.5 H50 B F6 P5 Pt
Calculated formula	C53.5 H50 B F6 P5 Pt
Title of publication	A hampered oxidative addition of pre-coordinated pincer ligands can favour alternative pathways of activation.
Authors of publication	Wehmeyer, Frerk-Ulfert; Langer, Robert
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2023
Journal volume	59
Journal issue	40
Pages of publication	6004 - 6007
a	11.728 ± 0.002 Å
b	26.813 ± 0.005 Å
c	17.242 ± 0.003 Å
α	90°
β	102.88 ± 0.03°
γ	90°
Cell volume	5285.5 ± 1.7 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 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	0.0693
Residual factor for significantly intense reflections	0.0591
Weighted residual factors for significantly intense reflections	0.1385
Weighted residual factors for all reflections included in the refinement	0.1456
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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