Crystallography Open Database

Information card for entry 7703299

Preview

Coordinates	7703299.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C99.97 H156.95 K2 N8 O11.96 W2
Calculated formula	C99.97 H156.94 K2 N8 O11.96 W2
Title of publication	Formation of a dimeric tungsten(i) complex via C-H activation.
Authors of publication	Noor, Awal; Qayyum, Sadaf; Schwarz, Stefan; Dietel, Thomas; Kempe, Rhett
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	6
Pages of publication	1992 - 1996
a	13.358 ± 0.005 Å
b	24.83 ± 0.005 Å
c	17.125 ± 0.005 Å
α	90 ± 0.005°
β	93.678 ± 0.005°
γ	90 ± 0.005°
Cell volume	5668 ± 3 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1214
Residual factor for significantly intense reflections	0.0858
Weighted residual factors for significantly intense reflections	0.2061
Weighted residual factors for all reflections included in the refinement	0.2335
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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