Crystallography Open Database

Information card for entry 7717373

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Coordinates	7717373.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H30 B F6 N2 P3
Calculated formula	C34 H30 B F6 N2 P3
Title of publication	Evidence of boride-borylene ligand-tautomerism leading to a remote C-C-bond and concomitant boryl ligand formation.
Authors of publication	Wehmeyer, Frerk-Ulfert; Li, Yinwu; Schlossarek, Anne; Ke, Zhuofeng; Langer, Robert
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	54
Journal issue	1
Pages of publication	389 - 395
a	10.456 ± 0.002 Å
b	10.633 ± 0.002 Å
c	16.833 ± 0.003 Å
α	83.37 ± 0.03°
β	77.74 ± 0.03°
γ	62.19 ± 0.03°
Cell volume	1617.3 ± 0.7 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 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	0.0434
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0969
Weighted residual factors for all reflections included in the refinement	0.101
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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