Crystallography Open Database

Information card for entry 7720348

7720347 << 7720348 >> 7720349

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Coordinates	7720348.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H52 Cl8 Mo2 N2 O2
Calculated formula	C44 H50 Cl6 Mo2 N2 O2
Title of publication	Molybdenum(VI) borano-imido complexes and their application as Lewis acid catalysts in homocoupling of diazo compounds
Authors of publication	Škoch, Karel; Buziková, Michaela; Jakubczyk, Michal; Pattanamcheril Anilkumar, Krishna; Demel, Jan; Litecká, Miroslava
Journal of publication	Dalton Transactions
Year of publication	2026
a	9.709 ± 0.0005 Å
b	9.9534 ± 0.0007 Å
c	13.4743 ± 0.0009 Å
α	81.729 ± 0.005°
β	88.599 ± 0.005°
γ	69.331 ± 0.006°
Cell volume	1205.15 ± 0.14 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 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	0.0352
Residual factor for significantly intense reflections	0.0333
Weighted residual factors for significantly intense reflections	0.0848
Weighted residual factors for all reflections included in the refinement	0.0863
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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