Crystallography Open Database

Information card for entry 1540629

Preview

Coordinates	1540629.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C114 H158 Mo2 N10 O8
Calculated formula	C114 H158 Mo2 N10 O8
Title of publication	Molybdenum (VI) Imido Complexes Derived from Chelating Phenols: Synthesis, Characterization and ɛ-Caprolactone ROP Capability
Authors of publication	Al-Khafaji, Yahya; Prior, Timothy; Elsegood, Mark; Redshaw, Carl
Journal of publication	Catalysts
Year of publication	2015
Journal volume	5
Journal issue	4
Pages of publication	1928
a	13.0178 ± 0.0008 Å
b	13.4853 ± 0.0008 Å
c	16.9177 ± 0.001 Å
α	106.113 ± 0.001°
β	96.4972 ± 0.001°
γ	92.7062 ± 0.001°
Cell volume	2825.3 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction 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	0.0643
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for significantly intense reflections	0.0969
Weighted residual factors for all reflections included in the refinement	0.1074
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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