Crystallography Open Database

Information card for entry 7021594

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Coordinates	7021594.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H64 B2 N2 Si4 U
Calculated formula	C28 H64 B2 N2 Si4 U
SMILES	[BH]1(C[Si](C)(C)N([U]N([Si](C)(C)C)[Si](C)(C)C[BH]2C3CCCC2CCC3)[Si](C)(C)C)C2CCCC1CCC2
Title of publication	Uranium(iv) amido-borohydrides as highly active diene polymerisation catalysts.
Authors of publication	Mansell, Stephen M.; Bonnet, Fanny; Visseaux, Marc; Arnold, Polly L.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	25
Pages of publication	9033 - 9039
a	12.6359 ± 0.0001 Å
b	12.6359 ± 0.0001 Å
c	22.6693 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	3619.52 ± 0.05 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	6
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.0311
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.05
Weighted residual factors for all reflections included in the refinement	0.0515
Goodness-of-fit parameter for all reflections included in the refinement	1.089
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179920 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/15.	7021594.cif
87134	2013-07-14	cif/ Adding structures of 7021593, 7021594 via cif-deposit CGI script.	7021594.cif