Crystallography Open Database

Information card for entry 4061491

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Coordinates	4061491.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H71 N6 Sc Si3
Calculated formula	C42 H71 N6 Sc Si3
SMILES	[Sc]12([n]3[n](c(cc3C)C)C([n]3[n]1c(cc3C)C)[n]1[n]2c(cc1C)C)(C[Si](C)(C)C)(C[Si](C)(C)C)C[Si](C)(C)C.c1(ccccc1)C.c1(ccccc1)C
Title of publication	A Family of Scandium and Yttrium Tris((trimethylsilyl)methyl) Complexes with Neutral N~3~ Donor Ligands
Authors of publication	Tredget, Cara S.; Lawrence, Sally C.; Ward, Benjamin D.; Howe, Robert G.; Cowley, Andrew R.; Mountford, Philip
Journal of publication	Organometallics
Year of publication	2005
Journal volume	24
Journal issue	13
Pages of publication	3136 - 3148
a	12.4871 ± 0.0002 Å
b	16.0885 ± 0.0002 Å
c	24.0879 ± 0.0003 Å
α	90°
β	101.265 ± 0.0004°
γ	90°
Cell volume	4745.99 ± 0.11 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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