Crystallography Open Database

Information card for entry 7121073

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Structure parameters

Formula	C52 H58 N2
Calculated formula	C52 H58 N2
SMILES	N(/C(=N/c1c(cccc1C(C)C)C(C)C)C(C)(C)C)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C(C)C)C(c1ccccc1)c1ccccc1
Title of publication	Kinetic stabilisation of a molecular strontium hydride complex using an extremely bulky amidinate ligand.
Authors of publication	de Bruin-Dickason, Caspar N; Sutcliffe, Thomas; Alvarez Lamsfus, Carlos; Deacon, Glen B.; Maron, Laurent; Jones, Cameron
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	7
Pages of publication	786 - 789
a	17.6472 ± 0.0009 Å
b	22.0745 ± 0.0011 Å
c	10.8828 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	4239.4 ± 0.4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	3
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0783
Residual factor for significantly intense reflections	0.0503
Weighted residual factors for significantly intense reflections	0.1086
Weighted residual factors for all reflections included in the refinement	0.1234
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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