Crystallography Open Database

Information card for entry 4301150

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Coordinates	4301150.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H52 Ca N4
Calculated formula	C24 H52 Ca N4
SMILES	[Ca]1([N](C)(C)CC[N]1(C)C)(N1C(CCCC1(C)C)(C)C)N1C(CCCC1(C)C)(C)C
Title of publication	Alkyl-Substituted Amides as Ligands in Homometallic and Heterobimetallic Calcium Complexes
Authors of publication	Matthias Westerhausen; Carsten Glock; Helmar Görls
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	394 - 399
a	17.7149 ± 0.0007 Å
b	10.5141 ± 0.0004 Å
c	15.6061 ± 0.0005 Å
α	90°
β	110.466 ± 0.002°
γ	90°
Cell volume	2723.26 ± 0.18 Å³
Cell temperature	183 ± 2 K
Ambient diffraction temperature	183 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0821
Residual factor for significantly intense reflections	0.0665
Weighted residual factors for significantly intense reflections	0.1763
Weighted residual factors for all reflections included in the refinement	0.1848
Goodness-of-fit parameter for all reflections included in the refinement	1.157
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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