Crystallography Open Database

Information card for entry 7002265

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Structure parameters

Formula	C35 H42 N4
Calculated formula	C35 H42 N4
SMILES	[nH]1nc(c(c1/C=N/c1c(cccc1C(C)C)C(C)C)c1ccccc1)/C=N/c1c(cccc1C(C)C)C(C)C
Title of publication	Structural and magnetic variability of cobalt(II) complexes with bridging pyrazolate ligands bearing appended imine groups
Authors of publication	Sachse, Anna; Demeshko, Serhiy; Meyer, Franc
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	37
Pages of publication	7756 - 7764
a	27.719 ± 0.0014 Å
b	8.899 ± 0.0003 Å
c	25.4394 ± 0.0014 Å
α	90°
β	100.727 ± 0.004°
γ	90°
Cell volume	6165.5 ± 0.5 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	3
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	0.1073
Residual factor for significantly intense reflections	0.0617
Weighted residual factors for significantly intense reflections	0.1224
Weighted residual factors for all reflections included in the refinement	0.1383
Goodness-of-fit parameter for all reflections included in the refinement	0.999
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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