Crystallography Open Database

Information card for entry 4102569

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Coordinates	4102569.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H32 Co Fe2 N14 O4
Calculated formula	C38 H20 Co Fe2 N14 O4
Title of publication	Photoinduced Metal-to-Metal Charge Transfer toward Single-Chain Magnet
Authors of publication	Tao Liu; Yan-Juan Zhang; Shinji Kanegawa; Osamu Sato
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	8250 - 8251
a	11.059 ± 0.002 Å
b	28.269 ± 0.006 Å
c	6.625 ± 0.001 Å
α	90°
β	113.79 ± 0.03°
γ	90°
Cell volume	1895.2 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0714
Residual factor for significantly intense reflections	0.0594
Weighted residual factors for significantly intense reflections	0.1307
Weighted residual factors for all reflections included in the refinement	0.1369
Goodness-of-fit parameter for all reflections included in the refinement	1.179
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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