Crystallography Open Database

Information card for entry 2008452

2008451 << 2008452 >> 2008453

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Coordinates	2008452.cif
Original IUCr paper	HTML

Structure parameters

Formula	C24 H27 Cl2 Mn N7 O8
Calculated formula	C24 H27 Cl2 Mn N7 O8
SMILES	C1C[N]2=Cc3cccc[n]3[Mn]34562[N]1(CC[N]3=Cc1cccc[n]51)CC[N]4=Cc1cccc[n]61.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
Title of publication	[Tris(2-pyridyl-κ<i>N</i>-methyleneamino-κ<i>N</i>-ethyl)amine-κ<i>N</i>]manganese(II) diperchlorate
Authors of publication	Qian, Ming; Gou, Shao-Hua; He, Ling; Zhou, Yu-Ming; Duan, Chun-Ying
Journal of publication	Acta Crystallographica Section C
Year of publication	1999
Journal volume	55
Journal issue	5
Pages of publication	742 - 744
a	10.068 ± 0.003 Å
b	10.068 ± 0.003 Å
c	16.728 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	1468.5 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	159
Hermann-Mauguin space group symbol	P 3 1 c
Hall space group symbol	P 3 -2c
Residual factor for all reflections	0.0844
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for all reflections	0.1267
Weighted residual factors for significantly intense reflections	0.1165
Goodness-of-fit parameter for all reflections	1.052
Goodness-of-fit parameter for significantly intense reflections	1.244
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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