Crystallography Open Database

Information card for entry 7219204

7219203 << 7219204 >> 7219205

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Coordinates	7219204.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C75 H84 Mn3 N30 O18
Calculated formula	C75 H72 Mn3 N30 O18
Title of publication	Structural diversities and magnetic properties of azide-containing coordination polymers based on flexible tetra-pyridinate ligands
Authors of publication	Yu, Fan; Xiang, Mi; Li, Ai-hua; Zhang, Yu-min; Li, Bao
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	7
Pages of publication	1556
a	9.6197 ± 0.0001 Å
b	9.6197 ± 0.0001 Å
c	28.4217 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	2277.74 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	152
Hermann-Mauguin space group symbol	P 31 2 1
Hall space group symbol	P 31 2"
Residual factor for all reflections	0.1228
Residual factor for significantly intense reflections	0.1162
Weighted residual factors for significantly intense reflections	0.3151
Weighted residual factors for all reflections included in the refinement	0.3272
Goodness-of-fit parameter for all reflections included in the refinement	1.119
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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