Crystallography Open Database

Information card for entry 7206330

7206329 << 7206330 >> 7206331

Preview

Coordinates	7206330.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H72 Mn3 Mo12 N8 O69 P8
Calculated formula	C12 H44 Mn3 Mo12 N8 O69 P8
Title of publication	Effects of organoamine template and transition metal coordination mode on the self-assembly of reduced polyoxomolybdenum phosphate
Authors of publication	Yan, Dawei; Fu, Jie; Zheng, Lei; Zhang, Zhibin; Xu, Yan; Zhu, Xiaolei; Zhu, Dunru
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	16
Pages of publication	5133
a	11.9677 ± 0.0011 Å
b	12.2012 ± 0.0011 Å
c	14.7386 ± 0.0013 Å
α	67.613 ± 0.001°
β	74.527 ± 0.001°
γ	63.724 ± 0.001°
Cell volume	1771.8 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.036
Residual factor for significantly intense reflections	0.0316
Weighted residual factors for significantly intense reflections	0.0925
Weighted residual factors for all reflections included in the refinement	0.1037
Goodness-of-fit parameter for all reflections included in the refinement	1.117
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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