Crystallography Open Database

Information card for entry 7016852

Preview

Structure parameters

Formula	C28 H24 N6
Calculated formula	C28 H24 N6
SMILES	c1(c2cnccc2)n(CCCCn2c(c3cnccc3)nc3c2cccc3)c2c(n1)cccc2
Title of publication	Two novel inorganic-organic hybrid materials constructed from two kinds of octamolybdate clusters and flexible tetradentate ligands.
Authors of publication	Liu, Hai-Yan; Bo, Liu; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Wu, Hua
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	38
Pages of publication	9782 - 9788
a	6.693 ± 0.0004 Å
b	9.4581 ± 0.0004 Å
c	9.7729 ± 0.0006 Å
α	71.507 ± 0.004°
β	71.631 ± 0.005°
γ	87.487 ± 0.004°
Cell volume	555.73 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0624
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.0983
Weighted residual factors for all reflections included in the refinement	0.1034
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7016852.html