Crystallography Open Database

Information card for entry 4342632

Preview

Coordinates	4342632.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H162 Br2 Cr Mo6 N5 O24
Calculated formula	C70 H162 Br2 Cr Mo6 N5 O24
Title of publication	Step-by-Step Strategy from Achiral Precursors to Polyoxometalates-Based Chiral Organic-Inorganic Hybrids.
Authors of publication	Zhang, Jiangwei; Luo, Jianhui; Wang, Pingmei; Ding, Bin; Huang, Yichao; Zhao, Zhenlin; Zhang, Jin; Wei, Yongge
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	6
Pages of publication	2551 - 2559
a	16.5994 ± 0.0003 Å
b	26.2375 ± 0.0006 Å
c	22.12 ± 0.0004 Å
α	90°
β	91.7125 ± 0.0017°
γ	90°
Cell volume	9629.5 ± 0.3 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0532
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.0893
Weighted residual factors for all reflections included in the refinement	0.1086
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179529 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/26.	4342632.cif
134780	2015-04-04	cif/ Updating files of 4342631, 4342632, 4342633, 4342634, 4342635, 4342636, 4342637 Original log message: Adding full bibliography for 4342631--4342637.cif.	4342632.cif
133140	2015-03-06	cif/ Adding structures of 4342631, 4342632, 4342633, 4342634, 4342635, 4342636, 4342637 via cif-deposit CGI script.	4342632.cif