Crystallography Open Database

Information card for entry 1520226

1520225 << 1520226 >> 1520227

Preview

Coordinates	1520226.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	dimethyl melamine hydrochloride
Chemical name	Mela-DM?HCl
Formula	C5 H11 Cl N6
Calculated formula	C5 H11 Cl N6
Title of publication	Self-assembling 1D core/shell microrods by the introduction of additives: a one-pot and shell-tunable method
Authors of publication	Xu, Jun; Yu, Hongde; Yang, Liulin; Wu, Guanglu; Wang, Zhiqiang; Wang, Dong; Zhang, Xi
Journal of publication	Chem. Sci.
Year of publication	2015
Journal volume	6
Journal issue	8
Pages of publication	4907
a	6.4782 ± 0.0013 Å
b	9.5193 ± 0.0019 Å
c	14.311 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	882.5 ± 0.3 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	4
Space group number	53
Hermann-Mauguin space group symbol	P m n a
Hall space group symbol	-P 2ac 2
Residual factor for all reflections	0.0476
Residual factor for significantly intense reflections	0.0355
Weighted residual factors for significantly intense reflections	0.092
Weighted residual factors for all reflections included in the refinement	0.1214
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1520226.cif
153073	2015-08-08	cif/ Updating files of 1520226 Original log message: Adding full bibliography for 1520226.cif.	1520226.cif
137846	2015-06-04	cif/ Adding structures of 1520226 via cif-deposit CGI script.	1520226.cif