Crystallography Open Database

Information card for entry 7219318

7219317 << 7219318 >> 7219319

Preview

Coordinates	7219318.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H5 N O2
Calculated formula	C2 H5 N O2
SMILES	O=C([O-])C[NH3+]
Title of publication	Attrition-induced spontaneous chiral amplification of the γ polymorphic modification of glycine
Authors of publication	Tarasevych, Arkadii V.; Sorochinsky, Alexander E.; Kukhar, Valery P.; Toupet, Loïc; Crassous, Jeanne; Guillemin, Jean-Claude
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	7
Pages of publication	1513
a	7.0047 ± 0.0002 Å
b	7.0047 ± 0.0002 Å
c	5.4772 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	232.739 ± 0.016 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	4
Space group number	144
Hermann-Mauguin space group symbol	P 31
Hall space group symbol	P 31
Residual factor for all reflections	0.077
Residual factor for significantly intense reflections	0.077
Weighted residual factors for significantly intense reflections	0.2202
Weighted residual factors for all reflections included in the refinement	0.2202
Goodness-of-fit parameter for all reflections included in the refinement	1.229
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180524 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/93.	7219318.cif
133161	2015-03-06	cif/ Updating files of 7219316, 7219317, 7219318, 7219319 Original log message: Adding full bibliography for 7219316--7219319.cif.	7219318.cif
129681	2015-01-16	cif/ Adding structures of 7219316, 7219317, 7219318, 7219319 via cif-deposit CGI script.	7219318.cif