Crystallography Open Database

Information card for entry 2100595

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Coordinates	2100595.cif
Original IUCr paper	HTML

Structure parameters

Common name	Serine
Chemical name	L-serine-d7
Formula	C3 D7 N O3
Calculated formula	C3 D7 N O3
Title of publication	High-pressure neutron diffraction study of L-serine-I and L-serine-II, and the structure of L-serine-III at 8.1 GPa
Authors of publication	S. A. Moggach; W. G. Marshall; S. Parsons
Journal of publication	Acta Crystallographica, Section B
Year of publication	2006
Journal volume	62
Journal issue	4
Pages of publication	815 - 825
a	6.5477 ± 0.0004 Å
b	9.5405 ± 0.0006 Å
c	5.6092 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	350.4 ± 0.04 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Cell measurement pressure	8100000 kPa
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Goodness-of-fit parameter for all reflections	0.381
Diffraction radiation probe	neutron
Diffraction radiation type	Neutron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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