Crystallography Open Database

Information card for entry 2101262

Preview

Coordinates	2101262.cif
Original IUCr paper	HTML

Structure parameters

Formula	C6 H12 O6
Calculated formula	C3 H6 O3
SMILES	OC[C@H]1O[C@@H](O)[C@@H]([C@H]([C@@H]1O)O)O
Title of publication	Attempted prediction of the crystal structures of six monosaccharides
Authors of publication	van Eijck, B. P.; Mooij, W. T. M.; Kroon, J.
Journal of publication	Acta Crystallographica Section B
Year of publication	1995
Journal volume	51
Journal issue	1
Pages of publication	99 - 103
a	6.05 Å
b	9.35 Å
c	11.87 Å
α	90°
β	90°
γ	90°
Cell volume	671.456 Å³
Number of distinct elements	3
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKa
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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