Test Crystallography Open Database

Information card for entry 2000041

2000040 << 2000041 >> 2000042

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Coordinates	2000041.cif
Original IUCr paper	HTML

Structure parameters

Formula	C6 H7 Cs O7
Calculated formula	C6 H7 Cs O7
Title of publication	Crystal structure of caesium dihydrogen citrate from laboratory X-ray powder diffraction data and DFT comparison
Authors of publication	Rammohan, Alagappa; Kaduk, James A.
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2017
Journal volume	73
Journal issue	2
Pages of publication	133 - 136
a	8.7362 Å
b	20.5351 Å
c	5.1682 Å
α	90°
β	90°
γ	90°
Cell volume	927.169 Å³
Cell temperature	300 K
Number of distinct elements	4
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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