Crystallography Open Database

Information card for entry 7027127

Preview

Coordinates	7027127.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H17 In2 N2 O17 P3
Calculated formula	C6 In2 N2 O17 P3
Title of publication	Organically templated inorganic/organic hybrid materials: hydrothermal synthesis and structural characterization of [C4H12N2][In2(C2O4)(HPO4)3]·H2O
Authors of publication	Huang, Yuh-Feng; Lii, Kwang-Hwa
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1998
Journal issue	24
Pages of publication	4085
a	6.5052 ± 0.0002 Å
b	17.5005 ± 0.0002 Å
c	8.1811 ± 0.0002 Å
α	90°
β	107.656 ± 0.001°
γ	90°
Cell volume	887.5 ± 0.04 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0562
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for all reflections	0.1012
Weighted residual factors for significantly intense reflections	0.0944
Goodness-of-fit parameter for all reflections	0.999
Goodness-of-fit parameter for significantly intense reflections	1.008
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7027127.html