Crystallography Open Database

Information card for entry 4334983

Preview

Coordinates	4334983.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H18 N2 O9 P3 Zn2
Calculated formula	C8 H18 N2 O9 P3 Zn2
Title of publication	Ionothermal Synthesis of Chiral Metal Phosphite Open Frameworks with In Situ Generated Organic Templates
Authors of publication	Li-Ming Li; Kai Cheng; Fei Wang; Jian Zhang
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	5654 - 5656
a	9.8355 ± 0.0005 Å
b	9.8355 ± 0.0005 Å
c	15.6659 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	1312.44 ± 0.1 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	152
Hermann-Mauguin space group symbol	P 31 2 1
Hall space group symbol	P 31 2"
Residual factor for all reflections	0.0366
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.076
Weighted residual factors for all reflections included in the refinement	0.0778
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179452 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/49.	4334983.cif
100869	2014-02-07	cif/ Adding structures of 4334983 via cif-deposit CGI script.	4334983.cif