Crystallography Open Database

Information card for entry 4339291

Preview

Coordinates	4339291.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Zn(DHP)](DMF)2
Formula	C12 H18 N2 O10 P2 Zn
Calculated formula	C12 H18 N2 O10 P2 Zn
Title of publication	Crystalline zinc diphosphonate metal-organic framework with three-dimensional microporosity.
Authors of publication	Liang, Junmei; Shimizu, George K. H.
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	25
Pages of publication	10449 - 10451
a	15.53 ± 0.003 Å
b	14.008 ± 0.003 Å
c	9.1571 ± 0.0018 Å
α	90°
β	103.94 ± 0.03°
γ	90°
Cell volume	1933.4 ± 0.7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0296
Residual factor for significantly intense reflections	0.0267
Weighted residual factors for significantly intense reflections	0.0675
Weighted residual factors for all reflections included in the refinement	0.0831
Goodness-of-fit parameter for all reflections included in the refinement	1.139
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
179495 (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 4/33/92.	4339291.cif
117254	2014-06-14	cif/ Adding structures of 4339291 via cif-deposit CGI script.	4339291.cif