Crystallography Open Database

Information card for entry 7214579

Preview

Coordinates	7214579.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H48 Cl8 N6 O6 P2 Zn2
Calculated formula	C24 H48 Cl8 N6 O6 P2 Zn2
Title of publication	Isomorphic Co(ii) and Zn(ii) phosphonates: co-crystal formation of [{M2(η1-DMPzH)4(Cl3CPO3)2}{M(η1-DMPzH)2Cl2}2](toluene)2 (M = Co(ii) and Zn(ii))
Authors of publication	Chandrasekhar, Vadapalli; Sahoo, Dipankar; Metre, Ramesh K.
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	37
Pages of publication	7419
a	12.267 ± 0.005 Å
b	13.569 ± 0.005 Å
c	14.029 ± 0.005 Å
α	87.78 ± 0.005°
β	70.635 ± 0.005°
γ	71.328 ± 0.005°
Cell volume	2081.1 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0325
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.062
Weighted residual factors for all reflections included in the refinement	0.0646
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180476 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/45.	7214579.cif
110311	2014-04-18	cif/ Adding structures of 7214576, 7214577, 7214578, 7214579 via cif-deposit CGI script.	7214579.cif