Crystallography Open Database

Information card for entry 4502607

Preview

Coordinates	4502607.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H14.5 Cl1.5 Cu1.75 N3 O12.75
Calculated formula	C9 H11 Cl1.5 Cu1.75 N3 O12.75
Title of publication	A Copper(II)-Cytidine Complex as a Building Unit for the Construction of an Unusual Three-Dimensional Coordination Polymer
Authors of publication	Marino, Nadia; Armentano, Donatella; Mastropietro, Teresa F.; Julve, Miguel; Lloret, Francesc; De Munno, Giovanni
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	4
Pages of publication	1757
a	11.0389 ± 0.0013 Å
b	22.784 ± 0.003 Å
c	31.28 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	7867.2 ± 1.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	22
Hermann-Mauguin space group symbol	F 2 2 2
Hall space group symbol	F 2 2
Residual factor for all reflections	0.074
Residual factor for significantly intense reflections	0.0637
Weighted residual factors for significantly intense reflections	0.2075
Weighted residual factors for all reflections included in the refinement	0.219
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4502607.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502607.cif
36488	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502607 via cif-deposit CGI script.	4502607.cif