Crystallography Open Database

Information card for entry 7121140

Preview

Coordinates	7121140.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bis(aqua)tetrakis(μ-2cyano)copper(II) dibromoplatinate(IV)
Formula	C4 H4 Br2 Cu N4 O2 Pt
Calculated formula	C4 H3 Br2 Cu N4 O2 Pt
Title of publication	Designing anisotropic cyanometallate coordination polymers with unidirectional thermal expansion (TE): 2D zero and 1D colossal positive TE.
Authors of publication	Sergeenko, Ania S.; Ovens, Jeffrey S.; Leznoff, Daniel B.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	13
Pages of publication	1599 - 1602
a	6.3039 ± 0.0006 Å
b	14.2946 ± 0.0013 Å
c	6.564 ± 0.0006 Å
α	90°
β	110.207 ± 0.002°
γ	90°
Cell volume	555.09 ± 0.09 Å³
Cell temperature	135 ± 2 K
Ambient diffraction temperature	135 ± 2 K
Number of distinct elements	7
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0265
Residual factor for significantly intense reflections	0.0141
Weighted residual factors for significantly intense reflections	0.0309
Weighted residual factors for all reflections included in the refinement	0.0338
Goodness-of-fit parameter for all reflections included in the refinement	1.074
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
228383 (current)	2019-11-17	cif/ Updating files of 7121140 Original log message: Adding full bibliography for 7121140.cif.	7121140.cif
205232	2018-01-16	cif/ Adding structures of 7121140 via cif-deposit CGI script.	7121140.cif