Crystallography Open Database

Information card for entry 4500705

Preview

Coordinates	4500705.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H24 Cu F12 N4 O P2
Calculated formula	C23 H23 Cu F12 N4 O P2
Title of publication	Rational Construction of Wide Coordination Space and Control of Adsorption Properties in One-Dimensional Cu(II) Coordination Polymer
Authors of publication	Noro, Shin-ichiro; Fukuhara, Katsuo; Kubo, Kazuya; Nakamura, Takayoshi
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	6
Pages of publication	2379
a	12.8912 ± 0.0006 Å
b	13.1722 ± 0.0005 Å
c	17.114 ± 0.0007 Å
α	90°
β	96.0184 ± 0.0014°
γ	90°
Cell volume	2890 ± 0.2 Å³
Cell temperature	173.1 K
Ambient diffraction temperature	173.1 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0442
Weighted residual factors for all reflections included in the refinement	0.0587
Goodness-of-fit parameter for all reflections included in the refinement	1.209
Diffraction radiation wavelength	0.71075 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.	4500705.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500705.cif
34592	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500705 via cif-deposit CGI script.	4500705.cif