Crystallography Open Database

Information card for entry 7023749

Preview

Coordinates	7023749.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H39 Cu O4 P2
Calculated formula	C41 H39 Cu O4 P2
Title of publication	Copper(ii) and triphenylphosphine copper(i) ethylene glycol carboxylates: synthesis, characterisation and copper nanoparticle generation.
Authors of publication	Adner, David; Möckel, Stefan; Korb, Marcus; Buschbeck, Roy; Rüffer, Tobias; Schulze, Steffen; Mertens, Lutz; Hietschold, Michael; Mehring, Michael; Lang, Heinrich
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	44
Pages of publication	15599 - 15609
a	21.2391 ± 0.0002 Å
b	10.7028 ± 0.0001 Å
c	30.5782 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	6950.97 ± 0.11 Å³
Cell temperature	115 ± 2 K
Ambient diffraction temperature	115 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0404
Residual factor for significantly intense reflections	0.0346
Weighted residual factors for significantly intense reflections	0.0913
Weighted residual factors for all reflections included in the refinement	0.0929
Goodness-of-fit parameter for all reflections included in the refinement	0.962
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179942 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/37.	7023749.cif
90622	2013-11-18	cif/ Adding structures of 7023746, 7023747, 7023748, 7023749 via cif-deposit CGI script.	7023749.cif