Crystallography Open Database

Information card for entry 4308925

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Coordinates	4308925.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	P,P'-diphenylmethylenediphosphinate copper(II) tris-aquo
Formula	C13 H18 Cu O7 P2
Calculated formula	C13 H12 Cu O7 P2
Title of publication	Inorganic-Organic Hybrids Formed by P,P'-Diphenylmethylenediphosphinate, pcp2-, with the Cu2+ Ion. X-ray Crystal Structures of [Cu(pcp)(H2O)2].H2O and [Cu(pcp)(bipy)(H2O)]
Authors of publication	Samuele Ciattini; Ferdinando Costantino; Pablo Lorenzo-Luis; Stefano Midollini; Annabella Orlandini; Alberto Vacca
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	4008 - 4016
a	19.49 ± 0.008 Å
b	9.443 ± 0.003 Å
c	9.434 ± 0.003 Å
α	90°
β	110.37 ± 0.03°
γ	90°
Cell volume	1627.7 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0877
Residual factor for significantly intense reflections	0.066
Weighted residual factors for significantly intense reflections	0.1562
Weighted residual factors for all reflections included in the refinement	0.1689
Goodness-of-fit parameter for all reflections included in the refinement	0.99
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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