Crystallography Open Database

Information card for entry 4336664

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Coordinates	4336664.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H64 Cu2 N2 P6
Calculated formula	C48 H64 Cu2 N2 P6
Title of publication	Noninnocent Behavior of Bidentate Amidophosphido [NP]2-Ligands upon Coordination to Copper
Authors of publication	Mark W. Bezpalko; Bruce M. Foxman; Christine M. Thomas
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12329 - 12331
a	9.3693 ± 0.0007 Å
b	10.585 ± 0.0008 Å
c	14.842 ± 0.001 Å
α	82.895 ± 0.003°
β	82.387 ± 0.003°
γ	79.554 ± 0.004°
Cell volume	1427.27 ± 0.18 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0571
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for all reflections	0.0942
Weighted residual factors for significantly intense reflections	0.0895
Weighted residual factors for all reflections included in the refinement	0.0942
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4336664.cif
102671	2014-02-21	cif/ Adding structures of 4336664 via cif-deposit CGI script.	4336664.cif