Crystallography Open Database

Information card for entry 7701990

7701989 << 7701990 >> 7701991

Preview

Coordinates	7701990.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H41 Br N Ni O P
Calculated formula	C40 H41 Br N Ni O P
Title of publication	Neutral, cationic and anionic organonickel and -palladium complexes supported by iminophosphine/phosphinoenaminato ligands.
Authors of publication	Santiago, Tomás G; Urbaneja, Carmen; Álvarez, Eleuterio; Ávila, Elena; Palma, Pilar; Cámpora, Juan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	2
Pages of publication	322 - 335
a	9.9701 ± 0.0002 Å
b	14.6823 ± 0.0003 Å
c	12.4003 ± 0.0003 Å
α	90°
β	108.994 ± 0.001°
γ	90°
Cell volume	1716.37 ± 0.07 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0269
Residual factor for significantly intense reflections	0.0236
Weighted residual factors for significantly intense reflections	0.0549
Weighted residual factors for all reflections included in the refinement	0.056
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
247733 (current)	2020-02-04	cif/ Updating files of 7701989, 7701990, 7701991, 7701992, 7701993 Original log message: Adding full bibliography for 7701989--7701993.cif.	7701990.cif
231109	2019-11-21	cif/ Adding structures of 7701989, 7701990, 7701991, 7701992, 7701993 via cif-deposit CGI script.	7701990.cif