Crystallography Open Database

Information card for entry 7702073

7702072 << 7702073 >> 7702074

Preview

Coordinates	7702073.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[NbBr4(DMPE)2]]
Formula	C12 H32 Br4 Nb P4
Calculated formula	C12 H32 Br4 Nb P4
Title of publication	Niobium tetrahalide complexes with neutral diphosphine ligands.
Authors of publication	Benjamin, Sophie L.; Chang, Yao-Pang; Hector, Andrew L.; Jura, Marek; Levason, William; Reid, Gillian; Stenning, Gavin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	19
Pages of publication	8192 - 8200
a	13.3974 ± 0.0009 Å
b	12.4285 ± 0.0009 Å
c	14.1808 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2361.2 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.025
Residual factor for significantly intense reflections	0.0221
Weighted residual factors for significantly intense reflections	0.0424
Weighted residual factors for all reflections included in the refinement	0.0435
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
234732 (current)	2019-11-23	cif/ Adding structures of 7702073, 7702074, 7702075, 7702076, 7702077, 7702078, 7702079 via cif-deposit CGI script.	7702073.cif