Crystallography Open Database

Information card for entry 4318545

Preview

Coordinates	4318545.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H47 N3 O13.5 P
Calculated formula	C27 H36 N3 O13.5 P
Title of publication	Pseudoheptacoordination and Pseudohexacoordination in Tris(2-N,N-dimethylbenzylamino)phosphane
Authors of publication	A. Chandrasekaran; Natalya V. Timosheva; Roberta O. Day; Robert R. Holmes
Journal of publication	Inorganic Chemistry
Year of publication	2002
Journal volume	41
Pages of publication	5235 - 5240
a	11.1443 ± 0.0001 Å
b	25.4053 ± 0.0004 Å
c	12.7431 ± 0.0002 Å
α	90°
β	113.357 ± 0.0006°
γ	90°
Cell volume	3312.23 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1236
Residual factor for significantly intense reflections	0.1042
Weighted residual factors for significantly intense reflections	0.2945
Weighted residual factors for all reflections included in the refinement	0.3145
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4318545.html