Crystallography Open Database

Information card for entry 7032149

Preview

Coordinates	7032149.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H24 N P Si
Calculated formula	C21 H24 N P Si
SMILES	C[Si](C)(C)N=P(c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Phosphinimine-substituted boranes and borenium ions.
Authors of publication	Holthausen, Michael H.; Mallov, Ian; Stephan, Douglas W.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	40
Pages of publication	15201 - 15211
a	8.7098 ± 0.0007 Å
b	11.0404 ± 0.0011 Å
c	11.3544 ± 0.0011 Å
α	62.456 ± 0.005°
β	88.191 ± 0.006°
γ	87.019 ± 0.006°
Cell volume	966.74 ± 0.16 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 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	0.0827
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.0938
Weighted residual factors for all reflections included in the refinement	0.1064
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
180027 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/21.	7032149.cif
124846	2014-10-06	cif/ Updating files of 7032148, 7032149, 7032150, 7032151, 7032152, 7032153, 7032154, 7032155, 7032156, 7032157, 7032158, 7032159 Original log message: Adding full bibliography for 7032148--7032159.cif.	7032149.cif
122518	2014-08-27	cif/ Adding structures of 7032148, 7032149, 7032150, 7032151, 7032152, 7032153, 7032154, 7032155, 7032156, 7032157, 7032158, 7032159 via cif-deposit CGI script.	7032149.cif