Crystallography Open Database

Information card for entry 4088038

Preview

Coordinates	4088038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H36 P2 Te
Calculated formula	C48 H36 P2 Te
SMILES	[Te](c1c2c3c(cc1)CCc3ccc2P(c1ccccc1)c1ccccc1)c1c2c(P(c3ccccc3)c3ccccc3)ccc3c2c(cc1)CC3
Title of publication	Intramolecularly Group 15 Stabilized Aryltellurenyl Halides and Triflates
Authors of publication	Do, Truong Giang; Hupf, Emanuel; Nordheider, Andreas; Lork, Enno; Slawin, Alexandra M. Z.; Makarov, Sergey G.; Ketkov, Sergey Yu.; Mebs, Stefan; Woollins, J. Derek; Beckmann, Jens
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	21
Pages of publication	5341
a	11.7394 ± 0.0003 Å
b	12.5066 ± 0.0003 Å
c	14.3469 ± 0.0003 Å
α	91.146 ± 0.001°
β	101.003 ± 0.001°
γ	117.065 ± 0.001°
Cell volume	1827.45 ± 0.08 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.045
Residual factor for significantly intense reflections	0.0309
Weighted residual factors for significantly intense reflections	0.0671
Weighted residual factors for all reflections included in the refinement	0.0718
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
237228 (current)	2019-11-24	cif/ Adding structures of 4088031, 4088032, 4088033, 4088034, 4088035, 4088036, 4088037, 4088038, 4088039, 4088040, 4088041, 4088042, 4088043, 4088044, 4088045, 4088046 via cif-deposit CGI script.	4088038.cif