Crystallography Open Database

Information card for entry 7207508

7207507 << 7207508 >> 7207509

Preview

Coordinates	7207508.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H8 F8 I4 N
Calculated formula	C24 H8 F8 I4 N
Title of publication	Phosphorescent co-crystal assembled by 1,4-diiodotetrafluorobenzene with carbazole based on C‒I⋯π halogen bonding
Authors of publication	Gao, Hai Yue; Shen, Qian Jin; Zhao, Xiao Ran; Yan, Xiao Qing; Pang, Xue; Jin, Wei Jun
Journal of publication	Journal of Materials Chemistry
Year of publication	2012
Journal volume	22
Journal issue	12
Pages of publication	5336
a	5.9625 ± 0.0011 Å
b	9.3712 ± 0.0018 Å
c	12.051 ± 0.002 Å
α	75.207 ± 0.003°
β	88.706 ± 0.003°
γ	80.057 ± 0.003°
Cell volume	641.1 ± 0.2 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	0.041
Residual factor for significantly intense reflections	0.0325
Weighted residual factors for significantly intense reflections	0.0746
Weighted residual factors for all reflections included in the refinement	0.0789
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180406 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/75.	7207508.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207508.cif
37714	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7207508 via cif-deposit CGI script.	7207508.cif