Crystallography Open Database

Information card for entry 7703122

Preview

Coordinates	7703122.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H24 B F2 N4 O
Calculated formula	C36 H25 B F2 N4 O
Title of publication	Photophysical properties of some novel tetraphenylimidazole derived BODIPY based fluorescent molecular rotors.
Authors of publication	Dwivedi, Bhupendra Kumar; Singh, Vishwa Deepak; Kumar, Yogesh; Pandey, Daya Shankar
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	2
Pages of publication	438 - 452
a	10.208 ± 0.002 Å
b	10.769 ± 0.002 Å
c	14.485 ± 0.003 Å
α	111.348 ± 0.005°
β	90.21 ± 0.005°
γ	97.478 ± 0.005°
Cell volume	1468.2 ± 0.5 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.3119
Residual factor for significantly intense reflections	0.1069
Weighted residual factors for significantly intense reflections	0.1635
Weighted residual factors for all reflections included in the refinement	0.2264
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
246457 (current)	2020-01-03	cif/ Adding structures of 7703122, 7703123, 7703124, 7703125 via cif-deposit CGI script.	7703122.cif